#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 4.27 0.08 -0.61 1.10 -1.26 -5.00 121.20 119.78 2kui s ILE 356 Ca 0.00 1.58 -0.22 0.00 -0.51 0.00 0.00 60.65 61.49 2kui s ILE 356 Cb 0.00 -4.02 -0.07 0.00 0.15 0.00 0.00 42.46 38.53 2kui s ILE 356 CO 0.00 -0.03 0.67 -0.89 -2.11 0.00 0.00 174.94 172.58 2kui s THR 357 N 2.50 4.66 -0.29 4.00 2.01 -1.26 -4.92 115.64 122.34 2kui s THR 357 Ca 0.55 1.44 0.23 0.00 0.31 0.00 0.00 61.69 64.22 2kui s THR 357 Cb -0.24 -4.02 -0.02 0.00 0.01 0.00 0.00 72.50 68.23 2kui s THR 357 CO 0.20 0.48 1.04 0.54 -0.69 0.00 0.00 174.62 176.19 2kui n ARG 358 N 2.09 0.55 -2.59 4.92 5.12 -1.26 -4.74 116.66 120.76 2kui n ARG 358 Ca -0.07 0.09 -0.40 0.00 -1.93 0.00 0.00 57.85 55.54 2kui n ARG 358 Cb 0.50 -1.78 -0.05 0.00 -1.16 0.00 0.00 32.46 29.97 2kui n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2kui s ASP 359 N -5.09 7.41 0.14 0.55 1.01 -1.26 -4.85 116.67 114.58 2kui s ASP 359 Ca 0.00 2.11 0.09 0.00 0.71 0.00 0.00 52.55 55.47 2kui s ASP 359 Cb 0.11 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 2kui s ASP 359 CO 0.79 -0.04 -0.16 0.68 0.21 0.00 0.00 175.17 176.64 2kui s VAL 360 N -0.99 2.89 -0.08 -1.27 -7.23 0.11 -4.65 120.40 109.18 2kui s VAL 360 Ca 0.44 -1.57 -0.14 0.00 -1.81 0.00 0.00 61.98 58.90 2kui s VAL 360 Cb -0.29 -2.36 -0.05 0.00 0.56 0.00 0.00 36.38 34.24 2kui s VAL 360 CO 0.37 0.04 0.34 -1.58 -0.31 0.00 0.00 175.10 173.95 2kui s GLN 361 N -2.34 3.99 -0.24 4.82 0.74 -1.26 -0.30 119.66 125.06 2kui s GLN 361 Ca 0.20 0.24 -0.04 0.00 0.05 0.00 0.00 55.36 55.80 2kui s GLN 361 Cb -0.10 -3.30 -0.00 0.00 1.10 0.00 0.00 33.01 30.71 2kui s GLN 361 CO 0.11 0.52 -0.01 0.08 -0.55 0.00 0.00 175.29 175.44 2kui s VAL 362 N -0.44 3.52 -0.16 1.34 1.01 0.11 -5.00 120.40 120.79 2kui s VAL 362 Ca 0.20 -0.58 -0.28 0.00 0.00 0.00 0.00 61.98 61.32 2kui s VAL 362 Cb -0.15 -2.68 -0.01 0.00 0.00 0.00 0.00 36.38 33.55 2kui s VAL 362 CO 0.09 0.31 0.96 -2.84 0.00 0.00 0.00 175.10 173.62 2kui s PRO 363 N 1.47 4.34 -0.13 2.72 0.02 -1.26 -3.35 135.00 138.82 2kui s PRO 363 Ca 0.04 1.27 -0.07 0.00 0.02 0.00 0.00 61.00 62.26 2kui s PRO 363 Cb -0.15 -3.58 -0.04 0.00 0.02 0.00 0.00 34.50 30.75 2kui s PRO 363 CO -0.02 -0.40 0.11 0.16 -0.33 0.00 0.00 177.00 176.53 2kui s ASP 364 N 1.14 6.12 -0.09 2.53 -4.77 -1.26 -4.97 116.67 115.37 2kui s ASP 364 Ca 0.44 0.35 -0.00 0.00 -3.30 0.00 0.00 52.55 50.05 2kui s ASP 364 Cb -0.17 -1.97 0.08 0.00 -1.09 0.00 0.00 42.92 39.77 2kui s ASP 364 CO 0.13 0.36 1.74 1.33 0.70 0.00 0.00 175.17 179.43 2kui n VAL 365 N 2.33 1.96 -1.66 2.11 0.24 -1.26 -4.93 118.33 117.12 2kui n VAL 365 Ca -0.19 -0.68 -0.39 0.00 -2.04 0.00 0.00 64.34 61.04 2kui n VAL 365 Cb 0.54 -1.29 0.04 0.00 -1.47 0.00 0.00 33.84 31.66 2kui n VAL 365 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2kui n ARG 366 N 0.88 1.32 0.00 7.34 1.85 -1.26 -3.60 116.66 123.18 2kui n ARG 366 Ca 0.09 0.49 0.00 0.00 -1.00 0.00 0.00 57.85 57.43 2kui n ARG 366 Cb 0.57 -2.27 0.00 0.00 -1.05 0.00 0.00 32.46 29.70 2kui n ARG 366 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2kui n GLY 367 N 1.07 0.69 0.00 2.89 0.00 0.10 -4.98 105.19 104.97 2kui n GLY 367 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.47 3.85 -2.72 1.61 6.02 -1.20 -4.90 117.38 118.57 2kui n GLN 368 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 57.00 56.78 2kui n GLN 368 Cb 0.00 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.29 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 0.09 5.41 0.11 1.08 1.04 -1.26 -1.01 113.70 119.16 2kui s SER 369 Ca 0.00 0.05 -0.18 0.00 0.48 0.00 0.00 55.95 56.30 2kui s SER 369 Cb 0.00 -1.02 -0.05 0.00 0.10 0.00 0.00 66.02 65.05 2kui s SER 369 CO 0.00 -1.04 1.65 0.77 0.98 0.00 0.00 173.24 175.60 2kui h SER 370 N 0.15 0.40 -0.28 7.02 4.64 -1.88 -2.08 113.55 121.52 2kui h SER 370 Ca -0.43 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 60.70 2kui h SER 370 Cb 1.29 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2kui h SER 370 CO 0.53 0.46 0.11 0.00 -0.87 0.00 0.00 176.83 177.06 2kui h ALA 371 N 0.96 0.37 -0.27 5.18 0.00 -1.95 0.20 119.26 123.75 2kui h ALA 371 Ca 0.10 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2kui h ALA 371 Cb 0.19 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2kui h ALA 371 CO -0.01 -0.03 -0.04 0.22 0.00 0.00 0.00 179.25 179.39 2kui h ASP 372 N 0.31 0.50 -0.20 0.00 1.82 -1.95 0.51 116.42 117.41 2kui h ASP 372 Ca 0.09 -0.35 -0.04 0.00 -0.39 0.00 0.00 57.03 56.35 2kui h ASP 372 Cb 0.19 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 40.06 2kui h ASP 372 CO -0.01 0.73 -0.01 0.00 -1.61 0.00 0.00 179.24 178.34 2kui h ALA 373 N 0.79 0.27 -0.56 -0.78 0.00 -1.28 -1.23 119.26 116.47 2kui h ALA 373 Ca 0.07 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 2kui h ALA 373 Cb 0.50 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2kui h ALA 373 CO 0.02 0.01 0.08 0.82 0.00 0.00 0.00 179.25 180.18 2kui h ILE 374 N 0.11 1.24 -0.60 0.00 2.04 -0.58 -0.90 117.51 118.83 2kui h ILE 374 Ca 0.05 -0.96 -0.02 0.00 1.00 0.00 0.00 64.86 64.94 2kui h ILE 374 Cb 0.42 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 2kui h ILE 374 CO 0.01 0.35 0.31 0.00 0.00 0.00 0.00 178.15 178.83 2kui h ALA 375 N 1.22 0.77 -0.13 1.87 0.00 -0.70 0.19 119.26 122.48 2kui h ALA 375 Ca 0.17 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2kui h ALA 375 Cb 0.40 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2kui h ALA 375 CO 0.01 0.30 0.05 1.15 0.00 0.00 0.00 179.25 180.76 2kui h THR 376 N 0.81 1.16 -0.61 0.00 2.02 -0.78 -0.61 112.91 114.90 2kui h THR 376 Ca 0.21 -0.48 -0.06 0.00 0.77 0.00 0.00 66.41 66.85 2kui h THR 376 Cb 0.07 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.69 2kui h THR 376 CO -0.03 0.15 0.16 -0.07 0.37 0.00 0.00 175.52 176.09 2kui h LEU 377 N 0.05 0.92 -0.65 2.58 4.07 -0.90 -1.34 115.31 120.03 2kui h LEU 377 Ca 0.04 -0.23 -0.11 0.00 0.08 0.00 0.00 57.88 57.67 2kui h LEU 377 Cb 0.18 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 41.67 2kui h LEU 377 CO -0.00 0.91 -0.12 -0.61 -1.08 0.00 0.00 178.44 177.53 2kui h GLN 378 N 0.89 0.93 0.00 1.13 5.75 -0.55 0.10 115.11 123.36 2kui h GLN 378 Ca 0.19 -0.34 -0.01 0.00 -0.15 0.00 0.00 58.65 58.35 2kui h GLN 378 Cb 0.34 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 28.82 2kui h GLN 378 CO 0.00 0.99 -0.05 -0.91 -2.65 0.00 0.00 178.83 176.21 2kui h ASN 379 N 0.83 0.00 1.43 -0.69 2.35 -0.83 -0.74 115.58 117.93 2kui h ASN 379 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2kui h ASN 379 Cb 0.66 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.03 2kui h ASN 379 CO 0.05 0.05 -0.08 0.03 -1.65 0.00 0.00 177.43 175.83 2kui h ARG 380 N 0.00 0.00 0.00 0.81 2.47 -0.52 -3.47 114.38 113.67 2kui h ARG 380 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2kui h ARG 380 Cb 0.55 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.87 2kui h ARG 380 CO 0.01 0.00 0.00 0.41 0.56 0.00 0.00 179.97 180.95 2kui n GLY 381 N 1.30 0.79 3.84 0.04 0.00 -0.28 -4.82 105.19 106.05 2kui n GLY 381 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 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 3.44 0.05 1.61 0.40 0.28 -4.24 117.98 117.52 2kui s PHE 382 Ca 0.00 1.28 0.00 0.00 -0.60 0.00 0.00 56.93 57.61 2kui s PHE 382 Cb 0.00 -2.57 -0.04 0.00 0.51 0.00 0.00 43.02 40.92 2kui s PHE 382 CO 0.00 0.14 0.18 0.15 0.70 0.00 0.00 175.22 176.39 2kui s LYS 383 N -2.75 3.33 0.09 0.44 -0.14 0.81 -3.74 119.74 117.79 2kui s LYS 383 Ca 0.52 -0.47 0.03 0.00 -1.36 0.00 0.00 55.97 54.68 2kui s LYS 383 Cb -0.12 -2.98 -0.04 0.00 -1.68 0.00 0.00 37.83 33.01 2kui s LYS 383 CO 0.18 0.61 -0.08 0.96 -0.76 0.00 0.00 175.35 176.26 2kui s ILE 