#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kui s ILE 356 N 0.00 4.23 0.28 -0.61 1.10 -1.26 -5.00 121.20 119.95 2kui s ILE 356 Ca 0.00 1.50 0.08 0.00 -0.51 0.00 0.00 60.65 61.72 2kui s ILE 356 Cb 0.00 -3.96 -0.04 0.00 0.15 0.00 0.00 42.46 38.61 2kui s ILE 356 CO 0.00 -0.12 0.10 -0.89 -2.11 0.00 0.00 174.94 171.92 2kui s THR 357 N 3.39 3.62 -0.67 4.00 2.01 -1.26 -5.06 115.64 121.66 2kui s THR 357 Ca 0.56 -1.70 0.03 0.00 0.31 0.00 0.00 61.69 60.89 2kui s THR 357 Cb -0.23 -3.04 0.16 0.00 0.01 0.00 0.00 72.50 69.41 2kui s THR 357 CO 0.16 -0.31 0.47 0.00 -0.69 0.00 0.00 174.62 174.24 2kui s ARG 358 N -3.78 2.45 0.56 4.92 3.03 -1.26 -5.08 118.95 119.80 2kui s ARG 358 Ca 0.34 -3.08 -0.20 0.00 2.03 0.00 0.00 55.73 54.82 2kui s ARG 358 Cb -0.06 -3.50 -0.05 0.00 -1.03 0.00 0.00 34.95 30.32 2kui s ARG 358 CO 0.22 -1.23 1.19 -0.51 -1.13 0.00 0.00 175.30 173.85 2kui s ASP 359 N -0.79 5.43 0.09 -2.89 1.01 -1.26 -4.95 116.67 113.31 2kui s ASP 359 Ca 0.22 2.36 0.09 0.00 0.71 0.00 0.00 52.55 55.93 2kui s ASP 359 Cb -0.12 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.18 2kui s ASP 359 CO -0.10 -1.43 -0.20 0.68 0.21 0.00 0.00 175.17 174.33 2kui s VAL 360 N -1.61 2.71 -0.14 -1.27 -7.23 0.35 -4.71 120.40 108.51 2kui s VAL 360 Ca 0.74 -1.41 -0.16 0.00 -1.81 0.00 0.00 61.98 59.34 2kui s VAL 360 Cb -0.29 -2.19 -0.04 0.00 0.56 0.00 0.00 36.38 34.41 2kui s VAL 360 CO 0.33 0.20 0.38 -1.58 -0.31 0.00 0.00 175.10 174.12 2kui s GLN 361 N -1.83 4.30 -0.13 4.82 -0.44 -1.26 -0.06 119.66 125.05 2kui s GLN 361 Ca 0.16 0.26 -0.14 0.00 -2.50 0.00 0.00 55.36 53.15 2kui s GLN 361 Cb -0.10 -3.43 -0.05 0.00 -1.64 0.00 0.00 33.01 27.79 2kui s GLN 361 CO 0.07 0.20 0.31 0.08 0.50 0.00 0.00 175.29 176.45 2kui s VAL 362 N 0.54 5.28 0.06 1.34 1.01 -0.43 -4.99 120.40 123.21 2kui s VAL 362 Ca 0.21 0.59 -0.30 0.00 0.00 0.00 0.00 61.98 62.47 2kui s VAL 362 Cb -0.14 -3.64 -0.09 0.00 0.00 0.00 0.00 36.38 32.51 2kui s VAL 362 CO 0.07 0.43 1.85 -2.84 0.00 0.00 0.00 175.10 174.61 2kui s PRO 363 N 0.16 4.15 -0.42 2.72 0.02 -1.26 -4.29 135.00 136.08 2kui s PRO 363 Ca 0.18 2.53 -0.22 0.00 0.02 0.00 0.00 61.00 63.51 2kui s PRO 363 Cb -0.13 -3.88 0.02 0.00 0.02 0.00 0.00 34.50 30.53 2kui s PRO 363 CO 0.05 -0.88 0.74 0.16 -0.33 0.00 0.00 177.00 176.75 2kui s ASP 364 N 3.49 6.42 -0.11 2.53 -4.77 -1.26 -4.92 116.67 118.06 2kui s ASP 364 Ca 0.83 -0.03 0.03 0.00 -3.30 0.00 0.00 52.55 50.08 2kui s ASP 364 Cb -0.43 -2.37 0.26 0.00 -1.09 0.00 0.00 42.92 39.29 2kui s ASP 364 CO 0.37 -0.82 1.08 0.52 0.70 0.00 0.00 175.17 177.02 2kui n VAL 365 N 5.96 1.26 -1.60 2.11 0.31 -1.26 -4.92 118.33 120.18 2kui n VAL 365 Ca 0.01 -0.54 -0.41 0.00 -0.01 0.00 0.00 64.34 63.39 2kui n VAL 365 Cb 0.48 -0.58 0.02 0.00 -0.91 0.00 0.00 33.84 32.84 2kui n VAL 365 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 2kui n ARG 366 N 0.11 1.27 0.00 5.55 -4.01 -1.26 -2.95 116.66 115.36 2kui n ARG 366 Ca 0.14 0.46 0.00 0.00 -1.04 0.00 0.00 57.85 57.41 2kui n ARG 366 Cb 0.70 -2.04 0.00 0.00 -3.04 0.00 0.00 32.46 28.08 2kui n ARG 366 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2kui n GLY 367 N 1.22 1.67 0.00 2.89 0.00 0.99 -4.94 105.19 107.02 2kui n GLY 367 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2kui n GLY 367 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kui n GLN 368 N -2.00 0.00 -3.75 1.61 6.02 -1.15 -4.87 117.38 113.24 2kui n GLN 368 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 56.94 2kui n GLN 368 Cb 0.00 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.24 2kui n GLN 368 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2kui s SER 369 N -0.79 -0.23 0.20 1.08 1.04 -1.26 -4.14 113.70 109.60 2kui s SER 369 Ca 0.00 -0.41 -0.09 0.00 0.48 0.00 0.00 55.95 55.93 2kui s SER 369 Cb 0.00 0.54 0.13 0.00 0.10 0.00 0.00 66.02 66.79 2kui s SER 369 CO 0.00 -0.99 1.76 0.28 0.98 0.00 0.00 173.24 175.26 2kui h SER 370 N 2.00 1.02 -0.35 7.02 0.02 -1.13 -0.72 113.55 121.41 2kui h SER 370 Ca -0.23 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.53 2kui h SER 370 Cb 1.24 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.50 2kui h SER 370 CO 0.26 0.92 0.15 0.00 -1.14 0.00 0.00 176.83 177.02 2kui h ALA 371 N 1.14 0.45 -0.57 3.77 0.00 -1.96 0.22 119.26 122.31 2kui h ALA 371 Ca 0.24 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 2kui h ALA 371 Cb 0.23 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2kui h ALA 371 CO -0.02 0.03 0.18 -0.44 0.00 0.00 0.00 179.25 179.00 2kui h ASP 372 N 0.42 0.84 0.01 0.00 3.32 -1.90 0.11 116.42 119.22 2kui h ASP 372 Ca 0.12 -0.21 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 2kui h ASP 372 Cb 0.15 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.48 2kui h ASP 372 CO -0.01 0.82 -0.00 0.00 -1.72 0.00 0.00 179.24 178.33 2kui h ALA 373 N 1.05 -0.01 -0.86 3.45 0.00 -0.84 -2.40 119.26 119.65 2kui h ALA 373 Ca 0.18 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2kui h ALA 373 Cb 0.29 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2kui h ALA 373 CO -0.01 -0.34 0.45 0.82 0.00 0.00 0.00 179.25 180.17 2kui h ILE 374 N -0.35 1.26 -0.33 0.00 2.04 -0.51 -0.32 117.51 119.31 2kui h ILE 374 Ca -0.00 -0.68 0.02 0.00 1.00 0.00 0.00 64.86 65.20 2kui h ILE 374 Cb 0.34 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 2kui h ILE 374 CO 0.00 0.30 0.17 0.00 0.00 0.00 0.00 178.15 178.63 2kui h ALA 375 N 1.24 0.40 -0.13 1.87 0.00 -0.72 0.25 119.26 122.17 2kui h ALA 375 Ca 0.30 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 2kui h ALA 375 Cb 0.07 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2kui h ALA 375 CO -0.04 -0.19 0.00 1.15 0.00 0.00 0.00 179.25 180.17 2kui h THR 376 N 0.36 1.25 -0.47 0.00 2.02 -1.10 -2.06 112.91 112.91 2kui h THR 376 Ca 0.13 -0.80 -0.01 0.00 0.77 0.00 0.00 66.41 66.50 2kui h THR 376 Cb 0.03 1.53 -0.02 0.00 -1.74 0.00 0.00 68.15 67.94 2kui h THR 376 CO -0.08 0.23 0.25 -0.07 0.37 0.00 0.00 175.52 176.22 2kui h LEU 377 N -0.04 0.60 -0.57 2.58 3.38 -0.68 -1.58 115.31 119.00 2kui h LEU 377 Ca 0.04 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 2kui h LEU 377 Cb 0.35 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2kui h LEU 377 CO 0.01 0.53 0.22 -0.61 0.09 0.00 0.00 178.44 178.68 2kui h GLN 378 N 0.62 0.86 0.00 1.13 5.75 -0.50 0.10 115.11 123.08 2kui h GLN 378 Ca 0.17 -0.16 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2kui h GLN 378 Cb 0.08 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.49 2kui h GLN 378 CO -0.02 0.75 0.00 -0.91 -2.65 0.00 0.00 178.83 175.99 2kui h ASN 379 N 0.79 0.00 0.72 -0.69 2.35 -1.03 -1.54 115.58 116.18 2kui h ASN 379 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 2kui h ASN 379 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 2kui h ASN 379 CO -0.01 0.00 -0.66 0.54 -1.65 0.00 0.00 177.43 175.65 2kui n ARG 380 N -2.69 0.23 0.00 0.81 5.12 -0.62 -4.93 116.66 114.57 2kui n ARG 380 Ca 0.01 0.05 0.00 0.00 -1.93 0.00 0.00 57.85 55.99 2kui n ARG 380 Cb 0.28 -1.63 0.00 0.00 -1.16 0.00 0.00 32.46 29.95 2kui n ARG 380 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2kui n GLY 381 N 1.38 1.00 3.89 -0.13 0.00 -0.58 -4.91 105.19 105.85 2kui n GLY 381 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 2kui n GLY 381 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kui s PHE 382 N -2.00 3.50 0.15 1.61 0.40 0.27 -4.14 117.98 117.77 2kui s PHE 382 Ca 0.00 0.88 0.05 0.00 -0.60 0.00 0.00 56.93 57.26 2kui s PHE 382 Cb 0.00 -2.32 -0.04 0.00 0.51 0.00 0.00 43.02 41.17 2kui s PHE 382 CO 0.00 -0.11 0.13 0.15 0.70 0.00 0.00 175.22 176.09 2kui s LYS 383 N -4.10 2.90 0.08 0.44 -0.14 0.23 -3.98 119.74 115.16 2kui s LYS 383 Ca 0.48 -0.84 0.07 0.00 -1.36 0.00 0.00 55.97 54.32 2kui s LYS 383 Cb -0.10 -2.66 -0.03 0.00 -1.68 0.00 0.00 37.83 33.36 2kui s LYS 383 CO 0.36 0.50 -0.18 0.96 -0.76 0.00 0.00 175.35 176.23 2kui s ILE 384 N -1.70 1.42 -0.13 2.17 -0.00 -1.26 -0.57 121.20 121.13 2kui s ILE 384 Ca 0.31 -1.37 0.01 0.00 -0.00 0.00 0.00 60.65 59.61 2kui s ILE 384 Cb -0.10 -1.31 -0.00 0.00 -0.00 0.00 0.00 42.46 41.05 2kui s ILE 384 CO 0.23 -0.09 -0.18 -0.60 -0.00 0.00 0.00 174.94 174.31 2kui s ARG 385 N -1.70 3.21 -0.13 0.37 3.52 0.88 -4.81 118.95 120.29 2kui s ARG 385 Ca 0.03 -0.77 0.02 0.00 -0.13 0.00 0.00 55.73 54.87 2kui s ARG 385 Cb -0.10 -2.52 0.01 0.00 -1.56 0.00 0.00 34.95 30.78 2kui s ARG 385 CO 0.03 0.12 -0.18 0.99 -0.81 0.00 0.00 175.30 175.45 2kui s THR 386 N 0.53 1.76 -0.22 4.11 2.01 -1.26 -0.04 115.64 122.53 2kui s THR 386 Ca -0.11 -0.79 -0.04 0.00 0.31 0.00 0.00 61.69 61.06 2kui s THR 386 Cb -0.16 -1.58 -0.01 0.00 0.01 0.00 0.00 72.50 70.76 2kui s THR 386 CO 0.04 0.49 -0.04 -0.22 -0.69 0.00 0.00 174.62 174.21 2kui s LEU 387 N 0.96 2.93 -0.08 4.42 1.98 0.46 -4.96 118.68 124.39 2kui s LEU 387 Ca -0.06 -0.40 0.04 0.00 -2.89 0.00 0.00 54.13 50.82 2kui s LEU 387 Cb -0.15 -1.74 -0.02 0.00 0.66 0.00 0.00 46.19 44.94 2kui s LEU 387 CO -0.03 -0.03 -0.19 0.00 -1.89 0.00 0.00 176.35 174.22 2kui s GLN 388 N 1.48 2.79 0.02 1.98 0.00 -1.26 -0.34 119.66 124.33 2kui s GLN 388 Ca 0.06 -0.79 0.02 0.00 -0.00 0.00 0.00 55.36 54.64 2kui s GLN 388 Cb -0.14 -2.35 -0.01 0.00 0.00 0.00 0.00 33.01 30.50 2kui s GLN 388 CO -0.03 0.39 -0.07 0.15 0.00 0.00 0.00 175.29 175.73 2kui s LYS 389 N -0.15 0.49 0.64 9.60 1.02 -0.38 -4.99 119.74 125.97 2kui s LYS 389 Ca -0.02 -0.48 -0.16 0.00 0.02 0.00 0.00 55.97 55.33 2kui s LYS 389 Cb -0.14 -0.36 -0.01 0.00 -0.52 0.00 0.00 37.83 36.80 2kui s LYS 389 CO 0.04 0.08 1.13 -2.14 -0.92 0.00 0.00 175.35 173.54 2kui s PRO 390 N -0.85 2.83 0.09 -1.68 0.02 -1.26 -0.22 135.00 133.93 2kui s PRO 390 Ca -0.04 1.51 -0.31 0.00 0.02 0.00 0.00 61.00 62.18 2kui s PRO 390 Cb -0.06 -1.94 -0.09 0.00 0.02 0.00 0.00 34.50 32.42 2kui s PRO 390 CO 0.00 -1.25 1.74 0.34 -0.33 0.00 0.00 177.00 177.51 2kui s ASP 391 N -2.29 6.51 -0.13 2.53 2.15 0.37 -4.77 116.67 121.05 2kui s ASP 391 Ca 0.70 2.62 0.11 0.00 0.43 0.00 0.00 52.55 56.40 2kui s ASP 391 Cb -0.23 -2.56 0.25 0.00 -0.30 0.00 0.00 42.92 40.08 2kui s ASP 391 CO 0.39 -0.95 1.21 -1.20 -0.17 0.00 0.00 175.17 174.44 2kui n SER 392 N 5.71 -0.51 -0.75 -0.34 7.64 -1.26 -4.70 113.62 119.41 2kui n SER 392 Ca 0.17 -2.07 0.00 0.00 1.01 0.00 0.00 58.87 57.98 2kui n SER 392 Cb 0.39 0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.82 2kui n SER 392 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2kui n THR 393 N -0.46 0.00 -4.31 0.44 -1.04 -1.26 -5.11 114.28 102.54 2kui n THR 393 Ca -0.15 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.57 2kui n THR 393 Cb 0.84 -1.96 -0.11 0.00 -1.82 0.00 0.00 70.33 67.28 2kui n THR 393 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 2kui s ILE 394 N -2.89 2.87 0.23 12.58 -0.00 -1.26 -5.11 121.20 127.63 2kui s ILE 394 Ca 0.00 -1.61 -0.31 0.00 -0.00 0.00 0.00 60.65 58.74 2kui s ILE 394 Cb 0.00 -2.35 -0.14 0.00 -0.00 0.00 0.00 42.46 39.96 2kui s ILE 394 CO 0.00 0.02 1.18 -2.65 -0.00 0.00 0.00 174.94 173.49 2kui n PRO 395 N 0.55 1.48 -0.67 0.37 -0.02 -1.26 -4.79 135.00 130.66 2kui n PRO 395 Ca -0.14 0.52 -0.30 0.00 -2.02 0.00 0.00 63.50 61.56 2kui n PRO 395 Cb 0.54 -2.02 0.19 0.00 -0.02 0.00 0.00 33.50 32.18 2kui n PRO 395 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2kui s PRO 396 N -0.83 0.42 0.00 0.52 0.04 -1.26 -2.24 135.00 131.65 2kui s PRO 396 Ca 0.66 1.31 0.00 0.00 0.04 0.00 0.00 61.00 63.01 2kui s PRO 396 Cb -0.74 -1.68 0.00 0.00 0.04 0.00 0.00 34.50 32.12 2kui s PRO 396 CO 0.54 -2.96 0.84 -0.40 0.04 0.00 0.00 177.00 175.06 2kui n ASP 397 N -4.44 0.00 -4.60 6.66 5.75 -1.24 -4.25 116.55 114.43 2kui n ASP 397 Ca 0.09 0.35 -0.42 0.00 -0.01 0.00 0.00 54.79 54.80 2kui n ASP 397 Cb 0.53 -0.35 -0.04 0.00 -1.03 0.00 0.00 41.12 40.22 2kui n ASP 397 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 2kui s HIS 398 N -2.68 3.10 -0.08 2.11 3.76 -1.26 -0.49 115.29 119.74 2kui s HIS 398 Ca 0.00 0.69 -0.30 0.00 -0.15 0.00 0.00 55.06 55.30 2kui s HIS 398 Cb 0.00 -3.53 -0.05 0.00 1.11 0.00 0.00 32.58 30.11 2kui s HIS 398 CO 0.00 -0.78 1.60 0.14 -0.85 0.00 0.00 174.74 174.85 2kui s VAL 399 N 3.30 3.69 -0.00 -0.90 -7.23 -1.26 -4.86 120.40 113.14 2kui s VAL 399 Ca 0.35 0.83 0.10 0.00 -1.81 0.00 0.00 61.98 61.45 2kui s VAL 399 Cb -0.13 -3.55 -0.23 0.00 0.56 0.00 0.00 36.38 33.04 2kui s VAL 399 CO 0.18 -0.09 0.83 0.40 -0.31 0.00 0.00 175.10 176.10 2kui h ILE 400 N 5.62 1.08 -4.11 -0.62 5.03 -1.94 0.28 117.51 122.85 2kui h ILE 400 Ca -0.37 -2.89 -0.16 0.00 -0.12 0.00 0.00 64.86 61.32 2kui h ILE 400 Cb 1.17 2.55 -0.11 0.00 -3.03 0.00 0.00 36.82 37.39 2kui h ILE 400 CO 0.96 0.64 -0.34 -0.83 -0.68 0.00 0.00 178.15 177.90 2kui s GLY 401 N -5.01 1.04 0.44 5.37 0.00 -1.26 -4.49 107.32 103.41 2kui s GLY 401 Ca -0.04 -1.30 0.02 0.00 0.00 0.00 0.00 44.72 43.40 2kui s GLY 401 CO 0.82 -1.00 0.18 -1.30 0.00 0.00 0.00 173.10 171.81 2kui n THR 402 N -0.36 0.00 -3.88 0.90 -2.24 -1.26 -4.83 114.28 102.61 2kui n THR 402 Ca 0.00 -1.91 -0.36 0.00 -2.27 0.00 0.00 64.05 59.52 2kui n THR 402 Cb 0.64 0.13 -0.07 0.00 -2.10 0.00 0.00 70.33 68.93 2kui n THR 402 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2kui s ASP 403 N -3.52 6.23 0.63 3.42 2.15 -1.26 -4.97 116.67 119.35 2kui s ASP 403 Ca 0.14 0.37 0.22 0.00 0.43 0.00 0.00 52.55 53.71 2kui s ASP 403 Cb -0.01 -2.03 1.09 0.00 -0.30 0.00 0.00 42.92 41.67 2kui s ASP 403 CO 0.09 0.34 1.59 -0.65 -0.17 0.00 0.00 175.17 176.36 2kui h PRO 404 N 5.51 0.00 0.00 4.34 0.11 -1.98 0.72 132.00 140.70 2kui h PRO 404 Ca -0.50 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 2kui h PRO 404 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2kui h PRO 404 CO 0.63 0.00 -0.22 0.00 -0.21 0.00 0.00 178.00 178.20 2kui h ALA 405 N 0.92 1.57 0.18 -0.75 0.00 -1.92 -1.39 119.26 117.86 2kui h ALA 405 Ca 0.16 -0.20 -0.34 0.00 0.00 0.00 0.00 54.91 54.53 2kui h ALA 405 Cb 1.55 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 19.31 2kui h ALA 405 CO -0.00 0.28 -1.67 0.00 0.00 0.00 0.00 179.25 177.86 2kui h ALA 406 N 1.78 0.14 0.00 0.00 0.00 -1.17 -3.35 119.26 116.65 2kui h ALA 406 Ca -0.00 -1.11 0.00 0.00 0.00 0.00 0.00 54.91 53.79 2kui h ALA 406 Cb 0.41 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2kui h ALA 406 CO 0.03 0.96 0.00 0.09 0.00 0.00 0.00 179.25 180.33 2kui n ASN 407 N -3.67 0.19 -4.93 0.00 4.13 -1.07 -1.31 115.26 108.60 2kui n ASN 407 Ca -0.24 0.53 -0.24 0.00 1.68 0.00 0.00 54.58 56.31 2kui n ASN 407 Cb 1.04 -0.57 -0.03 0.00 -1.54 0.00 0.00 39.78 38.68 2kui n ASN 407 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2kui s THR 408 N -3.04 5.16 -0.34 3.41 2.01 -0.55 -4.82 115.64 117.47 2kui s THR 408 Ca 0.11 -0.91 -0.29 0.00 0.31 0.00 0.00 61.69 60.92 2kui s THR 408 Cb 0.15 -3.73 0.00 0.00 0.01 0.00 0.00 72.50 68.93 2kui s THR 408 CO 0.48 -0.22 1.40 -0.44 -0.69 0.00 0.00 174.62 175.15 2kui s SER 409 N -3.59 6.47 0.31 3.53 0.01 -1.26 -3.98 113.70 115.19 2kui s SER 409 Ca 0.34 1.10 0.04 0.00 1.31 0.00 0.00 55.95 58.73 2kui s SER 409 Cb -0.10 -2.54 -0.06 0.00 0.21 0.00 0.00 66.02 63.53 2kui s SER 409 CO 0.28 -1.27 0.05 0.68 0.41 0.00 0.00 173.24 173.39 2kui s VAL 410 N 4.99 1.17 0.13 3.43 -7.23 0.91 -4.67 120.40 119.14 2kui s VAL 410 Ca 0.61 -2.01 -0.30 0.00 -1.81 0.00 0.00 61.98 58.47 2kui s VAL 410 Cb -0.16 -2.73 -0.07 0.00 0.56 0.00 0.00 36.38 33.97 2kui s VAL 410 CO 0.28 -0.04 1.19 -0.55 -0.31 0.00 0.00 175.10 175.67 2kui s SER 411 N -3.46 7.10 0.34 4.85 0.15 -1.26 -0.49 113.70 120.93 2kui s SER 411 Ca 0.36 2.13 -0.29 0.00 0.70 0.00 0.00 55.95 58.85 2kui s SER 411 Cb 0.08 -2.59 -0.11 0.00 -1.71 0.00 0.00 66.02 61.69 2kui s SER 411 CO 0.15 -0.39 1.48 0.00 1.20 0.00 0.00 173.24 175.67 2kui s ALA 412 N 0.38 3.61 0.00 5.45 0.00 -1.26 -3.62 121.76 126.32 2kui s ALA 412 Ca 0.55 1.51 0.00 0.00 0.00 0.00 0.00 51.96 54.02 2kui s ALA 412 Cb -0.31 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.22 2kui s ALA 412 CO 0.33 -0.95 0.00 0.41 0.00 0.00 0.00 175.76 175.55 2kui n GLY 413 N 1.03 1.01 1.74 0.00 0.00 -1.26 -5.03 105.19 102.68 2kui n GLY 413 Ca 0.03 -0.24 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 2kui n GLY 413 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kui n ASP 414 N 0.53 1.15 -4.33 1.61 -0.08 -1.24 -4.69 116.55 109.50 2kui n ASP 414 Ca 0.00 -1.73 -0.36 0.00 -1.51 0.00 0.00 54.79 51.19 2kui n ASP 414 Cb 0.17 -0.15 -0.13 0.00 2.34 0.00 0.00 41.12 43.35 2kui n ASP 414 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2kui s GLU 415 N -3.13 3.15 -0.20 -0.67 2.02 -1.25 -0.60 118.70 118.01 2kui s GLU 415 Ca 0.24 -0.80 -0.11 0.00 0.02 0.00 0.00 54.97 54.32 2kui s GLU 415 Cb -0.02 -3.24 -0.05 0.00 0.10 0.00 0.00 34.13 30.92 2kui s GLU 415 CO 0.15 -0.37 0.16 0.42 0.02 0.00 0.00 175.26 175.64 2kui s ILE 416 N 1.48 5.38 -0.10 -1.63 -1.09 0.27 -4.80 121.20 120.71 2kui s ILE 416 Ca 0.03 0.25 -0.18 0.00 -2.23 0.00 0.00 60.65 58.52 2kui s ILE 416 Cb -0.16 -3.50 -0.04 0.00 -1.58 0.00 0.00 42.46 37.17 2kui s ILE 416 CO 0.00 0.42 0.48 -0.89 -1.23 0.00 0.00 174.94 173.72 2kui s THR 417 N 0.50 5.16 -0.05 2.92 2.01 -1.26 -0.09 115.64 124.83 2kui s THR 417 Ca 0.09 0.96 0.05 0.00 0.31 0.00 0.00 61.69 63.11 2kui s THR 417 Cb -0.12 -3.82 -0.01 0.00 0.01 0.00 0.00 72.50 68.57 2kui s THR 417 CO -0.00 0.35 -0.21 0.54 -0.69 0.00 0.00 174.62 174.62 2kui s VAL 418 N 0.43 1.71 -0.20 3.82 0.11 0.94 -4.04 120.40 123.17 2kui s VAL 418 Ca 0.26 -0.87 -0.06 0.00 -2.93 0.00 0.00 61.98 58.38 2kui s VAL 418 Cb -0.15 -1.46 -0.03 0.00 -1.53 0.00 0.00 36.38 33.21 2kui s VAL 418 CO 0.11 0.48 0.02 0.54 -3.33 0.00 0.00 175.10 172.92 2kui s ASN 419 N -0.02 5.03 -0.07 3.54 2.20 -1.26 -0.40 114.94 123.96 2kui s ASN 419 Ca -0.05 -0.15 0.03 0.00 -0.94 0.00 0.00 52.86 51.76 2kui s ASN 419 Cb -0.13 -1.87 0.01 0.00 -2.00 0.00 0.00 41.25 37.26 2kui s ASN 419 CO 0.03 0.07 -0.17 0.54 -2.94 0.00 0.00 177.10 174.64 2kui s VAL 420 N 0.97 1.45 -0.15 3.54 0.11 0.54 -4.84 120.40 122.01 2kui s VAL 420 Ca 0.02 -0.68 -0.04 0.00 -2.93 0.00 0.00 61.98 58.35 2kui s VAL 420 Cb -0.14 -1.28 -0.03 0.00 -1.53 0.00 0.00 36.38 33.40 2kui s VAL 420 CO 0.02 0.42 -0.01 -0.55 -3.33 0.00 0.00 175.10 171.65 2kui s SER 421 N 0.41 5.04 0.46 3.54 0.15 -0.95 -1.25 113.70 121.09 2kui s SER 421 Ca -0.13 -0.05 -0.07 0.00 0.70 0.00 0.00 55.95 56.41 2kui s SER 421 Cb -0.15 -1.77 -0.04 0.00 -1.71 0.00 0.00 66.02 62.34 2kui s SER 421 CO 0.05 0.20 0.77 0.42 1.20 0.00 0.00 173.24 175.88 2kui s THR 422 N 0.19 4.88 0.00 6.45 -4.23 0.70 -3.64 115.64 119.98 2kui s THR 422 Ca -0.00 0.30 0.00 0.00 -1.18 0.00 0.00 61.69 60.81 2kui s THR 422 Cb -0.13 -3.83 0.00 0.00 