384 N -1.46 0.79 -0.06 2.17 -0.00 -1.26 -0.10 121.20 121.28 2kui s ILE 384 Ca 0.33 -1.74 0.01 0.00 -0.00 0.00 0.00 60.65 59.25 2kui s ILE 384 Cb -0.13 -1.45 0.02 0.00 -0.00 0.00 0.00 42.46 40.91 2kui s ILE 384 CO 0.25 -0.70 -0.06 -0.60 -0.00 0.00 0.00 174.94 173.83 2kui s ARG 385 N -3.19 1.11 -0.18 0.37 3.52 -0.07 -4.83 118.95 115.68 2kui s ARG 385 Ca 0.07 -0.17 -0.04 0.00 -0.13 0.00 0.00 55.73 55.46 2kui s ARG 385 Cb 0.00 -1.11 -0.02 0.00 -1.56 0.00 0.00 34.95 32.26 2kui s ARG 385 CO -0.02 -0.12 -0.02 0.99 -0.81 0.00 0.00 175.30 175.32 2kui s THR 386 N 1.13 3.86 -0.22 4.11 2.01 -1.26 0.25 115.64 125.52 2kui s THR 386 Ca -0.07 -0.35 -0.04 0.00 0.31 0.00 0.00 61.69 61.53 2kui s THR 386 Cb -0.14 -2.72 -0.01 0.00 0.01 0.00 0.00 72.50 69.64 2kui s THR 386 CO -0.01 0.46 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.12 2kui s LEU 387 N 0.76 2.94 -0.22 4.42 2.96 0.88 -4.95 118.68 125.47 2kui s LEU 387 Ca -0.01 -0.38 -0.20 0.00 -0.22 0.00 0.00 54.13 53.33 2kui s LEU 387 Cb -0.14 -1.75 -0.02 0.00 0.50 0.00 0.00 46.19 44.77 2kui s LEU 387 CO 0.02 -0.02 0.61 -1.10 -1.32 0.00 0.00 176.35 174.54 2kui s GLN 388 N 1.48 4.16 -0.05 1.98 1.11 -1.26 -0.28 119.66 126.80 2kui s GLN 388 Ca 0.06 0.55 -0.00 0.00 0.01 0.00 0.00 55.36 55.98 2kui s GLN 388 Cb -0.14 -3.61 0.03 0.00 -1.01 0.00 0.00 33.01 28.28 2kui s GLN 388 CO -0.03 -0.30 -0.02 0.15 0.01 0.00 0.00 175.29 175.11 2kui s LYS 389 N 2.12 0.65 -0.04 2.91 1.02 0.26 -4.96 119.74 121.70 2kui s LYS 389 Ca 0.27 0.01 -0.29 0.00 0.02 0.00 0.00 55.97 55.98 2kui s LYS 389 Cb -0.16 -0.84 -0.02 0.00 -0.52 0.00 0.00 37.83 36.29 2kui s LYS 389 CO 0.09 -0.19 0.97 -1.25 -0.92 0.00 0.00 175.35 174.06 2kui s PRO 390 N 1.39 4.50 0.00 -1.68 0.04 -1.25 -0.97 135.00 137.03 2kui s PRO 390 Ca -0.04 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.38 2kui s PRO 390 Cb -0.13 -3.49 0.00 0.00 0.04 0.00 0.00 34.50 30.92 2kui s PRO 390 CO -0.03 -0.14 0.00 -3.47 0.04 0.00 0.00 177.00 173.41 2kui n ASP 391 N 4.28 0.00 -0.00 6.66 -0.08 -0.89 -4.90 116.55 121.63 2kui n ASP 391 Ca 0.07 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.44 2kui n ASP 391 Cb 0.50 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.84 2kui n ASP 391 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2kui n SER 392 N 0.00 0.81 -0.57 1.67 7.64 -1.26 -4.19 113.62 117.71 2kui n SER 392 Ca 0.00 -0.79 0.07 0.00 1.01 0.00 0.00 58.87 59.16 2kui n SER 392 Cb 0.00 1.19 0.08 0.00 -1.01 0.00 0.00 64.21 64.47 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 -1.63 0.21 -3.25 0.44 -1.04 -1.26 -4.96 114.28 102.79 2kui n THR 393 Ca 0.02 -0.61 -0.38 0.00 -2.04 0.00 0.00 64.05 61.04 2kui n THR 393 Cb 0.36 1.11 -0.06 0.00 -1.82 0.00 0.00 70.33 69.92 2kui n THR 393 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2kui s ILE 394 N -1.07 4.71 -0.00 12.58 -1.09 -1.26 -5.01 121.20 130.06 2kui s ILE 394 Ca 0.18 1.23 -0.40 0.00 -2.23 0.00 0.00 60.65 59.42 2kui s ILE 394 Cb 0.12 -3.90 -0.20 0.00 -1.58 0.00 0.00 42.46 36.89 2kui s ILE 394 CO 0.17 0.52 1.07 -2.65 -1.23 0.00 0.00 174.94 172.82 2kui n PRO 395 N 1.61 0.00 -0.68 2.79 -0.02 -1.26 -4.52 135.00 132.92 2kui n PRO 395 Ca -0.09 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.07 2kui n PRO 395 Cb 0.51 -1.50 0.17 0.00 -0.02 0.00 0.00 33.50 32.66 2kui n PRO 395 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2kui n PRO 396 N 1.52 -0.67 0.00 0.52 -0.02 -1.26 -0.53 135.00 134.56 2kui n PRO 396 Ca 0.20 -0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 2kui n PRO 396 Cb 0.08 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 2kui n PRO 396 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2kui n ASP 397 N -3.51 0.00 -4.58 2.55 5.68 -1.26 -4.10 116.55 111.34 2kui n ASP 397 Ca 0.09 0.42 -0.36 0.00 -0.50 0.00 0.00 54.79 54.44 2kui n ASP 397 Cb 0.53 -0.42 -0.11 0.00 -1.14 0.00 0.00 41.12 39.98 2kui n ASP 397 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 2kui s HIS 398 N -2.84 3.22 -0.08 2.11 3.76 -1.26 -2.98 115.29 117.22 2kui s HIS 398 Ca 0.00 0.00 -0.30 0.00 -0.15 0.00 0.00 55.06 54.62 2kui s HIS 398 Cb 0.00 -2.24 -0.05 0.00 1.11 0.00 0.00 32.58 31.40 2kui s HIS 398 CO 0.00 -0.07 1.61 0.14 -0.85 0.00 0.00 174.74 175.56 2kui s VAL 399 N 1.20 3.67 -0.14 -0.90 -7.23 -0.18 -4.82 120.40 112.01 2kui s VAL 399 Ca 0.06 0.81 0.16 0.00 -1.81 0.00 0.00 61.98 61.19 2kui s VAL 399 Cb -0.14 -3.54 -0.23 0.00 0.56 0.00 0.00 36.38 33.04 2kui s VAL 399 CO 0.05 -0.09 0.12 0.00 -0.31 0.00 0.00 175.10 174.87 2kui n ILE 400 N 5.55 0.96 -4.03 -0.62 0.00 -1.26 0.03 119.36 119.99 2kui n ILE 400 Ca 0.17 -0.67 -0.10 0.00 0.00 0.00 0.00 62.75 62.15 2kui n ILE 400 Cb 0.43 -0.43 -0.08 0.00 0.00 0.00 0.00 39.64 39.57 2kui n ILE 400 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2kui s GLY 401 N -4.93 0.70 0.14 4.50 0.00 -1.26 -4.42 107.32 102.05 2kui s GLY 401 Ca -0.08 -1.10 0.00 0.00 0.00 0.00 0.00 44.72 43.54 2kui s GLY 401 CO 0.72 -0.99 0.18 -1.30 0.00 0.00 0.00 173.10 171.71 2kui n THR 402 N -0.21 0.00 -3.60 0.90 -2.24 -1.26 -4.82 114.28 103.04 2kui n THR 402 Ca -0.05 -0.78 -0.37 0.00 -2.27 0.00 0.00 64.05 60.58 2kui n THR 402 Cb 0.63 0.46 -0.09 0.00 -2.10 0.00 0.00 70.33 69.23 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 -1.89 6.23 0.00 3.42 2.15 -1.23 -4.95 116.67 120.40 2kui s ASP 403 Ca 0.13 0.26 0.00 0.00 0.43 0.00 0.00 52.55 53.36 2kui s ASP 403 Cb -0.00 -2.14 0.00 0.00 -0.30 0.00 0.00 42.92 40.48 2kui s ASP 403 CO 0.09 0.06 0.64 -2.65 -0.17 0.00 0.00 175.17 173.14 2kui n PRO 404 N 4.11 0.00 -0.36 4.34 -0.02 -1.26 -2.62 135.00 139.19 2kui n PRO 404 Ca -0.13 0.19 0.06 0.00 -2.02 0.00 0.00 63.50 61.59 2kui n PRO 404 Cb 0.52 -1.54 0.22 0.00 -0.02 0.00 0.00 33.50 32.68 2kui n PRO 404 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kui h ALA 405 N 1.63 1.49 -0.78 3.55 0.00 -1.92 -0.28 119.26 122.95 2kui h ALA 405 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2kui h ALA 405 Cb 0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2kui h ALA 405 CO 0.00 0.30 0.29 0.00 0.00 0.00 0.00 179.25 179.84 2kui h ALA 406 N 1.51 1.02 -0.00 0.00 0.00 -1.80 -2.08 119.26 117.92 2kui h ALA 406 Ca 0.47 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2kui h ALA 406 Cb 0.37 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2kui h ALA 406 CO -0.23 0.67 -0.01 0.09 0.00 0.00 0.00 179.25 179.77 2kui n ASN 407 N -4.27 0.06 -4.96 0.00 5.03 -0.34 0.07 115.26 110.86 2kui n ASN 407 Ca 0.07 -0.35 -0.22 0.00 0.87 0.00 0.00 54.58 54.95 2kui n ASN 407 Cb 0.20 -0.21 -0.02 0.00 -1.02 0.00 0.00 39.78 38.74 2kui n ASN 407 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2kui s THR 408 N -2.46 5.07 -0.37 3.41 2.01 -0.26 -4.78 115.64 118.26 2kui s THR 408 Ca 0.32 -0.83 -0.29 0.00 0.31 0.00 0.00 61.69 61.20 2kui s THR 408 Cb 0.21 -3.81 0.01 0.00 0.01 0.00 0.00 72.50 68.92 2kui s THR 408 CO 0.45 -0.38 1.30 -0.44 -0.69 0.00 0.00 174.62 174.86 2kui s SER 409 N -4.02 6.57 0.32 3.53 0.01 -1.26 -4.09 113.70 114.76 2kui s SER 409 Ca 0.37 0.94 0.04 0.00 1.31 0.00 0.00 55.95 58.61 2kui s SER 409 Cb -0.09 -2.54 -0.06 0.00 0.21 0.00 0.00 66.02 63.53 2kui s SER 409 CO 0.31 -1.22 0.06 0.68 0.41 0.00 0.00 173.24 173.49 2kui s VAL 410 N 4.70 1.16 0.35 3.43 -7.23 0.59 -4.68 120.40 118.72 2kui s VAL 410 Ca 0.56 -2.00 -0.26 0.00 -1.81 0.00 0.00 61.98 58.46 2kui s VAL 410 Cb -0.14 -2.79 -0.09 0.00 0.56 0.00 0.00 36.38 33.92 2kui s VAL 410 CO 0.27 0.00 1.08 -0.55 -0.31 0.00 0.00 175.10 175.59 2kui s SER 411 N -3.48 6.94 0.20 4.85 0.15 -1.26 0.05 113.70 121.14 2kui s SER 411 Ca 0.37 2.17 -0.31 0.00 0.70 0.00 0.00 55.95 58.87 2kui s SER 411 Cb 0.09 -2.61 -0.11 0.00 -1.71 0.00 0.00 66.02 61.69 2kui s SER 411 CO 