1.34 0.00 0.00 72.50 69.88 2kui s THR 422 CO 0.02 -0.75 0.00 0.61 -0.54 0.00 0.00 174.62 173.96 2kui n GLY 423 N -1.97 -2.66 3.76 3.99 0.00 -1.26 -0.48 105.19 106.57 2kui n GLY 423 Ca 0.01 -1.29 -0.34 0.00 0.00 0.00 0.00 46.02 44.40 2kui n GLY 423 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2kui s PRO 424 N 0.00 2.79 0.60 1.61 0.04 -1.26 -0.87 135.00 137.92 2kui s PRO 424 Ca 0.00 1.55 -0.05 0.00 0.04 0.00 0.00 61.00 62.53 2kui s PRO 424 Cb 0.00 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.62 2kui s PRO 424 CO 0.00 -1.28 0.90 -1.21 0.04 0.00 0.00 177.00 175.45 2kui s GLU 425 N -3.83 2.76 -0.04 4.56 2.02 -1.26 -4.88 118.70 118.03 2kui s GLU 425 Ca 0.70 -0.13 0.02 0.00 0.02 0.00 0.00 54.97 55.58 2kui s GLU 425 Cb -0.24 -2.28 0.01 0.00 0.10 0.00 0.00 34.13 31.72 2kui s GLU 425 CO 0.39 -0.78 -0.08 -1.14 0.02 0.00 0.00 175.26 173.67 2kui s GLN 426 N -5.00 1.06 0.21 1.61 0.74 -1.26 -3.48 119.66 113.53 2kui s GLN 426 Ca 0.55 -0.24 0.10 0.00 0.05 0.00 0.00 55.36 55.82 2kui s GLN 426 Cb -0.11 -0.97 -0.04 0.00 1.10 0.00 0.00 33.01 32.99 2kui s GLN 426 CO 0.44 0.01 -0.20 1.03 -0.55 0.00 0.00 175.29 176.02 2kui s ARG 427 N 0.61 1.45 0.18 1.67 1.81 0.30 -4.88 118.95 120.10 2kui s ARG 427 Ca -0.10 -1.55 -0.26 0.00 -1.72 0.00 0.00 55.73 52.10 2kui s ARG 427 Cb -0.13 -1.56 -0.08 0.00 -0.45 0.00 0.00 34.95 32.73 2kui s ARG 427 CO 0.01 0.31 0.81 -1.83 -0.68 0.00 0.00 175.30 173.92 2kui s GLU 428 N -3.04 4.63 -0.16 3.54 -1.05 -1.26 0.28 118.70 121.64 2kui s GLU 428 Ca 0.21 1.23 -0.29 0.00 -0.15 0.00 0.00 54.97 55.97 2kui s GLU 428 Cb -0.06 -3.27 -0.01 0.00 -0.44 0.00 0.00 34.13 30.36 2kui s GLU 428 CO 0.10 0.56 1.07 0.42 0.95 0.00 0.00 175.26 178.36 2kui s ILE 429 N -1.15 4.62 0.33 1.83 1.01 -0.74 -4.90 121.20 122.20 2kui s ILE 429 Ca 0.37 1.93 -0.28 0.00 0.00 0.00 0.00 60.65 62.67 2kui s ILE 429 Cb -0.24 -4.24 -0.10 0.00 0.01 0.00 0.00 42.46 37.89 2kui s ILE 429 CO 0.27 -0.09 1.21 -2.16 0.00 0.00 0.00 174.94 174.18 2kui s PRO 430 N 2.70 4.38 0.17 2.79 0.04 -1.26 -4.45 135.00 139.38 2kui s PRO 430 Ca 0.48 2.01 0.03 0.00 0.04 0.00 0.00 61.00 63.56 2kui s PRO 430 Cb -0.18 -3.03 -0.03 0.00 0.04 0.00 0.00 34.50 31.30 2kui s PRO 430 CO 0.13 -0.09 0.28 0.16 0.04 0.00 0.00 177.00 177.52 2kui s ASP 431 N -0.74 6.21 0.26 6.66 -4.77 -1.26 -4.92 116.67 118.12 2kui s ASP 431 Ca 0.49 0.11 -0.14 0.00 -3.30 0.00 0.00 52.55 49.71 2kui s ASP 431 Cb -0.35 -1.83 0.00 0.00 -1.09 0.00 0.00 42.92 39.65 2kui s ASP 431 CO 0.46 0.03 0.53 0.54 0.70 0.00 0.00 175.17 177.43 2kui s VAL 432 N -1.80 0.00 0.43 2.11 0.11 -1.26 -5.07 120.40 114.92 2kui s VAL 432 Ca 0.34 -1.34 -0.23 0.00 -2.93 0.00 0.00 61.98 57.82 2kui s VAL 432 Cb -0.10 -2.23 -0.08 0.00 -1.53 0.00 0.00 36.38 32.43 2kui s VAL 432 CO 0.28 0.00 1.09 -0.44 -3.33 0.00 0.00 175.10 172.70 2kui s SER 433 N -3.02 6.51 0.49 3.54 0.01 -1.26 -4.94 113.70 115.02 2kui s SER 433 Ca 0.21 2.14 0.27 0.00 1.31 0.00 0.00 55.95 59.87 2kui s SER 433 Cb -0.02 -2.59 1.20 0.00 0.21 0.00 0.00 66.02 64.83 2kui s SER 433 CO 0.10 -0.67 1.95 0.71 0.41 0.00 0.00 173.24 175.73 2kui h THR 434 N 2.04 0.51 0.00 1.44 1.35 -1.99 -0.81 112.91 115.45 2kui h THR 434 Ca -0.49 -0.82 0.00 0.00 -0.55 0.00 0.00 66.41 64.55 2kui h THR 434 Cb 1.23 1.56 0.00 0.00 -1.73 0.00 0.00 68.15 69.21 2kui h THR 434 CO 0.61 0.16 -0.02 0.00 -0.25 0.00 0.00 175.52 176.02 2kui n LEU 435 N -3.46 0.33 -2.54 3.87 -0.00 -1.26 -0.05 117.00 113.89 2kui n LEU 435 Ca -0.01 0.51 -0.36 0.00 -0.00 0.00 0.00 56.01 56.15 2kui n LEU 435 Cb 0.34 -0.42 0.06 0.00 -0.00 0.00 0.00 43.42 43.39 2kui n LEU 435 CO 0.31 -0.07 1.38 0.41 -0.00 0.00 0.00 177.39 179.42 2kui n THR 436 N -1.80 3.52 -0.31 1.47 -1.04 -0.31 -4.71 114.28 111.10 2kui n THR 436 Ca 0.06 -3.59 0.14 0.00 -2.04 0.00 0.00 64.05 58.62 2kui n THR 436 Cb 0.38 -1.19 0.37 0.00 -1.82 0.00 0.00 70.33 68.06 2kui n THR 436 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 2kui h TYR 437 N 2.41 0.90 -0.58 -1.42 3.20 -1.71 -1.01 116.97 118.76 2kui h TYR 437 Ca 0.57 0.03 0.05 0.00 3.14 0.00 0.00 58.73 62.52 2kui h TYR 437 Cb 0.56 -0.28 -0.05 0.00 1.54 0.00 0.00 36.73 38.50 2kui h TYR 437 CO 1.29 0.26 0.30 0.00 -1.64 0.00 0.00 178.16 178.37 2kui h ALA 438 N 1.61 0.75 -0.11 1.82 0.00 -1.95 -1.54 119.26 119.85 2kui h ALA 438 Ca 0.52 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 55.31 2kui h ALA 438 Cb 0.88 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2kui h ALA 438 CO -0.28 -0.03 -0.52 1.49 0.00 0.00 0.00 179.25 179.91 2kui h GLU 439 N 0.58 0.30 0.07 0.00 4.81 -1.62 -2.71 114.58 116.01 2kui h GLU 439 Ca 0.26 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2kui h GLU 439 Cb 0.16 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 2kui h GLU 439 CO -0.17 0.75 -0.07 0.00 -0.73 0.00 0.00 179.01 178.78 2kui h ALA 440 N 1.22 -0.14 -0.61 2.92 0.00 -0.32 0.34 119.26 122.68 2kui h ALA 440 Ca 0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2kui h ALA 440 Cb 0.99 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 2kui h ALA 440 CO 0.08 -0.59 0.25 -0.39 0.00 0.00 0.00 179.25 178.60 2kui h VAL 441 N -0.16 1.21 -0.20 0.00 -1.51 -1.34 0.13 116.25 114.38 2kui h VAL 441 Ca 0.01 -0.66 0.00 0.00 -1.23 0.00 0.00 66.70 64.82 2kui h VAL 441 Cb 0.16 0.49 -0.01 0.00 -2.13 0.00 0.00 31.29 29.80 2kui h VAL 441 CO -0.03 0.26 0.13 0.50 -1.23 0.00 0.00 177.57 177.20 2kui h LYS 442 N 0.87 0.26 -0.55 5.19 1.63 -1.09 -1.25 116.57 121.63 2kui h LYS 442 Ca 0.21 -0.02 -0.09 0.00 -0.85 0.00 0.00 60.65 59.90 2kui h LYS 442 Cb 0.16 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.71 2kui h LYS 442 CO -0.02 0.20 -0.02 0.87 -3.45 0.00 0.00 179.45 177.02 2kui h LYS 443 N 0.26 0.96 -0.28 1.90 1.79 0.34 -1.11 116.57 120.42 2kui h LYS 443 Ca 0.07 -0.30 -0.04 0.00 -2.18 0.00 0.00 60.65 58.20 2kui h LYS 443 Cb -0.01 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.54 2kui h LYS 443 CO -0.01 0.96 -0.02 -0.07 -1.08 0.00 0.00 179.45 179.23 2kui h LEU 444 N 0.88 0.40 -0.18 2.94 3.38 -0.59 -0.72 115.31 121.42 2kui h LEU 444 Ca 0.16 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 2kui h LEU 444 Cb 0.54 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 2kui h LEU 444 CO 0.03 0.48 -0.22 0.74 0.09 0.00 0.00 178.44 179.56 2kui h THR 445 N 0.42 1.34 0.00 0.22 2.02 -0.54 0.22 112.91 116.60 2kui h THR 445 Ca 0.09 -1.42 -0.01 0.00 0.77 0.00 0.00 66.41 65.84 2kui h THR 445 Cb 0.30 1.84 -0.00 0.00 -1.74 0.00 0.00 68.15 68.55 2kui h THR 445 CO 0.01 0.43 -0.07 0.00 0.37 0.00 0.00 175.52 176.26 2kui h ALA 446 N 0.62 1.06 -0.04 6.16 0.00 -0.89 -2.24 119.26 123.92 2kui h ALA 446 Ca 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2kui h ALA 446 Cb 0.78 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2kui h ALA 446 CO 0.05 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.39 2kui n ALA 447 N -2.15 2.57 0.00 0.00 0.00 -0.31 -4.96 120.51 115.67 2kui n ALA 447 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2kui n ALA 447 Cb 0.28 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.51 2kui n ALA 447 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 448 N 0.83 2.11 0.37 0.00 0.00 -0.84 -4.74 105.19 102.92 2kui n GLY 448 Ca 0.13 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.41 2kui n GLY 448 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2kui n PHE 449 N 0.00 -0.39 -1.46 1.61 1.16 -1.25 -4.84 117.46 112.30 2kui n PHE 449 Ca 0.00 1.09 -0.16 0.00 -1.87 0.00 0.00 57.45 56.52 2kui n PHE 449 Cb 0.00 -0.57 -0.07 0.00 -1.61 0.00 0.00 39.48 37.23 2kui n PHE 449 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2kui n GLY 450 N -1.22 1.55 3.51 4.97 0.00 0.05 -4.92 105.19 109.13 2kui n GLY 450 Ca 0.02 -0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 2kui n GLY 450 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kui s ARG 451 N -3.31 3.26 0.06 1.61 1.81 -1.26 -4.72 118.95 116.40 2kui s ARG 451 Ca 0.00 -0.54 0.02 0.00 -1.72 0.00 0.00 55.73 53.48 2kui s ARG 451 Cb 0.00 -3.92 -0.03 0.00 -0.45 0.00 0.00 34.95 30.55 2kui s ARG 451 CO 0.00 -0.83 -0.07 -0.59 -0.68 0.00 0.00 175.30 173.14 2kui s PHE 452 N 2.32 0.70 -0.04 -0.53 -0.12 -1.26 -2.02 117.98 117.03 2kui s PHE 452 Ca 0.15 -0.67 -0.02 0.00 -0.05 0.00 0.00 56.93 56.34 2kui s PHE 452 Cb -0.16 -0.42 0.03 0.00 -0.63 0.00 0.00 43.02 41.83 2kui s PHE 452 CO 0.15 -0.13 0.10 0.21 -0.05 0.00 0.00 175.22 175.50 2kui s LYS 453 N -2.45 0.06 -0.16 1.99 2.47 -0.54 -4.92 119.74 116.20 2kui s LYS 453 Ca -0.02 0.25 -0.08 0.00 -1.56 0.00 0.00 55.97 54.56 2kui s LYS 453 Cb -0.04 -0.12 -0.04 0.00 -1.46 0.00 0.00 37.83 36.16 2kui s LYS 453 CO -0.02 -0.12 0.11 -1.14 0.16 0.00 0.00 175.35 174.34 2kui s GLN 454 N 0.80 3.76 -0.02 4.03 0.74 -1.26 0.37 119.66 128.07 2kui s GLN 454 Ca -0.06 -0.23 0.06 0.00 0.05 0.00 0.00 55.36 55.17 2kui s GLN 454 Cb -0.08 -3.23 -0.01 0.00 1.10 0.00 0.00 33.01 30.78 2kui s GLN 454 CO -0.03 0.50 -0.20 0.00 -0.55 0.00 0.00 175.29 175.01 2kui s ALA 455 N -0.25 1.69 -0.04 1.58 0.00 0.11 -4.93 121.76 119.92 2kui s ALA 455 Ca 0.10 -0.85 0.06 0.00 0.00 0.00 0.00 51.96 51.27 2kui s ALA 455 Cb -0.12 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.53 2kui s ALA 455 CO 0.01 0.39 -0.24 0.54 0.00 0.00 0.00 175.76 176.46 2kui s ASN 456 N -0.36 2.90 0.00 0.00 2.20 -1.26 -0.15 114.94 118.27 2kui s ASN 456 Ca 0.05 -0.47 0.02 0.00 -0.94 0.00 0.00 52.86 51.51 2kui s ASN 456 Cb -0.09 -0.66 -0.01 0.00 -2.00 0.00 0.00 41.25 38.49 2kui s ASN 456 CO 0.00 0.25 -0.06 -0.55 -2.94 0.00 0.00 177.10 173.80 2kui s SER 457 N -0.26 0.68 0.13 3.54 0.15 -0.42 -4.94 113.70 112.59 2kui s SER 457 Ca 0.00 -0.16 -0.31 0.00 0.70 0.00 0.00 55.95 56.19 2kui s SER 457 Cb -0.12 -0.06 -0.08 0.00 -1.71 0.00 0.00 66.02 64.05 2kui s SER 457 CO 0.02 0.04 1.36 -2.16 1.20 0.00 0.00 173.24 173.70 2kui s PRO 458 N -0.31 4.34 0.35 5.44 0.04 -1.23 -0.37 135.00 143.27 2kui s PRO 458 Ca 0.01 2.06 -0.05 0.00 0.04 0.00 0.00 61.00 63.06 2kui s PRO 458 Cb -0.03 -3.24 0.02 0.00 0.04 0.00 0.00 34.50 31.29 2kui s PRO 458 CO -0.00 -0.38 0.54 0.43 0.04 0.00 0.00 177.00 177.63 2kui n SER 459 N 3.60 -1.53 -4.56 6.66 7.64 -1.18 -4.88 113.62 119.37 2kui n SER 459 Ca 0.10 -2.77 -0.46 0.00 1.01 0.00 0.00 58.87 56.75 2kui n SER 459 Cb 0.43 2.75 -0.02 0.00 -1.01 0.00 0.00 64.21 66.35 2kui n SER 459 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2kui n THR 460 N -0.55 1.76 -0.13 0.44 5.66 -1.26 -4.73 114.28 115.47 2kui n THR 460 Ca -0.01 -0.44 0.27 0.00 -3.05 0.00 0.00 64.05 60.81 2kui n THR 460 Cb 0.57 -0.82 0.72 0.00 -1.55 0.00 0.00 70.33 69.25 2kui n THR 460 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2kui h PRO 461 N 2.14 0.00 0.00 1.09 0.13 -1.96 0.53 132.00 133.93 2kui h PRO 461 Ca -0.39 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.64 2kui h PRO 461 Cb 1.36 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.47 2kui h PRO 461 CO 0.62 0.00 -0.50 1.05 -0.23 0.00 0.00 178.00 178.94 2kui h GLU 462 N 0.00 0.00 0.00 0.86 4.11 -1.99 -2.90 114.58 114.65 2kui h GLU 462 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.81 2kui h GLU 462 Cb 1.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.85 2kui h GLU 462 CO -0.00 0.50 -0.64 1.28 0.07 0.00 0.00 179.01 180.22 2kui n LEU 463 N -3.45 0.70 -4.71 3.06 7.99 0.14 -4.84 117.00 115.90 2kui n LEU 463 Ca 0.00 0.22 -0.42 0.00 -0.01 0.00 0.00 56.01 55.81 2kui n LEU 463 Cb 0.63 -0.18 -0.03 0.00 -0.11 0.00 0.00 43.42 43.73 2kui n LEU 463 CO 0.39 -0.05 1.41 -0.69 -1.51 0.00 0.00 177.39 176.94 2kui s VAL 464 N -3.17 2.36 0.00 4.08 1.01 -0.98 -1.78 120.40 121.91 2kui s VAL 464 Ca 0.06 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.13 2kui s VAL 464 Cb 0.13 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.46 2kui s VAL 464 CO 0.72 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.44 2kui n GLY 465 N 4.08 0.51 3.39 4.51 0.00 0.66 -4.94 105.19 113.40 2kui n GLY 465 Ca 0.17 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.98 2kui n GLY 465 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kui s LYS 466 N -0.85 1.45 0.36 1.61 3.01 -0.73 -4.76 119.74 119.83 2kui s LYS 466 Ca 0.00 -1.65 -0.27 0.00 -1.01 0.00 0.00 55.97 53.04 2kui s LYS 466 Cb 0.00 -1.33 -0.09 0.00 -1.01 0.00 0.00 37.83 35.40 2kui s LYS 466 CO 0.00 0.23 1.17 0.08 0.51 0.00 0.00 175.35 177.34 2kui s VAL 467 N -2.83 3.18 -0.20 3.17 1.01 0.93 -0.73 120.40 124.93 2kui s VAL 467 Ca 0.25 1.06 0.07 0.00 0.00 0.00 0.00 61.98 63.36 2kui s VAL 467 Cb -0.02 -3.62 -0.22 0.00 0.00 0.00 0.00 36.38 32.52 2kui s VAL 467 CO 0.10 0.16 0.05 -0.38 0.00 0.00 0.00 175.10 175.02 2kui n ILE 468 N 0.43 1.51 -2.53 2.22 5.41 0.42 -4.78 119.36 122.04 2kui n ILE 468 Ca 0.02 -0.70 0.00 0.00 1.00 0.00 0.00 62.75 63.07 2kui n ILE 468 Cb 0.45 -1.11 0.00 0.00 -0.71 0.00 0.00 39.64 38.28 2kui n ILE 468 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2kui n GLY 469 N 1.98 -1.39 3.34 7.39 0.00 -1.18 -5.07 105.19 110.25 2kui n GLY 469 Ca -0.37 -0.99 -0.29 0.00 0.00 0.00 0.00 46.02 44.38 2kui n GLY 469 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 470 N -2.76 2.06 0.01 2.61 -4.23 -1.26 -1.88 115.64 110.19 2kui s THR 470 Ca 0.00 -1.46 -0.21 0.00 -1.18 0.00 0.00 61.69 58.84 2kui s THR 470 Cb 0.00 -1.79 -0.18 0.00 1.34 0.00 0.00 72.50 71.88 2kui s THR 470 CO 0.00 0.24 1.24 -1.13 -0.54 0.00 0.00 174.62 174.43 2kui h ASN 471 N 4.53 0.37 -3.80 3.99 -1.24 -1.80 -3.43 115.58 114.19 2kui h ASN 471 Ca -0.47 -0.59 -0.48 0.00 0.71 0.00 0.00 56.30 55.47 2kui h ASN 471 Cb 1.15 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 40.07 2kui h ASN 471 CO 0.42 0.90 0.23 -2.84 -1.29 0.00 0.00 177.43 174.85 2kui s PRO 472 N -3.87 4.32 0.10 6.67 0.02 -1.26 -5.01 135.00 135.97 2kui s PRO 472 Ca -0.14 1.05 -0.31 0.00 0.02 0.00 0.00 61.00 61.61 2kui s PRO 472 Cb 0.04 -2.64 -0.09 0.00 0.02 0.00 0.00 34.50 31.83 2kui s PRO 472 CO 0.76 0.23 1.58 -2.14 -0.33 0.00 0.00 177.00 177.11 2kui s PRO 473 N -2.40 4.22 0.00 5.54 0.02 -1.26 -4.88 135.00 136.24 2kui s PRO 473 Ca 0.51 2.30 0.10 0.00 0.02 0.00 0.00 61.00 63.92 2kui s PRO 473 Cb -0.15 -3.41 0.33 0.00 0.02 0.00 0.00 34.50 31.30 2kui s PRO 473 CO 0.20 -0.65 1.25 0.00 -0.33 0.00 0.00 177.00 177.47 2kui n ALA 474 N 4.85 2.48 0.53 -1.55 0.00 -1.26 -2.77 120.51 122.79 2kui n ALA 474 Ca 0.15 -0.41 0.06 0.00 0.00 0.00 0.00 53.44 53.24 2kui n ALA 474 Cb 0.40 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 2kui n ALA 474 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2kui n ASN 475 N 0.14 1.03 -4.97 0.00 5.03 -1.26 -4.25 115.26 110.98 2kui n ASN 475 Ca 0.09 -1.02 -0.19 0.00 0.87 0.00 0.00 54.58 54.33 2kui n ASN 475 Cb 0.21 0.67 0.04 0.00 -1.02 0.00 0.00 39.78 39.67 2kui n ASN 475 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2kui s GLN 476 N -1.73 2.54 -0.28 3.52 -1.52 -1.11 -4.68 119.66 116.40 2kui s GLN 476 Ca 0.08 -1.16 -0.18 0.00 -1.95 0.00 0.00 55.36 52.15 2kui s GLN 476 Cb 0.09 -2.62 -0.02 0.00 -0.22 0.00 0.00 33.01 30.24 2kui s GLN 476 CO 0.36 -0.61 0.50 0.99 -0.25 0.00 0.00 175.29 176.28 2kui s THR 477 N -2.60 5.07 0.08 -0.19 2.01 -1.26 -1.79 115.64 116.96 2kui s THR 477 Ca 0.58 0.75 0.08 0.00 0.31 0.00 0.00 61.69 63.40 2kui s THR 477 Cb -0.09 -3.84 -0.04 0.00 0.01 0.00 0.00 72.50 68.54 2kui s THR 477 CO 0.37 0.03 -0.16 -0.44 -0.69 0.00 0.00 174.62 173.73 2kui s SER 478 N 1.60 3.97 0.70 3.53 0.01 0.14 -4.85 113.70 118.80 2kui s SER 478 Ca 0.20 -0.47 -0.12 0.00 1.31 0.00 0.00 55.95 56.88 2kui s SER 478 Cb -0.16 -0.64 0.01 0.00 0.21 0.00 0.00 66.02 65.45 2kui s SER 478 CO 0.10 0.21 1.07 0.00 0.41 0.00 0.00 173.24 175.03 2kui s ALA 479 N -1.07 2.57 0.18 1.44 0.00 -1.26 -0.54 121.76 123.08 2kui s ALA 479 Ca 0.17 0.20 0.32 0.00 0.00 0.00 0.00 51.96 52.65 2kui s ALA 479 Cb -0.11 -3.22 1.39 0.00 0.00 0.00 0.00 23.12 21.19 2kui s ALA 479 CO 0.09 -1.32 2.00 0.82 0.00 0.00 0.00 175.76 177.35 2kui h ILE 480 N -0.64 0.15 -0.41 0.00 1.08 -1.93 -1.38 117.51 114.38 2kui h ILE 480 Ca -0.44 -0.58 0.00 0.00 -0.39 0.00 0.00 64.86 63.45 2kui h ILE 480 Cb 1.22 1.50 0.00 0.00 -3.07 0.00 0.00 36.82 36.47 2kui h ILE 480 CO 0.55 0.05 0.00 0.35 -0.69 0.00 0.00 178.15 178.41 2kui n THR 481 N -3.19 0.53 -3.47 -0.27 -2.24 -1.26 -3.95 114.28 100.43 2kui n THR 481 Ca -0.00 -0.77 -0.37 0.00 -2.27 0.00 0.00 64.05 60.64 2kui n THR 481 Cb 0.30 0.97 -0.06 0.00 -2.10 0.00 0.00 70.33 69.43 2kui n THR 481 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2kui s ASN 482 N -1.46 6.63 -0.22 3.42 2.47 -0.52 -5.06 114.94 120.20 2kui s ASN 482 Ca 0.39 0.75 -0.10 0.00 0.42 0.00 0.00 52.86 54.33 2kui s ASN 482 Cb 0.23 -2.23 -0.05 0.00 -1.45 0.00 0.00 41.25 37.75 2kui s ASN 482 CO 0.32 0.16 0.14 -0.69 -3.72 0.00 0.00 177.10 173.31 2kui s VAL 483 N -0.08 5.27 -0.13 -5.21 1.01 -1.26 -4.60 120.40 115.41 2kui s VAL 483 Ca 0.22 0.15 -0.06 0.00 0.00 0.00 0.00 61.98 62.29 2kui s VAL 483 Cb -0.15 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 2kui s VAL 483 CO 0.09 0.38 0.08 0.68 0.00 0.00 0.00 175.10 176.33 2kui s VAL 484 N 0.81 4.97 -0.18 2.92 -7.23 -0.86 -4.99 120.40 115.84 2kui s VAL 484 Ca 0.07 0.01 -0.05 0.00 -1.81 0.00 0.00 61.98 60.20 2kui s VAL 484 Cb -0.13 -3.16 -0.03 0.00 0.56 0.00 0.00 36.38 33.62 2kui s VAL 484 CO 0.02 0.57 0.01 -0.51 -0.31 0.00 0.00 175.10 174.88 2kui s ILE 485 N -0.63 4.20 -0.17 -0.62 -1.16 -1.26 -1.47 121.20 120.09 2kui s ILE 485 Ca 0.12 -0.24 -0.04 0.00 -0.51 0.00 0.00 60.65 59.98 2kui s ILE 485 Cb -0.12 -2.88 -0.03 0.00 0.61 0.00 0.00 42.46 40.05 2kui s ILE 485 CO 0.02 0.46 -0.03 -0.63 -2.81 0.00 0.00 174.94 171.96 2kui s ILE 486 N 0.54 3.86 -0.17 2.00 -1.09 0.16 -2.08 121.20 124.43 2kui s ILE 486 Ca -0.00 -0.36 -0.02 0.00 -2.23 0.00 0.00 60.65 58.03 2kui s ILE 486 Cb -0.14 -2.70 -0.02 0.00 -1.58 0.00 0.00 42.46 38.02 2kui s ILE 486 CO 0.02 0.48 -0.08 -0.51 -1.23 0.00 0.00 174.94 173.62 2kui s ILE 487 N 0.56 3.37 0.13 2.92 2.07 -0.79 0.08 121.20 129.55 2kui s ILE 487 Ca -0.03 -0.53 0.08 0.00 -1.41 0.00 0.00 60.65 58.77 2kui s ILE 487 Cb -0.14 -2.48 -0.04 0.00 0.13 0.00 0.00 42.46 39.93 2kui s ILE 487 CO 0.03 0.48 -0.09 0.68 -1.91 0.00 0.00 174.94 174.12 2kui s VAL 488 N 0.75 3.33 0.04 4.00 -7.23 0.79 -0.44 120.40 121.63 2kui s VAL 488 Ca -0.03 -1.40 -0.28 0.00 -1.81 0.00 0.00 61.98 58.45 2kui s VAL 488 Cb -0.15 -2.59 -0.05 0.00 0.56 0.00 0.00 36.38 34.15 2kui s VAL 488 CO 0.02 0.03 0.89 -0.83 -0.31 0.00 0.00 175.10 174.89 2kui s GLY 489 N -2.45 2.87 0.07 2.32 0.00 0.09 -1.30 107.32 108.93 2kui s GLY 489 Ca 0.23 0.44 -0.03 0.00 0.00 0.00 0.00 44.72 45.35 2kui s GLY 489 CO 0.14 1.41 0.04 -1.35 0.00 0.00 0.00 173.10 173.34 2kui