0.15 -0.37 1.59 0.00 1.20 0.00 0.00 173.24 175.82 2kui s ALA 412 N -1.42 3.80 0.00 5.45 0.00 -1.26 -3.04 121.76 125.28 2kui s ALA 412 Ca 0.52 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.92 2kui s ALA 412 Cb -0.27 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.22 2kui s ALA 412 CO 0.34 -0.83 0.00 0.41 0.00 0.00 0.00 175.76 175.68 2kui n GLY 413 N 3.45 1.24 2.25 0.00 0.00 -1.26 -5.01 105.19 105.86 2kui n GLY 413 Ca 0.13 -0.41 -0.16 0.00 0.00 0.00 0.00 46.02 45.58 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 0.91 0.24 -4.32 1.61 -0.08 -1.17 -4.35 116.55 109.39 2kui n ASP 414 Ca 0.00 -1.38 -0.36 0.00 -1.51 0.00 0.00 54.79 51.55 2kui n ASP 414 Cb 0.22 -0.54 -0.13 0.00 2.34 0.00 0.00 41.12 43.01 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 -4.52 3.22 -0.31 -0.67 2.02 -1.25 -0.13 118.70 117.06 2kui s GLU 415 Ca 0.43 -0.75 -0.09 0.00 0.02 0.00 0.00 54.97 54.58 2kui s GLU 415 Cb -0.01 -3.16 0.00 0.00 0.10 0.00 0.00 34.13 31.06 2kui s GLU 415 CO 0.30 -0.31 0.13 0.42 0.02 0.00 0.00 175.26 175.81 2kui s ILE 416 N 1.47 4.37 -0.06 -1.63 -1.09 0.85 -4.93 121.20 120.19 2kui s ILE 416 Ca 0.04 -0.54 -0.23 0.00 -2.23 0.00 0.00 60.65 57.69 2kui s ILE 416 Cb -0.16 -3.25 -0.04 0.00 -1.58 0.00 0.00 42.46 37.44 2kui s ILE 416 CO -0.01 0.06 0.68 0.42 -1.23 0.00 0.00 174.94 174.86 2kui s THR 417 N 1.57 5.02 -0.05 2.92 -4.23 -1.26 -0.89 115.64 118.72 2kui s THR 417 Ca 0.04 1.40 0.05 0.00 -1.18 0.00 0.00 61.69 62.00 2kui s THR 417 Cb -0.17 -4.02 -0.00 0.00 1.34 0.00 0.00 72.50 69.65 2kui s THR 417 CO 0.05 0.28 -0.19 0.54 -0.54 0.00 0.00 174.62 174.76 2kui s VAL 418 N 0.63 1.62 -0.23 2.29 0.11 0.14 -3.50 120.40 121.45 2kui s VAL 418 Ca 0.36 -0.81 -0.08 0.00 -2.93 0.00 0.00 61.98 58.52 2kui s VAL 418 Cb -0.18 -1.39 -0.03 0.00 -1.53 0.00 0.00 36.38 33.25 2kui s VAL 418 CO 0.18 0.46 0.08 0.54 -3.33 0.00 0.00 175.10 173.03 2kui s ASN 419 N 0.05 5.38 -0.13 3.54 6.03 -1.26 -0.08 114.94 128.48 2kui s ASN 419 Ca -0.06 -0.10 -0.01 0.00 -1.03 0.00 0.00 52.86 51.66 2kui s ASN 419 Cb -0.13 -1.96 -0.02 0.00 -3.03 0.00 0.00 41.25 36.11 2kui s ASN 419 CO 0.03 0.02 -0.09 -0.69 -2.03 0.00 0.00 177.10 174.34 2kui s VAL 420 N 1.29 3.45 -0.13 3.54 1.01 0.62 -4.48 120.40 125.68 2kui s VAL 420 Ca 0.05 -0.53 -0.24 0.00 0.00 0.00 0.00 61.98 61.26 2kui s VAL 420 Cb -0.15 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 2kui s VAL 420 CO 0.04 0.53 0.75 -0.94 0.00 0.00 0.00 175.10 175.48 2kui s SER 421 N 0.14 6.93 -0.32 3.32 1.04 0.31 -0.57 113.70 124.55 2kui s SER 421 Ca -0.04 1.13 0.01 0.00 0.48 0.00 0.00 55.95 57.53 2kui s SER 421 Cb -0.14 -2.42 0.08 0.00 0.10 0.00 0.00 66.02 63.63 2kui s SER 421 CO 0.04 -0.27 0.02 0.28 0.98 0.00 0.00 173.24 174.28 2kui s THR 422 N 1.60 2.60 0.01 2.02 -1.32 -0.14 -4.01 115.64 116.40 2kui s THR 422 Ca 0.37 -1.85 0.00 0.00 -1.21 0.00 0.00 61.69 59.00 2kui s THR 422 Cb -0.17 -2.67 0.00 0.00 -1.51 0.00 0.00 72.50 68.15 2kui s THR 422 CO 0.14 -0.32 0.00 0.61 -2.21 0.00 0.00 174.62 172.84 2kui n GLY 423 N 4.46 -3.73 3.73 6.08 0.00 -1.26 -3.87 105.19 110.59 2kui n GLY 423 Ca -0.07 -0.76 -0.34 0.00 0.00 0.00 0.00 46.02 44.85 2kui n GLY 423 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2kui s PRO 424 N -2.92 2.26 0.28 1.61 0.02 -1.26 -2.09 135.00 132.91 2kui s PRO 424 Ca 0.00 1.69 -0.29 0.00 0.02 0.00 0.00 61.00 62.42 2kui s PRO 424 Cb 0.00 -1.86 -0.09 0.00 0.02 0.00 0.00 34.50 32.57 2kui s PRO 424 CO 0.00 -1.73 1.06 -1.21 -0.33 0.00 0.00 177.00 174.80 2kui s GLU 425 N -3.94 4.64 -0.02 5.54 2.02 -1.26 -4.80 118.70 120.88 2kui s GLU 425 Ca 0.73 1.71 -0.02 0.00 0.02 0.00 0.00 54.97 57.41 2kui s GLU 425 Cb -0.28 -3.14 -0.04 0.00 0.10 0.00 0.00 34.13 30.77 2kui s GLU 425 CO 0.44 0.24 0.12 -1.14 0.02 0.00 0.00 175.26 174.94 2kui s GLN 426 N -1.50 3.22 -0.02 1.61 0.74 -1.26 -4.72 119.66 117.74 2kui s GLN 426 Ca 0.45 -0.39 0.07 0.00 0.05 0.00 0.00 55.36 55.54 2kui s GLN 426 Cb -0.30 -2.97 -0.02 0.00 1.10 0.00 0.00 33.01 30.83 2kui s GLN 426 CO 0.38 0.67 -0.23 1.03 -0.55 0.00 0.00 175.29 176.59 2kui s ARG 427 N -1.69 1.88 0.01 1.67 1.81 -0.99 -4.91 118.95 116.73 2kui s ARG 427 Ca 0.23 -0.82 -0.25 0.00 -1.72 0.00 0.00 55.73 53.17 2kui s ARG 427 Cb -0.12 -1.81 -0.05 0.00 -0.45 0.00 0.00 34.95 32.52 2kui s ARG 427 CO 0.14 0.49 0.75 -2.00 -0.68 0.00 0.00 175.30 174.00 2kui s GLU 428 N -0.53 4.47 -0.13 3.54 2.12 -1.26 -0.06 118.70 126.85 2kui s GLU 428 Ca 0.08 1.01 -0.29 0.00 0.36 0.00 0.00 54.97 56.14 2kui s GLU 428 Cb -0.09 -3.39 -0.01 0.00 0.26 0.00 0.00 34.13 30.90 2kui s GLU 428 CO -0.01 0.21 0.97 0.42 -0.54 0.00 0.00 175.26 176.31 2kui s ILE 429 N 0.25 4.79 0.46 -3.70 1.01 0.32 -4.88 121.20 119.44 2kui s ILE 429 Ca 0.39 1.96 -0.22 0.00 0.00 0.00 0.00 60.65 62.77 2kui s ILE 429 Cb -0.20 -4.28 -0.07 0.00 0.01 0.00 0.00 42.46 37.92 2kui s ILE 429 CO 0.21 -0.01 1.14 -2.16 0.00 0.00 0.00 174.94 174.12 2kui s PRO 430 N 2.18 3.76 -0.67 2.79 0.04 -1.26 -4.06 135.00 137.78 2kui s PRO 430 Ca 0.46 1.69 -0.27 0.00 0.04 0.00 0.00 61.00 62.92 2kui s PRO 430 Cb -0.17 -2.36 0.03 0.00 0.04 0.00 0.00 34.50 32.04 2kui s PRO 430 CO 0.15 -0.53 1.20 0.34 0.04 0.00 0.00 177.00 178.21 2kui s ASP 431 N -1.48 6.26 -0.06 6.66 2.15 -1.26 -4.88 116.67 124.06 2kui s ASP 431 Ca 0.64 -0.33 -0.10 0.00 0.43 0.00 0.00 52.55 53.19 2kui s ASP 431 Cb -0.26 -2.54 -0.05 0.00 -0.30 0.00 0.00 42.92 39.77 2kui s ASP 431 CO 0.32 -1.66 0.27 -0.69 -0.17 0.00 0.00 175.17 173.24 2kui s VAL 432 N 5.23 5.29 0.53 1.11 1.01 -1.26 -5.06 120.40 127.24 2kui s VAL 432 Ca 0.36 0.47 -0.22 0.00 0.00 0.00 0.00 61.98 62.59 2kui s VAL 432 Cb -0.09 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 2kui s VAL 432 CO 0.18 0.58 1.28 -0.94 0.00 0.00 0.00 175.10 176.20 2kui s SER 433 N -1.11 5.51 0.44 3.32 1.04 -1.26 -4.92 113.70 116.71 2kui s SER 433 Ca 0.20 2.57 0.10 0.00 0.48 0.00 0.00 55.95 59.30 2kui s SER 433 Cb -0.14 -2.62 0.96 0.00 0.10 0.00 0.00 66.02 64.32 2kui s SER 433 CO 0.09 -1.39 2.06 0.71 0.98 0.00 0.00 173.24 175.69 2kui h THR 434 N 1.47 1.09 0.00 2.02 1.35 -1.97 0.30 112.91 117.17 2kui h THR 434 Ca -0.50 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 2kui h THR 434 Cb 1.29 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 2kui h THR 434 CO 0.58 0.10 -0.06 0.00 -0.25 0.00 0.00 175.52 175.89 2kui n LEU 435 N -4.46 0.17 -2.28 3.87 -0.00 -1.26 -1.41 117.00 111.62 2kui n LEU 435 Ca 0.01 0.46 -0.32 0.00 -0.00 0.00 0.00 56.01 56.16 2kui n LEU 435 Cb 0.10 -0.45 0.06 0.00 -0.00 0.00 0.00 43.42 43.13 2kui n LEU 435 CO 0.35 -0.01 1.04 0.41 -0.00 0.00 0.00 177.39 179.18 2kui n THR 436 N -1.61 3.27 -0.31 1.47 -1.04 0.09 -4.73 114.28 111.41 2kui n THR 436 Ca 0.07 -3.47 0.15 0.00 -2.04 0.00 0.00 64.05 58.76 2kui n THR 436 Cb 0.35 -1.16 0.39 0.00 -1.82 0.00 0.00 70.33 68.09 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 2.14 0.87 -0.90 -1.42 3.20 -1.62 0.00 116.97 119.24 2kui h TYR 437 Ca 0.53 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.44 2kui h TYR 437 Cb 0.98 -0.26 -0.05 0.00 1.54 0.00 0.00 36.73 38.94 2kui h TYR 437 CO 1.23 0.21 0.59 0.00 -1.64 0.00 0.00 178.16 178.56 2kui h ALA 438 N 1.62 1.37 -0.25 1.82 0.00 -1.92 -1.06 119.26 120.84 2kui h ALA 438 Ca 0.53 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 55.23 2kui h ALA 438 Cb 0.99 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2kui h ALA 438 CO -0.29 0.58 -0.47 1.49 0.00 0.00 0.00 179.25 180.55 2kui h GLU 439 N 1.20 0.66 0.12 0.00 4.57 -1.41 -2.84 114.58 116.88 2kui h GLU 439 Ca 0.33 -0.38 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 2kui h GLU 439 Cb -0.12 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 2kui h GLU 439 CO -0.08 0.99 -0.06 0.00 -1.18 0.00 0.00 