s SER 490 N 0.41 0.37 0.00 1.64 1.04 0.51 -0.25 113.70 117.42 2kui s SER 490 Ca 0.45 -0.95 0.00 0.00 0.48 0.00 0.00 55.95 55.93 2kui s SER 490 Cb -0.21 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.16 2kui s SER 490 CO 0.26 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.43 2kui n GLY 491 N 0.03 1.36 3.77 7.32 0.00 -1.26 -3.08 105.19 113.33 2kui n GLY 491 Ca -0.13 -0.42 -0.38 0.00 0.00 0.00 0.00 46.02 45.09 2kui n GLY 491 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2kui s PRO 492 N 0.00 4.32 -1.21 1.61 0.02 -1.26 -4.90 135.00 133.58 2kui s PRO 492 Ca 0.00 1.69 -0.12 0.00 0.02 0.00 0.00 61.00 62.59 2kui s PRO 492 Cb 0.00 -2.81 0.19 0.00 0.02 0.00 0.00 34.50 31.90 2kui s PRO 492 CO 0.00 -0.04 1.47 0.00 -0.33 0.00 0.00 177.00 178.10 2kui n ALA 493 N 0.43 4.21 -2.40 -1.55 0.00 -1.26 -4.95 120.51 114.99 2kui n ALA 493 Ca 0.03 -4.33 -0.31 0.00 0.00 0.00 0.00 53.44 48.82 2kui n ALA 493 Cb 0.47 -2.94 -0.14 0.00 0.00 0.00 0.00 19.45 16.84 2kui n ALA 493 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2kui s THR 494 N 0.85 2.48 0.03 0.00 -4.23 -1.26 -1.12 115.64 112.39 2kui s THR 494 Ca 0.40 -1.15 -0.02 0.00 -1.18 0.00 0.00 61.69 59.74 2kui s THR 494 Cb -0.01 -1.97 -0.02 0.00 1.34 0.00 0.00 72.50 71.83 2kui s THR 494 CO -0.00 0.44 0.01 -0.54 -0.54 0.00 0.00 174.62 173.99 2kui s LYS 495 N -1.08 0.43 0.10 3.99 -0.14 0.65 -4.92 119.74 118.77 2kui s LYS 495 Ca 0.12 -0.72 -0.29 0.00 -1.36 0.00 0.00 55.97 53.72 2kui s LYS 495 Cb -0.10 0.16 -0.06 0.00 -1.68 0.00 0.00 37.83 36.15 2kui s LYS 495 CO 0.02 -0.08 0.94 0.16 -0.76 0.00 0.00 175.35 175.62 2kui s ASP 496 N -1.83 7.46 -0.13 2.83 -4.77 -1.26 -0.52 116.67 118.45 2kui s ASP 496 Ca -0.10 1.74 -0.26 0.00 -3.30 0.00 0.00 52.55 50.63 2kui s ASP 496 Cb -0.05 -2.57 -0.02 0.00 -1.09 0.00 0.00 42.92 39.19 2kui s ASP 496 CO -0.03 -0.06 0.87 0.27 0.70 0.00 0.00 175.17 176.91 2kui s ILE 497 N 0.04 4.88 0.58 2.11 -4.36 -0.07 -4.94 121.20 119.44 2kui s ILE 497 Ca 0.46 1.73 -0.10 0.00 -0.26 0.00 0.00 60.65 62.48 2kui s ILE 497 Cb -0.23 -4.18 0.13 0.00 1.25 0.00 0.00 42.46 39.44 2kui s ILE 497 CO 0.29 0.06 0.79 -0.81 0.24 0.00 0.00 174.94 175.50 2kui n PRO 498 N 4.91 -0.80 -2.72 0.37 -0.04 -1.26 -0.30 135.00 135.15 2kui n PRO 498 Ca 0.05 -1.22 -0.42 0.00 -0.04 0.00 0.00 63.50 61.87 2kui n PRO 498 Cb 0.49 -0.82 -0.03 0.00 -0.04 0.00 0.00 33.50 33.11 2kui n PRO 498 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2kui s ASP 499 N -3.87 6.55 0.00 3.54 -1.08 -1.26 -4.58 116.67 115.97 2kui s ASP 499 Ca 0.45 -1.70 0.18 0.00 -0.52 0.00 0.00 52.55 50.96 2kui s ASP 499 Cb -0.01 -2.49 0.25 0.00 -1.46 0.00 0.00 42.92 39.21 2kui s ASP 499 CO 0.31 -1.32 1.18 0.55 0.52 0.00 0.00 175.17 176.42 2kui n VAL 500 N 6.27 0.32 -1.70 1.11 3.14 -1.26 -4.80 118.33 121.41 2kui n VAL 500 Ca 0.28 -0.66 -0.40 0.00 -2.96 0.00 0.00 64.34 60.60 2kui n VAL 500 Cb 0.50 1.10 -0.01 0.00 -1.06 0.00 0.00 33.84 34.37 2kui n VAL 500 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kui n ALA 501 N 1.06 6.66 0.00 1.55 0.00 -1.26 -3.62 120.51 124.90 2kui n ALA 501 Ca 0.13 -3.84 0.00 0.00 0.00 0.00 0.00 53.44 49.73 2kui n ALA 501 Cb 0.48 -3.22 0.00 0.00 0.00 0.00 0.00 19.45 16.70 2kui n ALA 501 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 502 N 3.17 0.00 0.00 0.00 0.00 -1.25 -4.45 105.19 102.66 2kui n GLY 502 Ca 0.64 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.66 2kui n GLY 502 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kui n GLN 503 N 0.00 2.11 -2.46 1.61 6.02 -1.24 -4.86 117.38 118.56 2kui n GLN 503 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.68 2kui n GLN 503 Cb 0.00 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.23 2kui n GLN 503 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2kui s THR 504 N -0.70 4.64 0.19 5.09 2.01 -1.26 -0.54 115.64 125.06 2kui s THR 504 Ca 0.00 0.97 -0.12 0.00 0.31 0.00 0.00 61.69 62.85 2kui s THR 504 Cb 0.00 -3.75 0.10 0.00 0.01 0.00 0.00 72.50 68.86 2kui s THR 504 CO 0.00 -0.71 1.75 1.62 -0.69 0.00 0.00 174.62 176.59 2kui h VAL 505 N 0.78 0.83 -0.50 3.82 3.04 -0.89 0.21 116.25 123.54 2kui h VAL 505 Ca -0.47 -0.13 -0.09 0.00 -1.01 0.00 0.00 66.70 65.01 2kui h VAL 505 Cb 1.19 0.42 -0.02 0.00 -2.01 0.00 0.00 31.29 30.87 2kui h VAL 505 CO 0.62 0.07 -0.03 0.44 -1.01 0.00 0.00 177.57 177.66 2kui h ASP 506 N 0.38 0.89 -0.48 3.17 5.19 -1.93 -1.43 116.42 122.20 2kui h ASP 506 Ca 0.25 -0.32 -0.08 0.00 -0.62 0.00 0.00 57.03 56.26 2kui h ASP 506 Cb 0.27 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.52 2kui h ASP 506 CO -0.25 1.00 -0.02 0.58 -3.12 0.00 0.00 179.24 177.43 2kui h VAL 507 N 0.76 1.26 -0.45 -1.35 2.07 -1.79 -2.60 116.25 114.15 2kui h VAL 507 Ca 0.14 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 2kui h VAL 507 Cb 0.56 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 2kui h VAL 507 CO 0.03 0.38 0.24 0.00 0.02 0.00 0.00 177.57 178.24 2kui h ALA 508 N 0.92 0.58 -0.95 1.67 0.00 -0.36 -0.73 119.26 120.39 2kui h ALA 508 Ca 0.13 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2kui h ALA 508 Cb 0.54 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 2kui h ALA 508 CO 0.03 0.12 0.61 1.96 0.00 0.00 0.00 179.25 181.97 2kui h GLN 509 N 0.59 1.26 0.28 0.00 4.20 -1.09 0.21 115.11 120.57 2kui h GLN 509 Ca 0.16 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 2kui h GLN 509 Cb 0.08 -0.28 0.00 0.00 0.30 0.00 0.00 27.48 27.58 2kui h GLN 509 CO -0.02 0.85 -0.14 0.87 -0.67 0.00 0.00 178.83 179.72 2kui h LYS 510 N 1.30 -0.37 -0.65 1.46 1.57 -1.16 -2.17 116.57 116.54 2kui h LYS 510 Ca 0.35 0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 59.11 2kui h LYS 510 Cb -0.12 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 2kui h LYS 510 CO -0.07 -0.10 0.26 -0.91 -0.57 0.00 0.00 179.45 178.05 2kui h ASN 511 N -0.61 0.87 -0.55 0.86 2.35 -0.83 -1.27 115.58 116.41 2kui h ASN 511 Ca -0.04 -0.12 0.02 0.00 -0.55 0.00 0.00 56.30 55.61 2kui h ASN 511 Cb 0.44 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 2kui h ASN 511 CO 0.06 0.78 0.34 0.25 -1.65 0.00 0.00 177.43 177.22 2kui h LEU 512 N 0.94 0.56 -0.91 1.61 6.46 -0.54 -0.44 115.31 122.99 2kui h LEU 512 Ca 0.22 -0.00 -0.07 0.00 -0.12 0.00 0.00 57.88 57.91 2kui h LEU 512 Cb 0.18 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 39.96 2kui h LEU 512 CO -0.02 0.40 0.08 0.78 -0.62 0.00 0.00 178.44 179.06 2kui h ASN 513 N 0.68 0.83 0.16 1.25 -0.26 -0.67 -1.98 115.58 115.59 2kui h ASN 513 Ca 0.22 -0.18 -0.04 0.00 -0.56 0.00 0.00 56.30 55.74 2kui h ASN 513 Cb -0.01 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.03 2kui h ASN 513 CO -0.08 0.85 -0.17 0.58 -1.06 0.00 0.00 177.43 177.55 2kui h VAL 514 N 0.83 1.14 0.00 2.81 2.07 -0.22 -2.15 116.25 120.74 2kui h VAL 514 Ca 0.17 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 67.05 2kui h VAL 514 Cb 0.39 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 2kui h VAL 514 CO 0.01 0.19 0.00 -1.22 0.02 0.00 0.00 177.57 176.57 2kui n TYR 515 N -4.32 0.00 0.00 1.57 4.01 -0.27 -4.84 117.16 113.31 2kui n TYR 515 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 2kui n TYR 515 Cb 0.25 -0.23 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 2kui n TYR 515 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2kui n GLY 516 N 0.88 0.66 3.58 2.72 0.00 -0.81 -5.04 105.19 107.18 2kui n GLY 516 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2kui n GLY 516 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kui s PHE 517 N -2.05 3.12 -0.29 1.61 0.08 -1.09 -4.79 117.98 114.58 2kui s PHE 517 Ca 0.00 0.48 0.23 0.00 0.12 0.00 0.00 56.93 57.76 2kui s PHE 517 Cb 0.00 -3.32 0.05 0.00 -0.57 0.00 0.00 43.02 39.18 2kui s PHE 517 CO 0.00 -0.70 1.09 1.79 -0.10 0.00 0.00 175.22 177.30 2kui h THR 518 N 5.73 0.00 -3.57 0.64 1.35 -1.82 -3.07 112.91 112.17 2kui h THR 518 Ca -0.25 -0.94 -0.65 0.00 -0.55 0.00 0.00 66.41 64.01 2kui h THR 518 Cb 1.10 1.46 -0.24 0.00 -1.73 0.00 0.00 68.15 68.74 2kui h THR 518 CO 0.89 0.00 -0.65 -0.54 -0.25 0.00 0.00 175.52 174.97 2kui s LYS 519 N -3.34 3.53 0.13 4.72 1.02 -1.26 -4.93 119.74 119.61 2kui s LYS 519 Ca 0.01 -0.55 0.06 0.00 0.02 0.00 0.00 55.97 55.50 2kui s LYS 519 Cb 0.10 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 34.12 2kui s LYS 519 CO 0.78 -0.22 -0.13 -0.59 -0.92 0.00 0.00 175.35 174.27 2kui s PHE 520 N 1.57 1.38 0.00 3.18 -0.71 -1.26 -1.15 117.98 120.99 2kui s PHE 520 Ca 0.06 -0.61 -0.02 0.00 -1.04 0.00 0.00 56.93 55.32 2kui s PHE 520 Cb -0.15 -0.71 -0.01 0.00 -1.21 0.00 0.00 43.02 40.94 2kui s PHE 520 CO 0.02 0.14 0.04 -1.54 -1.34 0.00 0.00 175.22 172.54 2kui s SER 521 N -2.70 0.10 -0.06 1.98 1.04 0.17 -4.86 113.70 109.37 2kui s SER 521 Ca 0.12 -0.25 0.04 0.00 0.48 0.00 0.00 55.95 56.34 2kui s SER 521 Cb -0.03 0.13 -0.00 0.00 0.10 0.00 0.00 66.02 66.22 2kui s SER 521 CO 0.03 -0.24 -0.19 0.00 0.98 0.00 0.00 173.24 173.82 2kui s GLN 522 N -1.01 2.10 -0.06 4.02 1.03 -1.26 -0.02 119.66 124.46 2kui s GLN 522 Ca -0.11 -0.67 0.01 0.00 0.04 0.00 0.00 55.36 54.63 2kui s GLN 522 Cb -0.07 -1.75 0.02 0.00 0.03 0.00 0.00 33.01 31.25 2kui s GLN 522 CO -0.00 0.22 -0.05 0.00 -2.54 0.00 0.00 175.29 172.91 2kui s ALA 523 N 0.17 0.87 -0.14 2.60 0.00 -0.14 -4.96 121.76 120.16 2kui s ALA 523 Ca -0.08 -0.20 -0.11 0.00 0.00 