179.01 178.68 2kui h ALA 440 N 0.95 -0.16 -0.72 2.92 0.00 -0.53 0.12 119.26 121.83 2kui h ALA 440 Ca 0.03 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2kui h ALA 440 Cb 1.02 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 2kui h ALA 440 CO 0.10 -0.57 0.23 -0.39 0.00 0.00 0.00 179.25 178.61 2kui h VAL 441 N -0.20 1.26 -0.24 0.00 -1.51 -1.25 -0.56 116.25 113.75 2kui h VAL 441 Ca -0.02 -0.89 -0.12 0.00 -1.23 0.00 0.00 66.70 64.45 2kui h VAL 441 Cb 0.16 0.48 -0.01 0.00 -2.13 0.00 0.00 31.29 29.78 2kui h VAL 441 CO 0.03 0.35 -0.34 0.07 -1.23 0.00 0.00 177.57 176.44 2kui h LYS 442 N 1.05 0.51 -0.57 5.19 2.10 -1.32 -1.93 116.57 121.60 2kui h LYS 442 Ca 0.23 -0.23 -0.07 0.00 -2.00 0.00 0.00 60.65 58.58 2kui h LYS 442 Cb 0.30 -0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 31.59 2kui h LYS 442 CO -0.01 0.79 0.06 0.87 -2.00 0.00 0.00 179.45 179.15 2kui h LYS 443 N 0.43 0.94 -0.69 0.07 1.79 -0.57 0.17 116.57 118.71 2kui h LYS 443 Ca 0.05 -0.25 -0.04 0.00 -2.18 0.00 0.00 60.65 58.23 2kui h LYS 443 Cb 0.81 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 31.31 2kui h LYS 443 CO 0.07 0.89 0.26 -0.07 -1.08 0.00 0.00 179.45 179.52 2kui h LEU 444 N 0.88 0.96 -0.30 2.94 3.38 -0.86 -1.14 115.31 121.17 2kui h LEU 444 Ca 0.17 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 2kui h LEU 444 Cb 0.44 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2kui h LEU 444 CO 0.02 0.87 0.00 0.74 0.09 0.00 0.00 178.44 180.15 2kui h THR 445 N 1.01 1.26 0.00 0.22 2.02 -0.83 0.55 112.91 117.13 2kui h THR 445 Ca 0.23 -0.93 0.00 0.00 0.77 0.00 0.00 66.41 66.48 2kui h THR 445 Cb 0.22 1.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 2kui h THR 445 CO -0.02 0.30 0.00 0.00 0.37 0.00 0.00 175.52 176.17 2kui h ALA 446 N 0.84 1.00 -0.14 6.16 0.00 -0.60 -1.70 119.26 124.82 2kui h ALA 446 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2kui h ALA 446 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2kui h ALA 446 CO 0.01 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.26 2kui n ALA 447 N -1.85 2.53 0.00 0.00 0.00 -0.46 -4.97 120.51 115.77 2kui n ALA 447 Ca 0.02 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.98 2kui n ALA 447 Cb 0.24 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.57 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 1.10 2.16 0.08 0.00 0.00 -0.64 -4.71 105.19 103.18 2kui n GLY 448 Ca 0.16 -0.71 -0.02 0.00 0.00 0.00 0.00 46.02 45.45 2kui n GLY 448 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2kui h PHE 449 N 0.00 -0.30 -2.42 1.61 -0.00 -1.74 -3.46 116.94 110.62 2kui h PHE 449 Ca 0.00 0.01 -0.42 0.00 -0.00 0.00 0.00 57.97 57.57 2kui h PHE 449 Cb 0.00 0.14 -0.06 0.00 -0.00 0.00 0.00 35.95 36.03 2kui h PHE 449 CO 0.00 -0.08 -0.49 0.41 -0.00 0.00 0.00 178.31 178.14 2kui n GLY 450 N -1.06 0.17 3.46 6.09 0.00 0.16 -4.85 105.19 109.15 2kui n GLY 450 Ca -0.01 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 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 -4.69 3.00 -0.01 1.61 1.81 -1.26 -4.75 118.95 114.67 2kui s ARG 451 Ca 0.00 -0.99 -0.05 0.00 -1.72 0.00 0.00 55.73 52.96 2kui s ARG 451 Cb 0.00 -3.96 0.00 0.00 -0.45 0.00 0.00 34.95 30.54 2kui s ARG 451 CO 0.00 -0.73 0.11 -0.59 -0.68 0.00 0.00 175.30 173.41 2kui s PHE 452 N 1.68 0.02 -0.05 -0.53 -0.12 -1.26 -1.56 117.98 116.16 2kui s PHE 452 Ca 0.05 -0.06 -0.01 0.00 -0.05 0.00 0.00 56.93 56.86 2kui s PHE 452 Cb -0.19 -0.04 0.03 0.00 -0.63 0.00 0.00 43.02 42.19 2kui s PHE 452 CO 0.10 -0.21 0.02 0.21 -0.05 0.00 0.00 175.22 175.29 2kui s LYS 453 N -0.97 0.28 -0.17 1.99 2.20 -0.49 -4.92 119.74 117.67 2kui s LYS 453 Ca -0.11 0.19 -0.22 0.00 -0.36 0.00 0.00 55.97 55.47 2kui s LYS 453 Cb -0.06 -0.66 -0.02 0.00 -1.51 0.00 0.00 37.83 35.58 2kui s LYS 453 CO 0.01 -0.26 0.70 -1.14 -0.36 0.00 0.00 175.35 174.30 2kui s GLN 454 N 1.74 4.28 0.01 4.03 0.74 -1.26 0.07 119.66 129.27 2kui s GLN 454 Ca 0.00 0.78 0.08 0.00 0.05 0.00 0.00 55.36 56.27 2kui s GLN 454 Cb -0.13 -3.55 -0.02 0.00 1.10 0.00 0.00 33.01 30.41 2kui s GLN 454 CO -0.03 -0.21 -0.24 0.00 -0.55 0.00 0.00 175.29 174.26 2kui s ALA 455 N 1.77 2.03 0.02 1.58 0.00 0.54 -4.95 121.76 122.76 2kui s ALA 455 Ca 0.33 -1.11 0.07 0.00 0.00 0.00 0.00 51.96 51.24 2kui s ALA 455 Cb -0.16 -0.47 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 2kui s ALA 455 CO 0.12 0.49 -0.20 0.54 0.00 0.00 0.00 175.76 176.71 2kui s ASN 456 N -0.89 2.35 -0.02 0.00 2.20 -1.26 -0.03 114.94 117.28 2kui s ASN 456 Ca 0.10 -0.45 -0.02 0.00 -0.94 0.00 0.00 52.86 51.55 2kui s ASN 456 Cb -0.09 -0.22 0.01 0.00 -2.00 0.00 0.00 41.25 38.95 2kui s ASN 456 CO 0.01 0.18 0.06 -0.44 -2.94 0.00 0.00 177.10 173.97 2kui s SER 457 N -0.90 -0.05 0.01 3.54 0.01 -1.04 -4.95 113.70 110.32 2kui s SER 457 Ca 0.07 0.12 -0.30 0.00 1.31 0.00 0.00 55.95 57.14 2kui s SER 457 Cb -0.08 0.11 -0.07 0.00 0.21 0.00 0.00 66.02 66.19 2kui s SER 457 CO 0.01 -0.03 1.67 -2.16 0.41 0.00 0.00 173.24 173.14 2kui s PRO 458 N 0.11 4.19 0.38 12.44 0.04 -1.24 -2.20 135.00 148.72 2kui s PRO 458 Ca -0.01 2.29 0.06 0.00 0.04 0.00 0.00 61.00 63.38 2kui s PRO 458 Cb -0.01 -3.81 -0.02 0.00 0.04 0.00 0.00 34.50 30.69 2kui s PRO 458 CO -0.00 -0.79 0.22 -1.12 0.04 0.00 0.00 177.00 175.34 2kui s SER 459 N 2.96 2.29 0.17 6.66 0.01 0.83 -4.91 113.70 121.72 2kui s SER 459 Ca 0.75 -1.76 -0.33 0.00 1.31 0.00 0.00 55.95 55.92 2kui s SER 459 Cb -0.37 0.59 -0.16 0.00 0.21 0.00 0.00 66.02 66.29 2kui s SER 459 CO 0.32 -1.04 1.23 1.07 0.41 0.00 0.00 173.24 175.23 2kui n THR 460 N -0.79 0.74 -0.12 1.44 5.66 -1.26 -4.60 114.28 115.35 2kui n THR 460 Ca 0.01 -0.19 0.26 0.00 -3.05 0.00 0.00 64.05 61.09 2kui n THR 460 Cb 0.63 -0.93 0.72 0.00 -1.55 0.00 0.00 70.33 69.20 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 3.71 0.00 0.00 1.09 0.13 -1.93 0.16 132.00 135.16 2kui h PRO 461 Ca -0.44 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.63 2kui h PRO 461 Cb 1.33 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.45 2kui h PRO 461 CO 0.72 0.00 -0.28 1.05 -0.23 0.00 0.00 178.00 179.26 2kui h GLU 462 N 0.00 0.00 -0.01 0.86 4.11 -1.98 -3.00 114.58 114.56 2kui h GLU 462 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.80 2kui h GLU 462 Cb 1.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.77 2kui h GLU 462 CO -0.00 0.28 -0.60 1.28 0.07 0.00 0.00 179.01 180.04 2kui n LEU 463 N -3.31 1.77 -4.71 3.06 7.99 -0.01 -4.94 117.00 116.85 2kui n LEU 463 Ca 0.01 -0.70 -0.42 0.00 -0.01 0.00 0.00 56.01 54.89 2kui n LEU 463 Cb 0.53 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.81 2kui n LEU 463 CO 0.35 0.35 1.39 -0.69 -1.51 0.00 0.00 177.39 177.28 2kui s VAL 464 N -2.58 2.22 0.00 4.08 1.01 -0.84 -1.61 120.40 122.67 2kui s VAL 464 Ca 0.16 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.20 2kui s VAL 464 Cb 0.17 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.52 2kui s VAL 464 CO 0.64 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.35 2kui n GLY 465 N 4.04 0.53 3.51 4.51 0.00 0.04 -4.97 105.19 112.85 2kui n GLY 465 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 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 1.73 0.42 1.61 3.01 -0.64 -4.86 119.74 120.16 2kui s LYS 466 Ca 0.00 -1.90 -0.23 0.00 -1.01 0.00 0.00 55.97 52.82 2kui s LYS 466 Cb 0.00 -1.45 -0.09 0.00 -1.01 0.00 0.00 37.83 35.29 2kui s LYS 466 CO 0.00 0.06 1.07 0.08 0.51 0.00 0.00 175.35 177.07 2kui s VAL 467 N -2.81 3.59 -0.20 3.17 1.01 -0.50 -0.24 120.40 124.42 2kui s VAL 467 Ca 0.32 1.19 0.08 0.00 0.00 0.00 0.00 61.98 63.56 2kui s VAL 467 Cb 0.04 -3.60 -0.21 0.00 0.00 0.00 0.00 36.38 32.61 2kui s VAL 467 CO 0.15 -0.03 0.02 -0.38 0.00 0.00 0.00 175.10 174.86 2kui n ILE 468 N -0.26 