0.00 0.00 51.96 51.57 2kui s ALA 523 Cb -0.14 -0.58 -0.05 0.00 0.00 0.00 0.00 23.12 22.36 2kui s ALA 523 CO 0.04 -0.14 0.21 -1.12 0.00 0.00 0.00 175.76 174.75 2kui s SER 524 N 1.20 6.41 0.11 0.00 0.01 -1.26 -0.05 113.70 120.12 2kui s SER 524 Ca -0.06 0.48 0.09 0.00 1.31 0.00 0.00 55.95 57.77 2kui s SER 524 Cb -0.14 -2.13 -0.04 0.00 0.21 0.00 0.00 66.02 63.93 2kui s SER 524 CO -0.02 0.25 -0.23 0.68 0.41 0.00 0.00 173.24 174.33 2kui s VAL 525 N -0.26 1.94 0.25 3.43 -7.23 0.07 -4.91 120.40 113.69 2kui s VAL 525 Ca 0.15 -1.63 -0.30 0.00 -1.81 0.00 0.00 61.98 58.39 2kui s VAL 525 Cb -0.13 -1.74 -0.10 0.00 0.56 0.00 0.00 36.38 34.98 2kui s VAL 525 CO 0.04 0.00 1.40 1.51 -0.31 0.00 0.00 175.10 177.74 2kui s ASP 526 N -1.96 6.71 0.20 4.85 -4.77 -1.26 -0.24 116.67 120.19 2kui s ASP 526 Ca 0.09 2.62 -0.11 0.00 -3.30 0.00 0.00 52.55 51.86 2kui s ASP 526 Cb -0.10 -2.62 -0.00 0.00 -1.09 0.00 0.00 42.92 39.10 2kui s ASP 526 CO 0.05 -0.65 0.38 -0.44 0.70 0.00 0.00 175.17 175.21 2kui s SER 527 N 0.23 -0.05 0.34 2.11 0.01 0.14 -4.76 113.70 111.72 2kui s SER 527 Ca 0.57 -0.85 0.18 0.00 1.31 0.00 0.00 55.95 57.16 2kui s SER 527 Cb -0.41 0.51 0.21 0.00 0.21 0.00 0.00 66.02 66.54 2kui s SER 527 CO 0.44 -1.00 1.52 -0.65 0.41 0.00 0.00 173.24 173.96 2kui h PRO 528 N 2.39 0.00 -7.02 12.44 0.11 -1.84 -3.38 132.00 134.70 2kui h PRO 528 Ca -0.30 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.31 2kui h PRO 528 Cb 1.24 0.00 0.06 0.00 0.11 0.00 0.00 31.00 32.41 2kui h PRO 528 CO 0.42 0.33 0.46 1.03 -0.21 0.00 0.00 178.00 180.03 2kui s ARG 529 N -3.08 3.74 0.87 1.05 0.52 -1.26 -4.90 118.95 115.88 2kui s ARG 529 Ca 0.05 1.68 -0.11 0.00 -0.52 0.00 0.00 55.73 56.83 2kui s ARG 529 Cb 0.07 -2.33 0.12 0.00 0.52 0.00 0.00 34.95 33.33 2kui s ARG 529 CO 0.71 -0.55 1.15 -2.14 0.02 0.00 0.00 175.30 174.50 2kui s PRO 530 N -2.82 1.35 -0.05 3.54 0.02 -1.26 -2.85 135.00 132.93 2kui s PRO 530 Ca 0.65 1.55 -0.30 0.00 0.02 0.00 0.00 61.00 62.92 2kui s PRO 530 Cb -0.26 -1.76 -0.06 0.00 0.02 0.00 0.00 34.50 32.44 2kui s PRO 530 CO 0.31 -2.39 1.63 0.00 -0.33 0.00 0.00 177.00 176.23 2kui s ALA 531 N -2.56 3.62 0.00 -1.55 0.00 -1.25 -2.37 121.76 117.65 2kui s ALA 531 Ca 0.68 0.93 0.00 0.00 0.00 0.00 0.00 51.96 53.57 2kui s ALA 531 Cb -0.23 -3.73 0.00 0.00 0.00 0.00 0.00 23.12 19.15 2kui s ALA 531 CO 0.56 -1.36 0.00 0.41 0.00 0.00 0.00 175.76 175.37 2kui n GLY 532 N 4.09 2.06 3.72 0.00 0.00 -0.91 -4.91 105.19 109.24 2kui n GLY 532 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2kui n GLY 532 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kui s GLU 533 N -0.07 4.58 -0.29 1.61 2.56 -1.00 -0.19 118.70 125.90 2kui s GLU 533 Ca 0.00 1.59 -0.27 0.00 0.00 0.00 0.00 54.97 56.29 2kui s GLU 533 Cb 0.00 -3.36 0.01 0.00 2.00 0.00 0.00 34.13 32.78 2kui s GLU 533 CO 0.00 0.02 0.96 0.08 -0.56 0.00 0.00 175.26 175.76 2kui s VAL 534 N 0.35 4.65 -0.54 3.70 1.01 0.30 0.35 120.40 130.22 2kui s VAL 534 Ca 0.51 1.61 0.24 0.00 0.00 0.00 0.00 61.98 64.34 2kui s VAL 534 Cb -0.26 -4.29 0.25 0.00 0.00 0.00 0.00 36.38 32.08 2kui s VAL 534 CO 0.31 -0.32 1.57 0.00 0.00 0.00 0.00 175.10 176.66 2kui h THR 535 N 5.62 0.00 0.00 3.92 1.03 -1.38 -3.32 112.91 118.78 2kui h THR 535 Ca -0.22 -0.77 0.00 0.00 -0.01 0.00 0.00 66.41 65.42 2kui h THR 535 Cb 1.07 1.66 0.00 0.00 -1.07 0.00 0.00 68.15 69.82 2kui h THR 535 CO 0.97 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 177.09 2kui n GLY 536 N 1.21 -0.79 3.33 2.99 0.00 -1.14 -4.86 105.19 105.94 2kui n GLY 536 Ca 0.04 -1.10 -0.22 0.00 0.00 0.00 0.00 46.02 44.74 2kui n GLY 536 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 537 N -3.00 1.82 0.01 2.61 -4.23 -1.26 -1.44 115.64 110.15 2kui s THR 537 Ca 0.00 -1.90 -0.26 0.00 -1.18 0.00 0.00 61.69 58.36 2kui s THR 537 Cb 0.00 -1.83 -0.16 0.00 1.34 0.00 0.00 72.50 71.85 2kui s THR 537 CO 0.00 -0.30 1.22 -1.13 -0.54 0.00 0.00 174.62 173.88 2kui h ASN 538 N 3.30 -0.47 -3.15 3.99 -0.00 -1.31 -3.40 115.58 114.54 2kui h ASN 538 Ca -0.42 -0.11 -0.55 0.00 -0.00 0.00 0.00 56.30 55.22 2kui h ASN 538 Cb 1.20 0.12 -0.01 0.00 -0.00 0.00 0.00 38.32 39.63 2kui h ASN 538 CO 0.50 -0.11 0.63 -2.16 -0.00 0.00 0.00 177.43 176.29 2kui s PRO 539 N -4.73 4.39 0.72 6.67 0.04 -1.26 -5.01 135.00 135.82 2kui s PRO 539 Ca -0.14 1.68 -0.16 0.00 0.04 0.00 0.00 61.00 62.42 2kui s PRO 539 Cb 0.02 -3.49 0.03 0.00 0.04 0.00 0.00 34.50 31.11 2kui s PRO 539 CO 0.52 -0.36 1.25 -2.14 0.04 0.00 0.00 177.00 176.31 2kui s PRO 540 N 1.77 2.12 0.30 0.56 0.02 -1.26 -4.95 135.00 133.55 2kui s PRO 540 Ca 0.56 1.90 -0.29 0.00 0.02 0.00 0.00 61.00 63.19 2kui s PRO 540 Cb -0.26 -1.81 -0.10 0.00 0.02 0.00 0.00 34.50 32.35 2kui s PRO 540 CO 0.25 -1.88 1.33 0.00 -0.33 0.00 0.00 177.00 176.36 2kui s ALA 541 N -1.78 3.52 0.00 -1.55 0.00 -1.26 -2.40 121.76 118.30 2kui s ALA 541 Ca 0.78 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.98 2kui s ALA 541 Cb -0.33 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.30 2kui s ALA 541 CO 0.45 -0.64 0.00 0.41 0.00 0.00 0.00 175.76 175.98 2kui n GLY 542 N 1.29 3.15 3.75 0.00 0.00 0.59 -5.02 105.19 108.95 2kui n GLY 542 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 2kui n GLY 542 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kui s THR 543 N -2.76 2.66 -0.24 2.61 2.01 -1.01 -4.55 115.64 114.35 2kui s THR 543 Ca 0.00 0.56 -0.13 0.00 0.31 0.00 0.00 61.69 62.43 2kui s THR 543 Cb 0.00 -3.36 -0.04 0.00 0.01 0.00 0.00 72.50 69.11 2kui s THR 543 CO 0.00 0.09 0.27 -0.89 -0.69 0.00 0.00 174.62 173.40 2kui s THR 544 N -0.14 5.27 0.09 -0.82 2.01 -1.26 -0.89 115.64 119.90 2kui s THR 544 Ca 0.58 0.39 0.01 0.00 0.31 0.00 0.00 61.69 62.98 2kui s THR 544 Cb -0.42 -3.60 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 2kui s THR 544 CO 0.45 0.27 -0.06 0.68 -0.69 0.00 0.00 174.62 175.26 2kui s VAL 545 N 1.45 0.61 0.55 3.82 -7.23 0.32 -4.91 120.40 115.01 2kui s VAL 545 Ca 0.12 -1.90 -0.21 0.00 -1.81 0.00 0.00 61.98 58.18 2kui s VAL 545 Cb -0.15 -1.63 -0.05 0.00 0.56 0.00 0.00 36.38 35.11 2kui s VAL 545 CO 0.08 -0.89 1.27 -2.84 -0.31 0.00 0.00 175.10 172.41 2kui s PRO 546 N -3.81 3.19 0.59 4.82 0.02 -1.26 -0.25 135.00 138.30 2kui s PRO 546 Ca 0.11 2.01 0.38 0.00 0.02 0.00 0.00 61.00 63.52 2kui s PRO 546 Cb 0.05 -2.17 1.86 0.00 0.02 0.00 0.00 34.50 34.26 2kui s PRO 546 CO -0.06 -1.08 2.15 -0.39 -0.33 0.00 0.00 177.00 177.29 2kui h VAL 547 N 1.33 0.00 -0.20 3.83 -1.51 -1.44 -0.84 116.25 117.42 2kui h VAL 547 Ca -0.50 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 64.73 2kui h VAL 547 Cb 1.29 1.21 0.00 0.00 -2.13 0.00 0.00 31.29 31.66 2kui h VAL 547 CO 0.57 0.00 0.00 -0.67 -1.23 0.00 0.00 177.57 176.24 2kui n ASP 548 N -3.02 2.28 -4.91 4.19 2.03 -1.26 -3.39 116.55 112.46 2kui n ASP 548 Ca -0.01 -1.79 -0.28 0.00 0.52 0.00 0.00 54.79 53.23 2kui n ASP 548 Cb 0.18 -0.12 0.02 0.00 -0.72 0.00 0.00 41.12 40.47 2kui n ASP 548 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2kui s SER 549 N -1.64 5.94 -0.19 1.67 0.15 -0.32 -4.89 113.70 114.42 2kui s SER 549 Ca 0.34 0.90 -0.13 0.00 0.70 0.00 0.00 55.95 57.77 2kui s SER 549 Cb 0.20 -2.03 -0.05 0.00 -1.71 0.00 0.00 66.02 62.43 2kui s SER 549 CO 0.29 -0.85 0.25 -0.69 1.20 0.00 0.00 173.24 173.45 2kui s VAL 550 N -2.92 5.32 -0.18 4.45 1.01 -1.26 -4.20 120.40 122.61 2kui s VAL 550 Ca 0.51 0.43 -0.08 0.00 0.00 0.00 0.00 61.98 62.84 2kui s VAL 550 Cb -0.10 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2kui s VAL 550 CO 0.46 0.36 0.10 -0.63 0.00 0.00 0.00 175.10 175.40 2kui s ILE 551 N 0.74 5.14 -0.31 2.22 1.09 -0.30 -4.96 121.20 124.81 2kui s ILE 551 Ca 0.13 0.09 -0.10 0.00 -1.10 0.00 0.00 60.65 59.67 2kui s ILE 551 Cb -0.13 -3.32 -0.02 0.00 -1.06 0.00 0.00 42.46 37.93 2kui s ILE 551 CO 0.04 0.48 0.17 -0.70 -0.10 0.00 0.00 174.94 174.83 2kui s GLU 552 N 0.14 3.51 -0.12 2.79 2.12 -1.26 -0.66 118.70 125.22 2kui s GLU 552 Ca 0.07 -0.61 -0.20 0.00 0.36 0.00 0.00 54.97 54.59 2kui s GLU 552 Cb -0.12 -3.62 -0.04 0.00 0.26 0.00 0.00 34.13 30.62 2kui s GLU 552 CO -0.00 -0.36 0.55 -0.51 -0.54 0.00 0.00 175.26 174.39 2kui s LEU 553 N 1.67 4.26 -0.34 2.70 1.43 0.97 -0.80 118.68 128.57 2kui s LEU 553 Ca 0.06 0.89 -0.10 0.00 -1.03 0.00 0.00 54.13 53.94 2kui s LEU 553 Cb -0.17 -2.81 0.00 0.00 0.03 0.00 0.00 46.19 43.25 2kui s LEU 553 CO 0.08 -0.07 0.18 0.00 0.23 0.00 0.00 176.35 176.77 2kui s GLN 554 N 0.88 3.18 0.11 1.70 -2.07 -0.52 -0.97 119.66 121.97 2kui s GLN 554 Ca 0.29 -0.83 -0.08 0.00 -1.82 0.00 0.00 55.36 52.91 2kui s GLN 554 Cb -0.16 -3.65 -0.06 0.00 -1.09 0.00 0.00 33.01 28.05 2kui s GLN 554 CO 0.12 -0.52 0.40 0.08 -1.32 0.00 0.00 175.29 174.06 2kui s VAL 555 N 1.61 5.11 -0.03 3.63 1.01 0.93 -1.03 120.40 131.62 2kui s VAL 555 Ca 0.04 0.31 -0.24 0.00 0.00 0.00 0.00 61.98 62.09 2kui s VAL 555 Cb -0.18 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 2kui s VAL 555 CO 0.07 0.18 0.71 -0.44 0.00 0.00 0.00 175.10 175.61 2kui s SER 556 N -2.03 7.04 -0.29 3.32 0.01 0.15 -0.75 113.70 121.16 2kui s SER 556 Ca 0.37 1.25 -0.12 0.00 1.31 0.00 0.00 55.95 58.76 2kui s SER 556 Cb -0.13 -2.42 -0.04 0.00 0.21 0.00 0.00 66.02 63.63 2kui s SER 556 CO 0.20 -0.06 0.23 -0.75 0.41 0.00 0.00 173.24 173.27 2kui s LYS 557 N 0.50 3.91 0.22 12.44 2.20 0.66 -2.14 119.74 137.53 2kui s LYS 557 Ca 0.37 -0.29 -0.04 0.00 -0.36 0.00 0.00 55.97 55.66 2kui s LYS 557 Cb -0.18 -3.68 0.19 0.00 -1.51 0.00 0.00 37.83 32.65 2kui s LYS 557 CO 0.19 -0.23 1.63 0.78 -0.36 0.00 0.00 175.35 177.36 2kui h GLY 558 N 8.44 0.83 0.00 5.54 0.00 -1.71 0.39 103.07 116.57 2kui h GLY 558 Ca -0.34 -0.71 0.00 0.00 0.00 0.00 0.00 47.33 46.28 2kui h GLY 558 CO 0.58 0.64 0.00 -2.01 0.00 0.00 0.00 176.54 175.75 2kui n ASN 559 N -4.12 -2.29 -3.85 0.19 5.15 -1.26 -4.68 115.26 104.41 2kui n ASN 559 Ca 0.00 0.00 -0.12 0.00 -0.60 0.00 0.00 54.58 53.86 2kui n ASN 559 Cb 0.43 -2.16 -0.13 0.00 -0.53 0.00 0.00 39.78 37.40 2kui n ASN 559 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 2kui s GLN 560 N -1.03 0.16 -0.04 1.20 2.00 -1.26 -1.85 119.66 118.85 2kui s GLN 560 Ca 0.00 0.07 -0.02 0.00 -2.00 0.00 0.00 55.36 53.40 2kui s GLN 560 Cb 0.00 0.07 0.02 0.00 0.80 0.00 0.00 33.01 33.90 2kui s GLN 560 CO 0.00 -0.02 0.09 -0.59 -0.50 0.00 0.00 175.29 174.27 2kui s PHE 561 N -0.13 -0.09 -0.19 1.67 -0.71 -0.47 -4.84 117.98 113.22 2kui s PHE 561 Ca -0.02 0.27 -0.29 0.00 -1.04 0.00 0.00 56.93 55.85 2kui s PHE 561 Cb -0.02 -0.04 -0.03 0.00 -1.21 0.00 0.00 43.02 41.73 2kui s PHE 561 CO 0.00 -0.08 1.57 0.54 -1.34 0.00 0.00 175.22 175.91 2kui s VAL 562 N 0.49 3.76 -0.09 -2.49 0.11 -1.26 0.04 120.40 120.96 2kui s VAL 562 Ca -0.04 0.88 -0.09 0.00 -2.93 0.00 0.00 61.98 59.80 2kui s VAL 562 Cb -0.05 -3.72 -0.04 0.00 -1.53 0.00 0.00 36.38 31.03 2kui s VAL 562 CO -0.02 -0.24 0.21 -0.32 -3.33 0.00 0.00 175.10 171.40 2kui s MET 563 N 4.40 3.58 0.96 1.54 1.75 -1.02 -4.93 119.30 125.58 2kui s MET 563 Ca 0.69 0.01 -0.11 0.00 -1.25 0.00 0.00 55.69 55.04 2kui s MET 563 Cb -0.26 -3.20 0.17 0.00 2.84 0.00 0.00 34.83 34.38 2kui s MET 563 CO 0.27 0.75 1.12 -2.14 -0.65 0.00 0.00 175.02 174.37 2kui s PRO 564 N -1.01 0.64 0.10 4.11 0.02 -1.26 -0.04 135.00 137.55 2kui s PRO 564 Ca 0.17 1.41 -0.31 0.00 0.02 0.00 0.00 61.00 62.29 2kui s PRO 564 Cb -0.13 -1.69 -0.08 0.00 0.02 0.00 0.00 34.50 32.62 2kui s PRO 564 CO 0.06 -2.85 1.45 0.16 -0.33 0.00 0.00 177.00 175.50 2kui s ASP 565 N -2.65 6.77 0.00 2.53 -4.77 -1.26 -4.29 116.67 113.00 2kui s ASP 565 Ca 0.67 2.35 0.00 0.00 -3.30 0.00 0.00 52.55 52.27 2kui s ASP 565 Cb -0.23 -2.58 0.00 0.00 -1.09 0.00 0.00 42.92 39.02 2kui s ASP 565 CO 0.59 -0.72 0.44 -0.11 0.70 0.00 0.00 175.17 176.07 2kui n LEU 566 N 4.41 0.63 -4.73 2.11 7.94 -1.26 -5.02 117.00 121.07 2kui n LEU 566 Ca 0.13 -0.63 -0.41 0.00 -1.11 0.00 0.00 56.01 53.98 2kui n LEU 566 Cb 0.42 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.33 2kui n LEU 566 CO 0.59 0.16 0.75 -0.44 -1.11 0.00 0.00 177.39 177.34 2kui s SER 567 N -0.19 7.35 0.00 1.96 0.01 -1.26 -3.26 113.70 118.30 2kui s SER 567 Ca 0.00 1.95 0.00 0.00 1.31 0.00 0.00 55.95 59.21 2kui s SER 567 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2kui s SER 567 CO 0.00 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.08 2kui n GLY 568 N 2.25 0.65 3.83 3.44 0.00 -1.24 -5.05 105.19 109.07 2kui n GLY 568 Ca 0.03 -0.45 -0.30 0.00 0.00 0.00 0.00 46.02 45.30 2kui n GLY 568 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2kui s MET 569 N -0.95 2.22 0.35 1.61 1.00 -1.20 -4.85 119.30 117.48 2kui s MET 569 Ca 0.00 -2.20 -0.07 0.00 0.00 0.00 0.00 55.69 53.42 2kui s MET 569 Cb 0.00 -1.82 -0.05 0.00 0.00 0.00 0.00 34.83 32.96 2kui s MET 569 CO 0.00 -0.47 0.66 -0.06 0.00 0.00 0.00 175.02 175.14 2kui s PHE 570 N -2.82 3.48 0.48 -0.03 0.08 -1.26 -0.08 117.98 117.83 2kui s PHE 570 Ca 0.20 0.79 0.17 0.00 0.12 0.00 0.00 56.93 58.22 2kui s PHE 570 Cb -0.00 -2.24 1.19 0.00 -0.57 0.00 0.00 43.02 41.40 2kui s PHE 570 CO 0.12 0.02 2.07 2.35 -0.10 0.00 0.00 175.22 179.68 2kui h TRP 571 N 1.33 0.00 0.00 0.36 7.01 -0.42 0.12 115.95 124.35 2kui h TRP 571 Ca -0.48 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.52 2kui h TRP 571 Cb 1.19 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.25 2kui h TRP 571 CO 0.58 0.11 0.00 1.55 -2.79 0.00 0.00 178.44 177.89 2kui n VAL 572 N -4.29 0.72 -0.11 2.65 3.14 -1.26 -2.26 118.33 116.92 2kui n VAL 572 Ca -0.03 0.12 -0.15 0.00 -2.96 0.00 0.00 64.34 61.32 2kui n VAL 572 Cb 0.18 -0.92 -0.12 0.00 -1.06 0.00 0.00 33.84 31.92 2kui n VAL 572 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 2kui n ASP 573 N -1.90 1.60 0.22 6.55 8.00 -0.16 -4.52 116.55 126.35 2kui n ASP 573 Ca 0.04 -0.10 -0.15 0.00 0.71 0.00 0.00 54.79 55.30 2kui n ASP 573 Cb 0.26 -0.01 -0.08 0.00 -0.02 0.00 0.00 41.12 41.27 2kui n ASP 573 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kui h ALA 574 N 0.26 -0.54 0.02 2.24 0.00 -0.44 -2.72 119.26 118.08 2kui h ALA 574 Ca -0.54 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.21 2kui h ALA 574 Cb 1.94 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.94 2kui h ALA 574 CO -0.05 -0.72 -0.01 0.93 0.00 0.00 0.00 179.25 179.40 2kui h GLU 575 N -0.71 -0.02 -0.81 0.00 5.08 -1.73 -1.61 114.58 114.76 2kui h GLU 575 Ca -0.06 0.00 0.13 0.00 -1.00 0.00 0.00 59.36 58.44 2kui h GLU 575 Cb 0.50 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.67 2kui h GLU 575 CO 0.09 0.09 0.41 -1.35 -1.00 0.00 0.00 179.01 177.25 2kui h PRO 576 N -0.13 0.60 -0.38 2.33 0.11 -1.79 0.40 132.00 133.13 2kui h PRO 576 Ca -0.00 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.95 2kui h PRO 576 Cb 0.12 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 2kui h PRO 576 CO 0.00 0.39 -0.24 -0.09 -0.21 0.00 0.00 178.00 177.86 2kui h ARG 577 N 0.61 0.78 -0.22 1.05 2.43 -1.33 -1.03 114.38 116.67 2kui h ARG 577 Ca 0.43 -0.32 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 2kui h ARG 577 Cb 0.58 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 2kui h ARG 577 CO -0.34 0.94 0.09 -0.07 -1.51 0.00 0.00 179.97 179.07 2kui h LEU 578 N 0.67 0.31 -1.01 3.80 3.38 -0.21 -0.31 115.31 121.94 2kui h LEU 578 Ca 0.09 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2kui h LEU 578 Cb 0.75 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 2kui h LEU 578 CO 0.06 0.40 0.28 0.03 0.09 0.00 0.00 178.44 179.30 2kui h ARG 579 N 0.21 0.99 -0.11 1.13 3.08 -0.88 -0.34 114.38 118.45 2kui h ARG 579 Ca 0.07 -0.16 -0.13 0.00 0.07 0.00 0.00 59.98 59.84 2kui h ARG 579 Cb 0.19 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 2kui h ARG 579 CO -0.01 0.80 -0.49 0.00 -1.07 0.00 0.00 179.97 179.21 2kui h ALA 580 N 1.34 0.96 -0.00 0.04 0.00 -0.79 -2.84 119.26 117.97 2kui h ALA 580 Ca 0.23 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2kui h ALA 580 Cb 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2kui h ALA 580 CO -0.02 0.65 -0.11 1.47 0.00 0.00 0.00 179.25 181.24 2kui n LEU 581 N -3.97 0.18 -0.09 0.00 -0.00 -0.16 -4.90 117.00 108.05 2kui n LEU 581 Ca -0.02 0.28 0.00 0.00 -0.00 0.00 0.00 56.01 56.27 2kui n LEU 581 Cb 0.54 -0.36 0.00 0.00 -0.00 0.00 0.00 43.42 43.60 2kui n LEU 581 CO 0.43 0.04 0.00 0.61 -0.00 0.00 0.00 177.39 178.47 2kui n GLY 582 N 1.42 1.13 3.76 1.47 0.00 -0.94 -5.04 105.19 106.98 2kui n GLY 582 Ca 0.09 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 2kui n GLY 582 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2kui s TRP 583 N -2.19 3.04 -0.27 1.61 -0.00 -0.18 -5.01 118.94 115.94 2kui s TRP 583 Ca 0.00 1.21 -0.02 0.00 -0.00 0.00 0.00 56.10 57.29 2kui s TRP 583 Cb 0.00 -3.75 0.12 0.00 -0.00 0.00 0.00 33.47 29.84 2kui s TRP 583 CO 0.00 -2.26 0.24 0.99 -0.00 0.00 0.00 176.95 175.92 2kui s THR 584 N -0.50 -0.31 0.00 5.86 2.01 -1.26 -4.80 115.64 116.64 2kui s THR 584 Ca 0.54 -0.48 0.00 0.00 0.31 0.00 0.00 61.69 62.07 2kui s THR 584 Cb -0.41 -0.92 0.00 0.00 0.01 0.00 0.00 72.50 71.18 2kui s THR 584 CO 0.47 -0.48 0.00 0.61 -0.69 0.00 0.00 174.62 174.54 2kui n GLY 585 N 5.30 1.68 3.63 4.40 0.00 -1.25 -4.57 105.19 114.38 2kui n GLY 585 Ca -0.04 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 2kui n GLY 585 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2kui s MET 586 N 1.37 3.99 -0.22 1.61 -2.45 -1.26 -4.96 119.30 117.39 2kui s MET 586 Ca 0.00 -0.33 -0.13 0.00 -1.25 0.00 0.00 55.69 53.99 2kui s MET 586 Cb 0.00 -3.32 -0.05 0.00 1.25 0.00 0.00 34.83 32.72 2kui s MET 586 CO 0.00 0.19 0.25 -1.17 1.05 0.00 0.00 175.02 175.34 2kui s LEU 587 N 0.64 4.15 -0.24 4.11 1.98 -1.26 -2.09 118.68 125.96 2kui s LEU 587 Ca 0.05 0.30 0.02 0.00 -2.89 0.00 0.00 54.13 51.60 2kui s LEU 587 Cb -0.13 -2.27 0.06 0.00 0.66 0.00 0.00 46.19 44.51 2kui s LEU 587 CO 0.01 0.03 -0.08 -0.62 -1.89 0.00 0.00 176.35 173.80 2kui s ASP 588 N 0.93 4.06 -0.16 3.68 2.15 -0.36 -5.00 116.67 121.98 2kui s ASP 588 Ca 0.12 -1.25 -0.08 0.00 0.43 0.00 0.00 52.55 51.77 2kui s ASP 588 Cb -0.14 -1.33 -0.04 0.00 -0.30 0.00 0.00 42.92 41.11 2kui s ASP 588 CO 0.05 -0.21 0.14 -1.59 -0.17 0.00 0.00 175.17 173.39 2kui s LYS 589 N 1.28 3.79 0.40 4.34 -2.85 -1.26 -1.02 119.74 124.41 2kui s LYS 589 Ca -0.07 -0.17 -0.26 0.00 -1.00 0.00 0.00 55.97 54.48 2kui s LYS 589 Cb -0.19 -3.30 -0.09 0.00 -2.06 0.00 0.00 37.83 32.20 2kui s LYS 589 CO -0.06 0.56 1.22 0.20 0.10 0.00 0.00 175.35 177.37 2kui s GLY 590 N -0.39 2.90 0.21 0.59 0.00 -0.40 -4.96 107.32 105.26 2kui s GLY 590 Ca 0.12 1.07 -0.32 0.00 0.00 0.00 0.00 44.72 45.59 2kui s GLY 590 CO 0.01 1.62 1.67 0.00 0.00 0.00 0.00 173.10 176.40 2kui s ALA 591 N -1.34 3.88 0.25 3.20 0.00 -1.26 -4.67 121.76 121.82 2kui s ALA 591 