1.50 -3.91 2.22 5.41 0.59 -4.76 119.36 120.15 2kui n ILE 468 Ca 0.06 -0.70 0.00 0.00 1.00 0.00 0.00 62.75 63.11 2kui n ILE 468 Cb 0.50 -1.09 0.00 0.00 -0.71 0.00 0.00 39.64 38.34 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 1.99 -0.69 3.21 7.39 0.00 -1.19 -5.06 105.19 110.83 2kui n GLY 469 Ca -0.37 -1.10 -0.17 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 -3.00 1.19 -0.07 2.61 -4.23 -1.26 -1.96 115.64 108.92 2kui s THR 470 Ca 0.00 -1.61 -0.16 0.00 -1.18 0.00 0.00 61.69 58.73 2kui s THR 470 Cb 0.00 -1.40 -0.12 0.00 1.34 0.00 0.00 72.50 72.33 2kui s THR 470 CO 0.00 -0.41 0.62 -1.13 -0.54 0.00 0.00 174.62 173.16 2kui h ASN 471 N 3.69 -0.18 -4.28 3.99 -0.73 -1.96 -3.46 115.58 112.65 2kui h ASN 471 Ca -0.39 -0.27 -0.49 0.00 1.87 0.00 0.00 56.30 57.01 2kui h ASN 471 Cb 1.19 0.05 0.11 0.00 0.27 0.00 0.00 38.32 39.94 2kui h ASN 471 CO 0.49 0.38 0.33 -2.16 -0.37 0.00 0.00 177.43 176.11 2kui s PRO 472 N -2.86 2.14 0.02 6.67 0.04 -1.26 -4.97 135.00 134.78 2kui s PRO 472 Ca -0.10 0.72 -0.30 0.00 0.04 0.00 0.00 61.00 61.36 2kui s PRO 472 Cb 0.00 -1.92 -0.06 0.00 0.04 0.00 0.00 34.50 32.57 2kui s PRO 472 CO 0.35 -1.60 1.33 -2.14 0.04 0.00 0.00 177.00 174.97 2kui s PRO 473 N -5.11 4.33 0.00 0.56 0.02 -1.26 -4.89 135.00 128.65 2kui s PRO 473 Ca 0.61 1.90 0.24 0.00 0.02 0.00 0.00 61.00 63.76 2kui s PRO 473 Cb -0.15 -3.47 0.29 0.00 0.02 0.00 0.00 34.50 31.19 2kui s PRO 473 CO 0.55 -0.47 1.32 0.00 -0.33 0.00 0.00 177.00 178.07 2kui n ALA 474 N 4.81 2.44 0.11 -1.55 0.00 -1.26 -3.78 120.51 121.28 2kui n ALA 474 Ca 0.12 -0.81 0.06 0.00 0.00 0.00 0.00 53.44 52.80 2kui n ALA 474 Cb 0.44 -0.84 0.11 0.00 0.00 0.00 0.00 19.45 19.16 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 1.41 2.48 -3.91 0.00 5.03 -1.26 -4.32 115.26 114.70 2kui n ASN 475 Ca 0.16 -1.76 -0.24 0.00 0.87 0.00 0.00 54.58 53.61 2kui n ASN 475 Cb 0.60 -0.13 -0.05 0.00 -1.02 0.00 0.00 39.78 39.18 2kui n ASN 475 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2kui n GLN 476 N 0.57 0.93 -2.29 3.52 1.13 -1.25 -4.52 117.38 115.46 2kui n GLN 476 Ca 0.09 -2.87 -0.42 0.00 -1.94 0.00 0.00 57.00 51.86 2kui n GLN 476 Cb 0.36 0.98 -0.03 0.00 0.11 0.00 0.00 30.24 31.66 2kui n GLN 476 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 2kui s THR 477 N -2.53 3.53 0.03 5.09 -4.23 -1.26 -0.53 115.64 115.74 2kui s THR 477 Ca 0.05 1.17 0.04 0.00 -1.18 0.00 0.00 61.69 61.77 2kui s THR 477 Cb 0.00 -3.75 -0.02 0.00 1.34 0.00 0.00 72.50 70.07 2kui s THR 477 CO 0.03 0.13 -0.13 -0.44 -0.54 0.00 0.00 174.62 173.67 2kui s SER 478 N 0.70 1.55 0.66 3.99 0.01 0.92 -4.92 113.70 116.61 2kui s SER 478 Ca 0.59 -0.39 -0.11 0.00 1.31 0.00 0.00 55.95 57.34 2kui s SER 478 Cb -0.34 -0.11 -0.02 0.00 0.21 0.00 0.00 66.02 65.76 2kui s SER 478 CO 0.33 0.06 1.06 0.00 0.41 0.00 0.00 173.24 175.09 2kui s ALA 479 N -0.71 2.97 0.22 1.44 0.00 -1.26 -2.34 121.76 122.08 2kui s ALA 479 Ca 0.02 -0.15 0.22 0.00 0.00 0.00 0.00 51.96 52.05 2kui s ALA 479 Cb -0.07 -3.07 0.94 0.00 0.00 0.00 0.00 23.12 20.91 2kui s ALA 479 CO 0.01 -0.91 1.85 0.82 0.00 0.00 0.00 175.76 177.52 2kui h ILE 480 N -0.49 0.71 -0.00 0.00 5.03 -1.92 -2.12 117.51 118.72 2kui h ILE 480 Ca -0.44 -1.14 0.00 0.00 -0.12 0.00 0.00 64.86 63.15 2kui h ILE 480 Cb 1.21 1.73 0.00 0.00 -3.03 0.00 0.00 36.82 36.73 2kui h ILE 480 CO 0.62 0.26 -0.62 0.41 -0.68 0.00 0.00 178.15 178.14 2kui n THR 481 N -3.53 0.00 -3.00 -0.27 -1.04 -1.26 -4.27 114.28 100.90 2kui n THR 481 Ca -0.01 -0.02 -0.40 0.00 -2.04 0.00 0.00 64.05 61.58 2kui n THR 481 Cb 0.41 0.52 -0.04 0.00 -1.82 0.00 0.00 70.33 69.40 2kui n THR 481 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2kui s ASN 482 N -2.93 7.02 -0.21 8.00 2.47 -0.80 -5.04 114.94 123.46 2kui s ASN 482 Ca 0.12 1.23 -0.13 0.00 0.42 0.00 0.00 52.86 54.50 2kui s ASN 482 Cb 0.17 -2.43 -0.05 0.00 -1.45 0.00 0.00 41.25 37.50 2kui s ASN 482 CO 0.72 -0.16 0.25 0.54 -3.72 0.00 0.00 177.10 174.74 2kui s VAL 483 N 0.95 5.31 -0.22 -5.21 0.11 -1.26 -4.57 120.40 115.51 2kui s VAL 483 Ca 0.39 0.41 -0.10 0.00 -2.93 0.00 0.00 61.98 59.75 2kui s VAL 483 Cb -0.18 -3.59 -0.05 0.00 -1.53 0.00 0.00 36.38 31.03 2kui s VAL 483 CO 0.19 0.34 0.14 0.68 -3.33 0.00 0.00 175.10 173.12 2kui s VAL 484 N 0.92 5.35 -0.20 2.04 -7.23 -0.60 -4.97 120.40 115.71 2kui s VAL 484 Ca 0.13 0.17 -0.18 0.00 -1.81 0.00 0.00 61.98 60.30 2kui s VAL 484 Cb -0.13 -3.47 -0.03 0.00 0.56 0.00 0.00 36.38 33.30 2kui s VAL 484 CO 0.04 0.39 0.48 -0.51 -0.31 0.00 0.00 175.10 175.19 2kui s ILE 485 N 0.73 5.14 -0.28 -0.62 -1.16 -1.26 -1.39 121.20 122.36 2kui s ILE 485 Ca 0.08 0.87 -0.07 0.00 -0.51 0.00 0.00 60.65 61.02 2kui s ILE 485 Cb -0.12 -3.80 -0.00 0.00 0.61 0.00 0.00 42.46 39.14 2kui s ILE 485 CO 0.02 0.20 0.08 -0.63 -2.81 0.00 0.00 174.94 171.79 2kui s ILE 486 N 1.52 4.09 -0.23 2.00 -1.09 0.11 -3.11 121.20 124.50 2kui s ILE 486 Ca 0.22 -0.50 -0.10 0.00 -2.23 0.00 0.00 60.65 58.04 2kui s ILE 486 Cb -0.15 -3.04 -0.05 0.00 -1.58 0.00 0.00 42.46 37.64 2kui s ILE 486 CO 0.09 0.17 0.15 -0.51 -1.23 0.00 0.00 174.94 173.61 2kui s ILE 487 N 1.54 5.34 0.11 2.92 2.07 -0.83 -0.34 121.20 132.02 2kui s ILE 487 Ca 0.04 0.17 0.06 0.00 -1.41 0.00 0.00 60.65 59.51 2kui s ILE 487 Cb -0.16 -3.48 -0.04 0.00 0.13 0.00 0.00 42.46 38.91 2kui s ILE 487 CO 0.03 0.37 -0.02 0.68 -1.91 0.00 0.00 174.94 174.08 2kui s VAL 488 N 0.92 3.78 -0.04 4.00 -7.23 0.95 -0.30 120.40 122.49 2kui s VAL 488 Ca 0.07 -1.17 -0.29 0.00 -1.81 0.00 0.00 61.98 58.79 2kui s VAL 488 Cb -0.13 -2.82 -0.03 0.00 0.56 0.00 0.00 36.38 33.96 2kui s VAL 488 CO 0.03 0.06 0.95 -0.83 -0.31 0.00 0.00 175.10 175.00 2kui s GLY 489 N -2.44 2.71 0.17 2.32 0.00 0.66 -2.49 107.32 108.25 2kui s GLY 489 Ca 0.25 0.44 0.05 0.00 0.00 0.00 0.00 44.72 45.46 2kui s GLY 489 CO 0.17 1.69 -0.10 -0.45 0.00 0.00 0.00 173.10 174.41 2kui s SER 490 N 1.01 1.95 0.00 1.64 0.15 -0.93 -0.78 113.70 116.74 2kui s SER 490 Ca 0.49 -1.04 0.00 0.00 0.70 0.00 0.00 55.95 56.10 2kui s SER 490 Cb -0.20 -0.03 0.00 0.00 -1.71 0.00 0.00 66.02 64.08 2kui s SER 490 CO 0.24 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.97 2kui n GLY 491 N -0.26 1.44 3.49 9.45 0.00 -1.26 -0.12 105.19 117.94 2kui n GLY 491 Ca -0.09 0.35 -0.43 0.00 0.00 0.00 0.00 46.02 45.85 2kui n GLY 491 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2kui s PRO 492 N -0.14 3.20 -1.32 1.61 0.05 -1.26 -4.83 135.00 132.30 2kui s PRO 492 Ca 0.00 -0.53 -0.08 0.00 0.05 0.00 0.00 61.00 60.44 2kui s PRO 492 Cb 0.00 -4.16 0.13 0.00 0.05 0.00 0.00 34.50 30.52 2kui s PRO 492 CO 0.00 -1.79 2.15 0.00 0.05 0.00 0.00 177.00 177.41 2kui n ALA 493 N 8.00 6.08 -2.41 8.56 0.00 -1.26 -4.91 120.51 134.57 2kui n ALA 493 Ca -0.01 -4.17 -0.31 0.00 0.00 0.00 0.00 53.44 48.96 2kui n ALA 493 Cb 0.47 -2.93 -0.14 0.00 0.00 0.00 0.00 19.45 16.85 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 -0.08 2.55 0.05 0.00 -4.23 -1.26 -0.27 115.64 112.40 2kui s THR 494 Ca 0.47 -1.15 0.02 0.00 -1.18 0.00 0.00 61.69 59.85 2kui s THR 494 Cb 0.14 -2.01 -0.03 0.00 1.34 0.00 0.00 72.50 71.94 2kui s THR 494 CO -0.04 0.42 -0.08 -0.54 -0.54 0.00 0.00 174.62 173.84 2kui s LYS 495 N -1.14 0.57 -0.04 3.99 1.02 0.32 -4.91 119.74 119.54 2kui s LYS 495 Ca 0.13 -0.83 -0.25 0.00 0.02 0.00 0.00 55.97 55.04 2kui s LYS 495 Cb -0.10 -0.28 -0.04 0.00 -0.52 0.00 0.00 37.83 36.89 2kui s LYS 495 CO 0.03 0.04 0.75 0.16 -0.92 0.00 0.00 175.35 175.41 2kui s ASP 496 N -1.76 7.07 -0.23 2.83 -4.77 -1.26 -0.79 116.67 117.75 2kui s ASP 496 Ca -0.07 1.29 -0.18 0.00 -3.30 0.00 0.00 52.55 50.28 2kui s ASP 496 Cb -0.08 -2.44 -0.03 0.00 -1.09 0.00 0.00 42.92 39.28 2kui s ASP 496 CO -0.00 -0.12 0.51 0.27 0.70 0.00 0.00 175.17 176.53 2kui s ILE 497 N 0.74 5.09 0.00 