Ca 0.56 1.54 -0.31 0.00 0.00 0.00 0.00 51.96 53.75 2kui s ALA 591 Cb -0.34 -3.67 -0.13 0.00 0.00 0.00 0.00 23.12 18.98 2kui s ALA 591 CO 0.43 -0.89 1.41 -0.40 0.00 0.00 0.00 175.76 176.31 2kui n ASP 592 N 3.81 2.85 -3.69 0.00 5.68 -1.26 -4.95 116.55 118.99 2kui n ASP 592 Ca 0.15 1.15 -0.23 0.00 -0.50 0.00 0.00 54.79 55.35 2kui n ASP 592 Cb 0.36 -1.45 -0.17 0.00 -1.14 0.00 0.00 41.12 38.72 2kui n ASP 592 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2kui s VAL 593 N -0.13 0.12 -0.41 2.12 1.01 0.33 -4.90 120.40 118.54 2kui s VAL 593 Ca 0.67 0.05 -0.21 0.00 0.00 0.00 0.00 61.98 62.48 2kui s VAL 593 Cb -0.63 -0.49 0.02 0.00 0.00 0.00 0.00 36.38 35.27 2kui s VAL 593 CO 0.50 0.02 0.67 1.51 0.00 0.00 0.00 175.10 177.80 2kui s ASP 594 N 2.06 6.38 0.00 3.32 -4.77 -1.26 -1.61 116.67 120.79 2kui s ASP 594 Ca 0.03 -0.10 0.01 0.00 -3.30 0.00 0.00 52.55 49.19 2kui s ASP 594 Cb -0.14 -2.33 0.02 0.00 -1.09 0.00 0.00 42.92 39.37 2kui s ASP 594 CO -0.06 -0.73 0.81 0.00 0.70 0.00 0.00 175.17 175.89 2kui n ALA 595 N 6.26 2.07 0.00 2.11 0.00 -1.26 -5.01 120.51 124.68 2kui n ALA 595 Ca -0.01 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.78 2kui n ALA 595 Cb 0.48 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.62 2kui n ALA 595 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 596 N 0.02 4.52 0.05 0.00 0.00 -1.26 -4.87 105.19 103.65 2kui n GLY 596 Ca -0.01 -1.37 -0.12 0.00 0.00 0.00 0.00 46.02 44.52 2kui n GLY 596 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2kui h GLY 597 N 0.00 0.03 2.00 -0.02 0.00 -2.00 -1.19 103.07 101.88 2kui h GLY 597 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.26 2kui h GLY 597 CO 0.00 0.02 -0.28 1.76 0.00 0.00 0.00 176.54 178.04 2kui h SER 598 N -0.12 0.00 0.39 0.19 0.02 -2.02 -2.83 113.55 109.18 2kui h SER 598 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2kui h SER 598 Cb 0.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.69 2kui h SER 598 CO -0.00 0.28 -0.75 0.00 -1.14 0.00 0.00 176.83 175.22 2kui n GLN 599 N -3.43 0.09 -3.95 3.45 1.13 -1.13 -4.60 117.38 108.93 2kui n GLN 599 Ca 0.00 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 54.72 2kui n GLN 599 Cb 0.46 -1.53 -0.06 0.00 0.11 0.00 0.00 30.24 29.22 2kui n GLN 599 CO 0.00 0.00 0.00 -3.38 -1.44 0.00 0.00 177.06 172.24 2kui s HIS 600 N -3.06 3.51 0.00 1.08 -3.43 -0.46 -0.47 115.29 112.45 2kui s HIS 600 Ca 0.08 0.39 0.00 0.00 -0.80 0.00 0.00 55.06 54.73 2kui s HIS 600 Cb 0.16 -1.86 0.00 0.00 -1.43 0.00 0.00 32.58 29.46 2kui s HIS 600 CO 0.76 0.66 0.00 -1.71 -2.00 0.00 0.00 174.74 172.45 2kui n ASN 601 N 1.44 0.00 -4.76 7.38 2.85 -1.26 -4.72 115.26 116.18 2kui n ASN 601 Ca -0.15 0.00 -0.40 0.00 -0.11 0.00 0.00 54.58 53.92 2kui n ASN 601 Cb 0.54 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.52 2kui n ASN 601 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 2kui s ARG 602 N 0.00 4.58 0.04 1.20 3.52 -1.26 0.35 118.95 127.38 2kui s ARG 602 Ca 0.00 1.88 -0.30 0.00 -0.13 0.00 0.00 55.73 57.18 2kui s ARG 602 Cb 0.00 -3.17 -0.04 0.00 -1.56 0.00 0.00 34.95 30.17 2kui s ARG 602 CO 0.00 0.12 1.05 0.08 -0.81 0.00 0.00 175.30 175.74 2kui s VAL 603 N -1.06 4.52 -0.21 7.11 1.01 0.88 -3.98 120.40 128.68 2kui s VAL 603 Ca 0.46 1.85 -0.16 0.00 0.00 0.00 0.00 61.98 64.13 2kui s VAL 603 Cb -0.33 -4.19 -0.09 0.00 0.00 0.00 0.00 36.38 31.77 2kui s VAL 603 CO 0.43 0.17 -0.29 0.52 0.00 0.00 0.00 175.10 175.92 2kui n VAL 604 N 3.71 1.50 -4.20 2.92 0.31 0.42 -3.64 118.33 119.35 2kui n VAL 604 Ca 0.06 -0.05 -0.18 0.00 -0.01 0.00 0.00 64.34 64.16 2kui n VAL 604 Cb 0.49 -2.17 -0.12 0.00 -0.91 0.00 0.00 33.84 31.14 2kui n VAL 604 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 2kui s TYR 605 N -2.66 1.32 -0.02 3.52 -0.85 -1.26 -4.77 117.35 112.64 2kui s TYR 605 Ca -0.31 -0.50 0.05 0.00 -0.52 0.00 0.00 57.07 55.79 2kui s TYR 605 Cb 0.08 -0.72 -0.01 0.00 0.38 0.00 0.00 41.96 41.69 2kui s TYR 605 CO 0.44 0.10 -0.16 1.14 -1.52 0.00 0.00 175.55 175.55 2kui s GLN 606 N -2.12 1.34 0.04 -3.49 -2.07 -1.25 -2.90 119.66 109.20 2kui s GLN 606 Ca 0.03 -0.56 -0.10 0.00 -1.82 0.00 0.00 55.36 52.90 2kui s GLN 606 Cb -0.08 -1.27 -0.04 0.00 -1.09 0.00 0.00 33.01 30.53 2kui s GLN 606 CO 0.03 0.32 1.17 -0.97 -1.32 0.00 0.00 175.29 174.52 2kui h ASN 607 N 5.83 -0.57 -3.45 12.60 -0.73 -1.01 -3.34 115.58 124.90 2kui h ASN 607 Ca -0.35 0.07 -0.60 0.00 1.87 0.00 0.00 56.30 57.29 2kui h ASN 607 Cb 1.16 0.23 -0.10 0.00 0.27 0.00 0.00 38.32 39.88 2kui h ASN 607 CO 0.48 -0.13 -0.01 -2.16 -0.37 0.00 0.00 177.43 175.24 2kui s PRO 608 N -3.83 4.20 0.22 6.67 0.04 -1.26 -4.98 135.00 136.06 2kui s PRO 608 Ca -0.05 0.45 -0.30 0.00 0.04 0.00 0.00 61.00 61.15 2kui s PRO 608 Cb 0.03 -3.56 -0.09 0.00 0.04 0.00 0.00 34.50 30.91 2kui s PRO 608 CO 0.19 -0.16 1.34 -1.25 0.04 0.00 0.00 177.00 177.16 2kui s PRO 609 N 1.68 4.36 0.30 0.56 0.04 -1.26 -4.95 135.00 135.73 2kui s PRO 609 Ca 0.25 2.12 -0.29 0.00 0.04 0.00 0.00 61.00 63.12 2kui s PRO 609 Cb -0.15 -3.17 -0.10 0.00 0.04 0.00 0.00 34.50 31.12 2kui s PRO 609 CO 0.10 -0.28 1.27 0.00 0.04 0.00 0.00 177.00 178.12 2kui s ALA 610 N 0.00 3.49 0.00 8.56 0.00 -1.26 -1.90 121.76 130.65 2kui s ALA 610 Ca 0.57 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.69 2kui s ALA 610 Cb -0.38 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.29 2kui s ALA 610 CO 0.40 -0.53 0.00 0.41 0.00 0.00 0.00 175.76 176.04 2kui n GLY 611 N 1.18 1.04 3.64 0.00 0.00 0.94 -4.70 105.19 107.28 2kui n GLY 611 Ca 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 2kui n GLY 611 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kui s THR 612 N -2.26 2.18 0.02 2.61 2.01 -0.80 -4.84 115.64 114.57 2kui s THR 612 Ca 0.00 -1.95 -0.30 0.00 0.31 0.00 0.00 61.69 59.75 2kui s THR 612 Cb 0.00 -2.93 -0.06 0.00 0.01 0.00 0.00 72.50 69.52 2kui s THR 612 CO 0.00 -0.05 1.36 -0.83 -0.69 0.00 0.00 174.62 174.41 2kui s GLY 613 N -3.75 1.96 0.01 4.40 0.00 -1.26 -2.43 107.32 106.26 2kui s GLY 613 Ca 0.36 0.89 -0.12 0.00 0.00 0.00 0.00 44.72 45.85 2kui s GLY 613 CO 0.19 2.41 0.38 -1.34 0.00 0.00 0.00 173.10 174.74 2kui s VAL 614 N 2.02 5.10 0.46 1.40 -7.23 0.11 -4.65 120.40 117.61 2kui s VAL 614 Ca 0.63 0.65 -0.24 0.00 -1.81 0.00 0.00 61.98 61.20 2kui s VAL 614 Cb -0.31 -3.66 -0.08 0.00 0.56 0.00 0.00 36.38 32.88 2kui s VAL 614 CO 0.27 0.49 1.25 -0.46 -0.31 0.00 0.00 175.10 176.34 2kui n ASN 615 N 1.53 2.39 0.12 4.85 2.04 -1.26 -1.37 115.26 123.56 2kui n ASN 615 Ca -0.13 1.05 0.19 0.00 -0.44 0.00 0.00 54.58 55.26 2kui n ASN 615 Cb 0.53 -1.50 0.77 0.00 -2.53 0.00 0.00 39.78 37.04 2kui n ASN 615 CO 0.00 0.00 0.00 0.08 -0.44 0.00 0.00 177.26 176.90 2kui h ARG 616 N 1.79 0.00 -0.20 -3.83 0.11 -1.75 0.13 114.38 110.63 2kui h ARG 616 Ca -0.48 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.58 2kui h ARG 616 Cb 1.30 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.37 2kui h ARG 616 CO 0.58 0.00 0.07 -0.44 0.10 0.00 0.00 179.97 180.28 2kui h ASP 617 N 0.00 0.24 0.00 0.08 5.19 -1.89 -3.46 116.42 116.58 2kui h ASP 617 Ca 0.16 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.56 2kui h ASP 617 Cb 0.91 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.36 2kui h ASP 617 CO -0.00 0.23 0.00 0.61 -3.12 0.00 0.00 179.24 176.96 2kui n GLY 618 N -1.34 0.38 3.67 2.75 0.00 0.47 -3.85 105.19 107.26 2kui n GLY 618 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2kui n GLY 618 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2kui s ILE 619 N -1.86 3.70 -0.12 -0.61 -1.16 -1.26 -4.55 121.20 115.35 2kui s ILE 619 Ca 0.00 0.91 -0.00 0.00 -0.51 0.00 0.00 60.65 61.05 2kui s ILE 619 Cb 0.00 -3.59 0.03 0.00 0.61 0.00 0.00 42.46 39.51 2kui s ILE 619 CO 0.00 -0.06 -0.08 -0.51 -2.81 0.00 0.00 174.94 171.48 2kui s ILE 620 N 3.60 1.07 -0.20 2.00 -1.16 -0.89 -4.44 121.20 121.18 2kui s ILE 620 Ca 0.68 -0.34 -0.09 0.00 -0.51 0.00 0.00 60.65 60.39 2kui s ILE 620 Cb -0.31 -1.09 -0.05 0.00 0.61 0.00 0.00 42.46 41.62 2kui s ILE 620 CO 0.26 0.35 0.11 -0.89 -2.81 0.00 0.00 174.94 171.96 2kui s THR 621 N 1.69 5.12 0.10 4.00 2.01 -1.26 -1.22 115.64 126.08 2kui s THR 621 Ca 0.05 0.09 0.04 0.00 0.31 0.00 0.00 61.69 62.18 2kui s THR 621 Cb -0.13 -3.33 -0.04 0.00 0.01 0.00 0.00 72.50 69.01 2kui s THR 621 CO -0.08 0.43 -0.11 -1.48 -0.69 0.00 0.00 174.62 172.68 2kui s LEU 622 N 0.51 2.39 -0.04 4.42 2.34 -0.19 -0.36 118.68 127.76 2kui s LEU 622 Ca 0.06 -0.78 0.04 0.00 0.06 0.00 0.00 54.13 53.50 2kui s LEU 622 Cb -0.12 -0.38 -0.00 0.00 -0.56 0.00 0.00 46.19 45.13 2kui s LEU 622 CO 0.00 -0.21 -0.15 -0.60 -1.06 0.00 0.00 176.35 174.33 2kui s ARG 623 N -2.62 1.54 0.15 1.48 3.00 -1.14 -1.28 118.95 120.08 2kui s ARG 623 Ca 0.05 -0.51 -0.04 0.00 -1.00 0.00 0.00 55.73 54.23 2kui s ARG 623 Cb -0.04 -1.35 -0.03 0.00 0.00 0.00 0.00 34.95 33.53 2kui s ARG 623 CO 0.01 0.19 0.15 -0.59 0.00 0.00 0.00 175.30 175.06 2kui s PHE 624 N 0.11 0.71 0.00 5.12 -0.12 -1.26 -0.44 117.98 122.12 2kui s PHE 624 Ca -0.04 -1.07 0.00 0.00 -0.05 0.00 0.00 56.93 55.77 2kui s PHE 624 Cb -0.11 -0.33 0.00 0.00 -0.63 0.00 0.00 43.02 41.95 2kui s PHE 624 CO 0.02 -0.60 0.00 0.41 -0.05 0.00 0.00 175.22 174.99 2kui n GLY 625 N -0.15 1.42 0.00 1.99 0.00 0.38 -4.51 105.19 104.32 2kui n GLY 625 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14