2.11 -4.36 0.25 -4.93 121.20 120.10 2kui s ILE 497 Ca 0.40 0.91 0.00 0.00 -0.26 0.00 0.00 60.65 61.70 2kui s ILE 497 Cb -0.18 -3.83 0.00 0.00 1.25 0.00 0.00 42.46 39.69 2kui s ILE 497 CO 0.20 0.13 0.00 -0.81 0.24 0.00 0.00 174.94 174.70 2kui n PRO 498 N 5.20 1.05 -3.59 0.37 -0.04 -1.26 0.75 135.00 137.47 2kui n PRO 498 Ca -0.04 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.07 2kui n PRO 498 Cb 0.50 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.91 2kui n PRO 498 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 2kui s ASP 499 N -1.00 6.61 -0.01 3.54 -4.77 -1.26 -4.67 116.67 115.12 2kui s ASP 499 Ca 0.00 0.76 0.02 0.00 -3.30 0.00 0.00 52.55 50.03 2kui s ASP 499 Cb 0.00 -2.16 0.02 0.00 -1.09 0.00 0.00 42.92 39.69 2kui s ASP 499 CO 0.00 0.15 0.87 0.55 0.70 0.00 0.00 175.17 177.44 2kui n VAL 500 N 0.77 0.19 -3.22 2.11 3.14 -1.26 -5.08 118.33 114.98 2kui n VAL 500 Ca -0.07 -0.23 -0.35 0.00 -2.96 0.00 0.00 64.34 60.73 2kui n VAL 500 Cb 0.52 0.58 -0.06 0.00 -1.06 0.00 0.00 33.84 33.82 2kui n VAL 500 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kui s ALA 501 N -0.28 3.47 0.00 1.55 0.00 -1.26 -3.69 121.76 121.55 2kui s ALA 501 Ca 0.03 0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.00 2kui s ALA 501 Cb 0.02 -2.68 0.00 0.00 0.00 0.00 0.00 23.12 20.46 2kui s ALA 501 CO 0.00 0.39 0.00 0.41 0.00 0.00 0.00 175.76 176.56 2kui n GLY 502 N 0.57 0.61 3.97 0.00 0.00 -0.15 -5.00 105.19 105.19 2kui n GLY 502 Ca -0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.78 2kui n GLY 502 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kui s GLN 503 N -0.65 2.43 0.59 1.61 -0.21 -1.24 -4.83 119.66 117.35 2kui s GLN 503 Ca 0.00 -1.65 -0.06 0.00 0.02 0.00 0.00 55.36 53.67 2kui s GLN 503 Cb 0.00 -2.47 0.00 0.00 1.00 0.00 0.00 33.01 31.54 2kui s GLN 503 CO 0.00 -0.57 0.90 0.95 -2.12 0.00 0.00 175.29 174.46 2kui s THR 504 N -2.60 3.84 0.26 -0.19 -4.23 -1.26 -0.06 115.64 111.40 2kui s THR 504 Ca 0.51 0.09 -0.02 0.00 -1.18 0.00 0.00 61.69 61.09 2kui s THR 504 Cb -0.05 -3.52 0.24 0.00 1.34 0.00 0.00 72.50 70.51 2kui s THR 504 CO 0.31 -0.55 1.82 1.62 -0.54 0.00 0.00 174.62 177.28 2kui h VAL 505 N -0.16 0.91 -0.51 2.29 3.04 -1.71 0.11 116.25 120.22 2kui h VAL 505 Ca -0.45 -0.30 -0.08 0.00 -1.01 0.00 0.00 66.70 64.85 2kui h VAL 505 Cb 1.25 -0.04 -0.02 0.00 -2.01 0.00 0.00 31.29 30.47 2kui h VAL 505 CO 0.61 0.16 -0.01 -0.78 -1.01 0.00 0.00 177.57 176.54 2kui h ASP 506 N 0.88 0.88 -0.44 3.17 3.58 -1.93 0.66 116.42 123.21 2kui h ASP 506 Ca 0.44 -0.31 -0.11 0.00 0.42 0.00 0.00 57.03 57.47 2kui h ASP 506 Cb 0.41 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.21 2kui h ASP 506 CO -0.25 0.98 -0.16 0.58 -2.88 0.00 0.00 179.24 177.51 2kui h VAL 507 N 0.77 1.27 -0.27 2.25 2.07 -1.78 -0.21 116.25 120.35 2kui h VAL 507 Ca 0.14 -1.30 -0.02 0.00 0.82 0.00 0.00 66.70 66.35 2kui h VAL 507 Cb 0.53 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 2kui h VAL 507 CO 0.03 0.44 0.11 0.00 0.02 0.00 0.00 177.57 178.16 2kui h ALA 508 N 0.85 0.35 -0.68 1.67 0.00 -0.60 -1.31 119.26 119.54 2kui h ALA 508 Ca 0.11 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2kui h ALA 508 Cb 0.72 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 2kui h ALA 508 CO 0.05 -0.05 0.44 0.37 0.00 0.00 0.00 179.25 180.07 2kui h GLN 509 N 0.28 0.87 -0.32 0.00 4.15 -0.72 -0.97 115.11 118.40 2kui h GLN 509 Ca 0.09 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.47 2kui h GLN 509 Cb 0.19 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 2kui h GLN 509 CO -0.01 0.57 0.20 -0.22 -1.93 0.00 0.00 178.83 177.44 2kui h LYS 510 N 0.89 0.39 -0.34 1.69 3.64 -0.79 0.13 116.57 122.18 2kui h LYS 510 Ca 0.26 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 2kui h LYS 510 Cb -0.07 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 2kui h LYS 510 CO -0.07 0.26 0.16 -0.91 -2.27 0.00 0.00 179.45 176.62 2kui h ASN 511 N 0.40 0.45 -0.65 4.20 2.35 -0.69 -0.96 115.58 120.68 2kui h ASN 511 Ca 0.12 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2kui h ASN 511 Cb -0.02 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.20 2kui h ASN 511 CO -0.05 0.45 0.43 -0.07 -1.65 0.00 0.00 177.43 176.54 2kui h LEU 512 N 0.41 0.75 -0.92 1.61 4.07 -0.82 -1.39 115.31 119.03 2kui h LEU 512 Ca 0.12 -0.03 -0.02 0.00 0.08 0.00 0.00 57.88 58.03 2kui h LEU 512 Cb 0.13 -0.19 -0.04 0.00 1.08 0.00 0.00 40.66 41.64 2kui h LEU 512 CO -0.01 0.55 0.48 0.78 -1.08 0.00 0.00 178.44 179.16 2kui h ASN 513 N 0.88 1.12 0.02 -0.43 -0.26 -0.43 -0.83 115.58 115.64 2kui h ASN 513 Ca 0.24 -0.10 -0.06 0.00 -0.56 0.00 0.00 56.30 55.82 2kui h ASN 513 Cb -0.09 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 36.87 2kui h ASN 513 CO -0.05 0.90 -0.15 0.58 -1.06 0.00 0.00 177.43 177.65 2kui h VAL 514 N 1.25 1.20 -0.06 2.81 2.07 -0.65 -2.10 116.25 120.76 2kui h VAL 514 Ca 0.31 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2kui h VAL 514 Cb 0.04 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2kui h VAL 514 CO -0.05 0.27 0.00 -1.22 0.02 0.00 0.00 177.57 176.60 2kui n TYR 515 N -4.24 0.07 0.00 1.57 4.01 -0.56 -4.88 117.16 113.13 2kui n TYR 515 Ca -0.01 -0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 2kui n TYR 515 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.32 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 1.04 2.84 3.55 2.72 0.00 -0.79 -4.97 105.19 109.58 2kui n GLY 516 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.73 1.61 -1.25 1.61 0.08 -0.43 -4.76 117.98 112.12 2kui s PHE 517 Ca 0.00 0.87 0.14 0.00 0.12 0.00 0.00 56.93 58.06 2kui s PHE 517 Cb 0.00 -4.03 0.41 0.00 -0.57 0.00 0.00 43.02 38.84 2kui s PHE 517 CO 0.00 -2.27 1.34 0.25 -0.10 0.00 0.00 175.22 174.45 2kui n THR 518 N 7.38 1.00 -4.03 0.64 -2.24 -1.24 -3.48 114.28 112.31 2kui n THR 518 Ca 0.24 -1.00 -0.31 0.00 -2.27 0.00 0.00 64.05 60.71 2kui n THR 518 Cb 0.52 0.50 -0.16 0.00 -2.10 0.00 0.00 70.33 69.09 2kui n THR 518 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2kui s LYS 519 N -1.00 2.16 0.11 -0.78 1.02 -1.26 -5.11 119.74 114.89 2kui s LYS 519 Ca 0.31 -1.00 0.04 0.00 0.02 0.00 0.00 55.97 55.34 2kui s LYS 519 Cb 0.16 -2.59 -0.04 0.00 -0.52 0.00 0.00 37.83 34.85 2kui s LYS 519 CO 0.21 -0.46 -0.11 -0.59 -0.92 0.00 0.00 175.35 173.49 2kui s PHE 520 N 1.30 1.16 -0.02 3.18 -0.12 -1.26 -1.16 117.98 121.06 2kui s PHE 520 Ca -0.03 -0.68 0.01 0.00 -0.05 0.00 0.00 56.93 56.19 2kui s PHE 520 Cb -0.17 -0.62 0.01 0.00 -0.63 0.00 0.00 43.02 41.61 2kui s PHE 520 CO -0.08 0.04 -0.05 -1.12 -0.05 0.00 0.00 175.22 173.96 2kui s SER 521 N -2.65 0.69 -0.16 1.98 0.01 0.76 -4.85 113.70 109.47 2kui s SER 521 Ca 0.09 -0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.26 2kui s SER 521 Cb -0.02 -0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.04 2kui s SER 521 CO 0.00 0.02 -0.16 0.00 0.41 0.00 0.00 173.24 173.52 2kui s GLN 522 N 0.23 3.17 -0.18 12.44 -2.07 -1.26 -0.23 119.66 131.75 2kui s GLN 522 Ca -0.02 -0.77 -0.03 0.00 -1.82 0.00 0.00 55.36 52.71 2kui s GLN 522 Cb -0.06 -2.62 -0.02 0.00 -1.09 0.00 0.00 33.01 29.22 2kui s GLN 522 CO -0.00 -0.03 -0.05 0.00 -1.32 0.00 0.00 175.29 173.89 2kui s ALA 523 N 0.93 2.87 -0.25 2.60 0.00 0.06 -4.97 121.76 123.00 2kui s ALA 523 Ca -0.03 -0.98 -0.18 0.00 0.00 0.00 0.00 51.96 50.76 2kui s ALA 523 Cb -0.15 -1.59 -0.03 0.00 0.00 0.00 0.00 23.12 21.36 2kui s ALA 523 CO -0.02 -0.07 0.53 -1.54 0.00 0.00 0.00 175.76 174.65 2kui s SER 524 N 0.87 6.47 0.15 0.00 1.04 -1.26 -0.04 113.70 120.92 2kui s SER 524 Ca -0.01 0.56 0.11 0.00 0.48 0.00 0.00 55.95 57.09 2kui s SER 524 Cb -0.15 -2.29 -0.04 0.00 0.10 0.00 0.00 66.02 63.65 2kui s SER 524 CO 0.01 -0.28 -0.24 0.68 0.98 0.00 0.00 173.24 174.40 2kui s VAL 525 N 2.21 2.17 0.24 5.02 -7.23 -0.10 -4.95 120.40 117.77 2kui s VAL 525 Ca 0.22 -1.86 -0.30 0.00 -1.81 0.00 0.00 61.98 58.24 2kui s VAL 525 Cb -0.16 -1.97 -0.10 0.00 0.56 0.00 0.00 36.38 34.72 2kui s VAL 525 CO 0.09 -0.06 1.38 1.51 -0.31 0.00 0.00 175.10 177.72 2kui s ASP 526 N -2.35 6.75 0.21 4.85 -4.77 -1.26 -1.48 116.67 118.62 2kui s ASP 526 Ca 0.16 2.58 -0.14 0.00 -3.30 0.00 0.00 52.55 51.84 2kui s ASP 526 Cb -0.09 -2.62 0.01 0.00 -1.09 0.00 0.00 42.92 39.13 2kui s ASP 526 CO 0.07 -0.63 0.47 -0.44 0.70 0.00 0.00 175.17 175.34 2kui s SER 527 N 0.28 -0.14 0.00 2.11 0.01 -0.48 -4.79 113.70 110.68 2kui s SER 527 Ca 0.58 -0.70 0.25 0.00 1.31 0.00 0.00 55.95 57.39 2kui s SER 527 Cb -0.40 0.56 0.57 0.00 0.21 0.00 0.00 66.02 66.96 2kui s SER 527 CO 0.42 -1.06 1.45 -0.81 0.41 0.00 0.00 173.24 173.66 2kui n PRO 528 N -0.33 0.49 -2.84 12.44 -0.04 -1.26 -4.02 135.00 139.44 2kui n PRO 528 Ca -0.07 -0.30 -0.40 0.00 -0.04 0.00 0.00 63.50 62.68 2kui n PRO 528 Cb 0.62 -1.49 -0.05 0.00 -0.04 0.00 0.00 33.50 32.54 2kui n PRO 528 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2kui s ARG 529 N -2.72 4.65 0.63 0.54 1.81 -1.26 -4.88 118.95 117.72 2kui s ARG 529 Ca 0.18 1.30 -0.19 0.00 -1.72 0.00 0.00 55.73 55.31 2kui s ARG 529 Cb 0.18 -3.34 -0.02 0.00 -0.45 0.00 0.00 34.95 31.32 2kui s ARG 529 CO 0.61 0.35 1.26 -2.30 -0.68 0.00 0.00 175.30 174.53 2kui n PRO 530 N 2.37 1.17 -1.78 3.54 -0.02 -1.26 -2.45 135.00 136.57 2kui n PRO 530 Ca -0.01 0.45 -0.42 0.00 -2.02 0.00 0.00 63.50 61.50 2kui n PRO 530 Cb 0.49 -2.49 -0.03 0.00 -0.02 0.00 0.00 33.50 31.45 2kui n PRO 530 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kui s ALA 531 N -1.39 3.77 0.00 3.55 0.00 -1.24 -2.60 121.76 123.86 2kui s ALA 531 Ca 0.80 1.41 0.00 0.00 0.00 0.00 0.00 51.96 54.17 2kui s ALA 531 Cb -0.39 -3.73 0.00 0.00 0.00 0.00 0.00 23.12 19.00 2kui s ALA 531 CO 0.42 -1.13 0.00 0.41 0.00 0.00 0.00 175.76 175.47 2kui n GLY 532 N 4.12 1.44 3.69 0.00 0.00 -0.87 -4.94 105.19 108.62 2kui n GLY 532 Ca 0.17 0.00 -0.42 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 0.00 4.39 -0.34 1.61 2.12 -1.07 -1.82 118.70 123.59 2kui s GLU 533 Ca 0.00 1.17 -0.29 0.00 0.36 0.00 0.00 54.97 56.21 2kui s GLU 533 Cb 0.00 -3.53 0.00 0.00 0.26 0.00 0.00 34.13 30.86 2kui s GLU 533 CO 0.00 -0.24 1.35 0.08 -0.54 0.00 0.00 175.26 175.91 2kui s VAL 534 N 1.80 4.04 -0.42 3.70 1.01 0.91 -0.06 120.40 131.38 2kui s VAL 534 Ca 0.43 1.14 0.25 0.00 0.00 0.00 0.00 61.98 63.80 2kui s VAL 534 Cb -0.18 -4.16 0.33 0.00 0.00 0.00 0.00 36.38 32.37 2kui s VAL 534 CO 0.17 -0.57 1.69 0.00 0.00 0.00 0.00 175.10 176.39 2kui h THR 535 N 6.14 0.00 0.00 3.92 1.03 -1.14 -0.37 112.91 122.49 2kui h THR 535 Ca -0.27 -0.81 0.00 0.00 -0.01 0.00 0.00 66.41 65.32 2kui h THR 535 Cb 1.10 1.80 0.00 0.00 -1.07 0.00 0.00 68.15 69.98 2kui h THR 535 CO 1.05 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 177.17 2kui n GLY 536 N 0.96 -2.06 3.52 2.99 0.00 -1.17 -4.76 105.19 104.66 2kui n GLY 536 Ca 0.04 -1.27 -0.25 0.00 0.00 0.00 0.00 46.02 44.54 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 -2.57 2.79 -0.04 2.61 -4.23 -1.26 -0.27 115.64 112.67 2kui s THR 537 Ca 0.00 -2.06 -0.24 0.00 -1.18 0.00 0.00 61.69 58.20 2kui s THR 537 Cb 0.00 -2.43 -0.18 0.00 1.34 0.00 0.00 72.50 71.23 2kui s THR 537 CO 0.00 -0.27 1.08 -1.13 -0.54 0.00 0.00 174.62 173.76 2kui h ASN 538 N 2.54 -0.12 -3.08 3.99 -1.24 -1.40 -3.43 115.58 112.85 2kui h ASN 538 Ca -0.44 -0.43 -0.53 0.00 0.71 0.00 0.00 56.30 55.62 2kui h ASN 538 Cb 1.23 0.03 0.04 0.00 0.73 0.00 0.00 38.32 40.36 2kui h ASN 538 CO 0.56 0.41 0.79 -2.84 -1.29 0.00 0.00 177.43 175.06 2kui s PRO 539 N -3.87 4.27 0.53 6.67 0.02 -1.26 -4.98 135.00 136.38 2kui s PRO 539 Ca -0.15 2.25 -0.21 0.00 0.02 0.00 0.00 61.00 62.92 2kui s PRO 539 Cb 0.01 -3.16 -0.05 0.00 0.02 0.00 0.00 34.50 31.31 2kui s PRO 539 CO 0.58 -0.48 1.22 -2.14 -0.33 0.00 0.00 177.00 175.85 2kui s PRO 540 N 0.56 3.32 0.26 5.54 0.02 -1.26 -4.97 135.00 138.47 2kui s PRO 540 Ca 0.64 1.88 -0.30 0.00 0.02 0.00 0.00 61.00 63.24 2kui s PRO 540 Cb -0.41 -2.18 -0.11 0.00 0.02 0.00 0.00 34.50 31.83 2kui s PRO 540 CO 0.35 -0.94 1.52 0.00 -0.33 0.00 0.00 177.00 177.61 2kui s ALA 541 N -1.53 3.70 0.00 -1.55 0.00 -1.26 -2.23 121.76 118.89 2kui s ALA 541 Ca 0.71 1.44 0.00 0.00 0.00 0.00 0.00 51.96 54.10 2kui s ALA 541 Cb -0.31 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.20 2kui s ALA 541 CO 0.36 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.69 2kui n GLY 542 N 2.39 2.97 3.74 0.00 0.00 0.23 -4.98 105.19 109.54 2kui n GLY 542 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.61 2.92 -0.24 2.61 2.01 -0.95 -4.57 115.64 114.82 2kui s THR 543 Ca 0.00 0.77 -0.14 0.00 0.31 0.00 0.00 61.69 62.63 2kui s THR 543 Cb 0.00 -3.49 -0.04 0.00 0.01 0.00 0.00 72.50 68.98 2kui s THR 543 CO 0.00 0.12 0.33 -0.89 -0.69 0.00 0.00 174.62 173.49 2kui s THR 544 N 0.03 5.23 0.07 -0.82 2.01 -1.26 -0.58 115.64 120.31 2kui s THR 544 Ca 0.58 0.51 0.02 0.00 0.31 0.00 0.00 61.69 63.10 2kui s THR 544 Cb -0.39 -3.66 -0.03 0.00 0.01 0.00 0.00 72.50 68.43 2kui s THR 544 CO 0.41 0.23 -0.07 0.68 -0.69 0.00 0.00 174.62 175.18 2kui s VAL 545 N 1.62 0.56 0.57 3.82 -7.23 0.03 -4.91 120.40 114.86 2kui s VAL 545 Ca 0.14 -1.51 -0.20 0.00 -1.81 0.00 0.00 61.98 58.60 2kui s VAL 545 Cb -0.15 -1.14 -0.04 0.00 0.56 0.00 0.00 36.38 35.61 2kui s VAL 545 CO 0.08 -0.65 1.28 -2.84 -0.31 0.00 0.00 175.10 172.66 2kui s PRO 546 N -2.76 3.03 0.60 4.82 0.02 -1.26 -0.52 135.00 138.94 2kui s PRO 546 Ca 0.01 2.04 0.38 0.00 0.02 0.00 0.00 61.00 63.45 2kui s PRO 546 Cb -0.02 -2.10 1.83 0.00 0.02 0.00 0.00 34.50 34.23 2kui s PRO 546 CO -0.03 -1.22 2.15 -0.39 -0.33 0.00 0.00 177.00 177.19 2kui h VAL 547 N 1.15 0.00 -0.18 3.83 -1.51 -0.99 -0.67 116.25 117.88 2kui h VAL 547 Ca -0.51 -0.29 0.00 0.00 -1.23 0.00 0.00 66.70 64.68 2kui h VAL 547 Cb 1.30 1.28 0.00 0.00 -2.13 0.00 0.00 31.29 31.75 2kui h VAL 547 CO 0.56 0.00 0.00 -0.67 -1.23 0.00 0.00 177.57 176.23 2kui n ASP 548 N -3.07 2.14 -4.89 4.19 2.03 -1.26 -3.60 116.55 112.09 2kui n ASP 548 Ca -0.01 -1.76 -0.29 0.00 0.52 0.00 0.00 54.79 53.25 2kui n ASP 548 Cb 0.20 -0.11 0.00 0.00 -0.72 0.00 0.00 41.12 40.49 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 -1.66 6.28 -0.24 1.67 0.15 -0.26 -4.87 113.70 114.77 2kui s SER 549 Ca 0.34 1.16 -0.14 0.00 0.70 0.00 0.00 55.95 58.01 2kui s SER 549 Cb 0.19 -2.35 -0.04 0.00 -1.71 0.00 0.00 66.02 62.11 2kui s SER 549 CO 0.29 -0.68 0.33 -0.69 1.20 0.00 0.00 173.24 173.68 2kui s VAL 550 N -2.89 5.23 -0.18 4.45 1.01 -1.26 -4.25 120.40 122.51 2kui s VAL 550 Ca 0.51 0.51 -0.09 0.00 0.00 0.00 0.00 61.98 62.91 2kui s VAL 550 Cb -0.11 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 2kui s VAL 550 CO 0.47 0.23 0.12 -0.63 0.00 0.00 0.00 175.10 175.29 2kui s ILE 551 N 1.63 5.33 -0.32 2.22 1.01 -0.31 -4.92 121.20 125.84 2kui s ILE 551 Ca 0.14 0.16 -0.11 0.00 0.00 0.00 0.00 60.65 60.84 2kui s ILE 551 Cb -0.15 -3.41 -0.01 0.00 0.01 0.00 0.00 42.46 38.90 2kui s ILE 551 CO 0.08 0.47 0.19 -0.70 0.00 0.00 0.00 174.94 174.98 2kui s GLU 552 N 0.12 3.43 -0.14 2.79 2.12 -1.25 -0.17 118.70 125.60 2kui s GLU 552 Ca 0.09 -0.67 -0.05 0.00 0.36 0.00 0.00 54.97 54.70 2kui s GLU 552 Cb -0.11 -3.66 -0.04 0.00 0.26 0.00 0.00 34.13 30.58 2kui s GLU 552 CO -0.01 -0.41 0.04 -0.48 -0.54 0.00 0.00 175.26 173.86 2kui s LEU 553 N 1.66 3.73 -0.27 2.70 -0.00 0.67 -0.93 118.68 126.25 2kui s LEU 553 Ca 0.05 0.11 -0.09 0.00 -0.00 0.00 0.00 54.13 54.20 2kui s LEU 553 Cb -0.17 -1.91 -0.04 0.00 -0.00 0.00 0.00 46.19 44.07 2kui s LEU 553 CO 0.08 0.26 0.14 -1.10 -0.00 0.00 0.00 176.35 175.73 2kui s GLN 554 N -0.16 3.79 -0.13 1.48 -0.21 0.62 -0.76 119.66 124.29 2kui s GLN 554 Ca 0.06 -0.41 -0.07 0.00 0.02 0.00 0.00 55.36 54.96 2kui s GLN 554 Cb -0.12 -3.52 -0.04 0.00 1.00 0.00 0.00 33.01 30.33 2kui s GLN 554 CO 0.02 -0.20 0.14 0.08 -2.12 0.00 0.00 175.29 173.20 2kui s VAL 555 N 1.69 5.49 0.17 1.09 1.01 0.94 -0.57 120.40 130.21 2kui s VAL 555 Ca 0.07 0.20 -0.22 0.00 0.00 0.00 0.00 61.98 62.03 2kui s VAL 555 Cb -0.16 -3.40 -0.08 0.00 0.00 0.00 0.00 36.38 32.74 2kui s VAL 555 CO 0.08 0.60 0.72 -0.44 0.00 0.00 0.00 175.10 176.06 2kui s SER 556 N -0.88 7.22 0.06 3.32 0.01 0.91 -0.92 113.70 123.42 2kui s SER 556 Ca 0.14 1.50 0.04 0.00 1.31 0.00 0.00 55.95 58.95 2kui s SER 556 Cb -0.12 -2.45 -0.04 0.00 0.21 0.00 0.00 66.02 63.62 2kui s SER 556 CO 0.03 0.16 -0.04 -1.59 0.41 0.00 0.00 173.24 172.21 2kui s LYS 557 N -1.42 2.48 0.33 12.44 -2.85 -0.55 -2.06 119.74 128.12 2kui s LYS 557 Ca 0.37 -0.82 0.18 0.00 -1.00 0.00 0.00 55.97 54.70 2kui s LYS 557 Cb -0.20 -2.49 0.20 0.00 -2.06 0.00 0.00 37.83 33.28 2kui s LYS 557 CO 0.23 0.56 1.52 0.78 0.10 0.00 0.00 175.35 178.54 2kui h GLY 558 N 3.92 0.00 -5.23 0.59 0.00 -1.65 -1.27 103.07 99.43 2kui h GLY 558 Ca -0.48 0.00 -0.41 0.00 0.00 0.00 0.00 47.33 46.44 2kui h GLY 558 CO 0.56 0.00 -0.65 0.70 0.00 0.00 0.00 176.54 177.15 2kui n ASN 559 N -3.21 -6.15 -4.55 0.19 4.13 -1.26 -4.49 115.26 99.93 2kui n ASN 559 Ca 0.02 -0.43 -0.33 0.00 1.68 0.00 0.00 54.58 55.52 2kui n ASN 559 Cb 0.66 -4.90 -0.12 0.00 -1.54 0.00 0.00 39.78 33.88 2kui n ASN 559 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2kui s GLN 560 N -6.04 2.55 0.07 3.52 -0.21 -1.26 -2.64 119.66 115.64 2kui s GLN 560 Ca 0.46 -0.69 0.08 0.00 0.02 0.00 0.00 55.36 55.23 2kui s GLN 560 Cb -0.20 -2.46 -0.03 0.00 1.00 0.00 0.00 33.01 31.31 2kui s GLN 560 CO 0.57 0.62 -0.22 -0.59 -2.12 0.00 0.00 175.29 173.55 2kui s PHE 561 N -0.86 1.91 -0.19 0.91 -0.71 -0.49 -4.76 117.98 113.79 2kui s PHE 561 Ca 0.14 -0.39 -0.29 0.00 -1.04 0.00 0.00 56.93 55.35 2kui s PHE 561 Cb -0.11 -1.10 -0.02 0.00 -1.21 0.00 0.00 43.02 40.58 2kui s PHE 561 CO 0.04 0.15 1.43 0.08 -1.34 0.00 0.00 175.22 175.58 2kui s VAL 562 N -0.93 3.98 -0.21 -2.49 1.01 -1.26 0.12 120.40 120.62 2kui s VAL 562 Ca 0.08 1.15 -0.13 0.00 0.00 0.00 0.00 61.98 63.08 2kui s VAL 562 Cb -0.09 -3.87 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 2kui s VAL 562 CO 0.03 -0.24 0.27 -0.32 0.00 0.00 0.00 175.10 174.84 2kui s MET 563 N 4.05 4.15 1.20 2.72 1.75 -0.92 -4.93 119.30 127.31 2kui s MET 563 Ca 0.63 -0.03 -0.14 0.00 -1.25 0.00 0.00 55.69 54.90 2kui s MET 563 Cb -0.23 -3.51 0.30 0.00 2.84 0.00 0.00 34.83 34.22 2kui s MET 563 CO 0.23 0.06 1.01 -2.14 -0.65 0.00 0.00 175.02 173.53 2kui s PRO 564 N 1.03 -1.20 0.47 4.11 0.02 -1.26 -0.60 135.00 137.57 2kui s PRO 564 Ca 0.13 0.74 -0.24 0.00 0.02 0.00 0.00 61.00 61.65 2kui s PRO 564 Cb -0.14 -1.53 -0.07 0.00 0.02 0.00 0.00 34.50 32.78 2kui s PRO 564 CO 0.05 -3.89 1.41 0.16 -0.33 0.00 0.00 177.00 174.41 2kui s ASP 565 N -2.56 5.74 0.00 2.53 -4.77 -1.26 -4.58 116.67 111.78 2kui s ASP 565 Ca 0.69 2.88 0.00 0.00 -3.30 0.00 0.00 52.55 52.82 2kui s ASP 565 Cb -0.24 -2.65 0.00 0.00 -1.09 0.00 0.00 42.92 38.94 2kui s ASP 565 CO 0.64 -1.26 0.00 -0.11 0.70 0.00 0.00 175.17 175.14 2kui n LEU 566 N -0.38 1.80 -4.78 2.11 -0.00 -1.26 -5.02 117.00 109.47 2kui n LEU 566 Ca 0.06 0.00 -0.37 0.00 -0.00 0.00 0.00 56.01 55.70 2kui n LEU 566 Cb 0.42 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.80 2kui n LEU 566 CO 0.57 0.27 0.72 -0.55 -0.00 0.00 0.00 177.39 178.41 2kui s SER 567 N -4.11 6.98 0.00 1.96 0.15 -1.26 -3.53 113.70 113.89 2kui s SER 567 Ca 0.00 2.02 0.00 0.00 0.70 0.00 0.00 55.95 58.67 2kui s SER 567 Cb 0.00 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 2kui s SER 567 CO 0.00 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.72 2kui n GLY 568 N 0.51 0.79 3.58 9.45 0.00 -1.26 -5.08 105.19 113.18 2kui n GLY 568 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.47 2.07 0.17 1.61 1.00 -1.23 -4.99 119.30 117.47 2kui s MET 569 Ca 0.00 -1.36 -0.19 0.00 0.00 0.00 0.00 55.69 54.14 2kui s MET 569 Cb 0.00 -2.12 -0.08 0.00 0.00 0.00 0.00 34.83 32.64 2kui s MET 569 CO 0.00 0.41 0.66 -0.06 0.00 0.00 0.00 175.02 176.02 2kui s PHE 570 N -1.94 3.68 0.50 -0.03 0.08 -1.26 -2.55 117.98 116.46 2kui s PHE 570 Ca 0.27 1.30 0.27 0.00 0.12 0.00 0.00 56.93 58.89 2kui s PHE 570 Cb -0.08 -2.54 1.35 0.00 -0.57 0.00 0.00 43.02 41.18 2kui s PHE 570 CO 0.16 0.42 1.88 2.35 -0.10 0.00 0.00 175.22 179.92 2kui h TRP 571 N 3.71 0.19 0.00 0.36 7.01 -0.52 0.47 115.95 127.16 2kui h TRP 571 Ca -0.48 0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.52 2kui h TRP 571 Cb 1.20 -0.06 0.00 0.00 -2.10 0.00 0.00 29.16 28.20 2kui h TRP 571 CO 0.65 0.04 0.00 -0.39 -2.79 0.00 0.00 178.44 175.95 2kui h VAL 572 N 0.13 0.00 0.00 2.65 -1.51 -1.93 -1.34 116.25 114.26 2kui h VAL 572 Ca 0.44 -0.86 -0.36 0.00 -1.23 0.00 0.00 66.70 64.70 2kui h VAL 572 Cb 1.54 1.85 -0.07 0.00 -2.13 0.00 0.00 31.29 32.48 2kui h VAL 572 CO -0.07 0.00 -2.37 -0.67 -1.23 0.00 0.00 177.57 173.23 2kui n ASP 573 N -3.00 1.26 -0.17 4.19 2.03 0.48 -4.45 116.55 116.90 2kui n ASP 573 Ca 0.04 -0.07 -0.11 0.00 0.52 0.00 0.00 54.79 55.16 2kui n ASP 573 Cb 0.48 0.22 0.00 0.00 -0.72 0.00 0.00 41.12 41.10 2kui n ASP 573 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kui h ALA 574 N 0.42 0.69 0.25 -1.67 0.00 -0.18 -2.82 119.26 115.95 2kui h ALA 574 Ca -0.54 -0.38 0.01 0.00 0.00 0.00 0.00 54.91 54.00 2kui h ALA 574 Cb 2.00 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 19.59 2kui h ALA 574 CO -0.03 0.66 -0.41 1.49 0.00 0.00 0.00 179.25 180.95 2kui h GLU 575 N 0.86 -0.70 -0.98 0.00 4.81 -1.46 0.47 114.58 117.58 2kui h GLU 575 Ca 0.12 0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2kui h GLU 575 Cb 0.77 0.16 -0.05 0.00 0.63 0.00 0.00 28.75 30.26 2kui h GLU 575 CO 0.06 -0.47 0.65 -1.35 -0.73 0.00 0.00 179.01 177.17 2kui h PRO 576 N -0.73 1.27 -0.59 0.92 0.11 -1.79 -1.73 132.00 129.46 2kui h PRO 576 Ca -0.00 -0.08 -0.09 0.00 0.11 0.00 0.00 66.00 65.94 2kui h PRO 576 Cb 0.70 -0.29 -0.02 0.00 0.11 0.00 0.00 31.00 31.50 2kui h PRO 576 CO -0.16 0.84 0.03 -0.09 -0.21 0.00 0.00 178.00 178.41 2kui h ARG 577 N 1.31 1.01 -0.11 1.05 1.12 -1.19 -0.38 114.38 117.19 2kui h ARG 577 Ca 0.36 -0.30 -0.02 0.00 -1.11 0.00 0.00 59.98 58.92 2kui h ARG 577 Cb -0.13 -0.11 -0.00 0.00 -0.01 0.00 0.00 29.97 29.72 2kui h ARG 577 CO -0.08 0.97 -0.01 1.25 -3.11 0.00 0.00 179.97 178.99 2kui h LEU 578 N 0.93 0.20 -0.98 3.80 5.85 0.39 -0.74 115.31 124.75 2kui h LEU 578 Ca 0.17 -0.34 -0.08 0.00 0.84 0.00 0.00 57.88 58.47 2kui h LEU 578 Cb 0.50 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 2kui h LEU 578 CO 0.02 0.49 -0.16 0.08 -0.34 0.00 0.00 178.44 178.53 2kui h ARG 579 N -0.10 0.55 0.00 1.25 0.11 -1.25 -2.49 114.38 112.46 2kui h ARG 579 Ca 0.03 -0.18 -0.06 0.00 0.10 0.00 0.00 59.98 59.87 2kui h ARG 579 Cb 0.40 -0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.42 2kui h ARG 579 CO 0.01 0.70 -0.27 0.00 0.10 0.00 0.00 179.97 180.50 2kui h ALA 580 N 1.33 1.51 -0.01 0.08 0.00 -0.82 -1.47 119.26 119.88 2kui h ALA 580 Ca 0.09 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2kui h ALA 580 Cb 0.57 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2kui h ALA 580 CO 0.04 0.34 0.00 1.47 0.00 0.00 0.00 179.25 181.10 2kui n LEU 581 N -4.16 0.25 0.00 0.00 -0.00 -0.31 -4.86 117.00 107.93 2kui n LEU 581 Ca -0.02 -0.09 0.00 0.00 -0.00 0.00 0.00 56.01 55.90 2kui n LEU 581 Cb 0.33 -0.01 0.00 0.00 -0.00 0.00 0.00 43.42 43.74 2kui n LEU 581 CO 0.37 0.05 0.00 0.61 -0.00 0.00 0.00 177.39 178.42 2kui n GLY 582 N 0.97 0.96 3.74 1.47 0.00 -0.55 -4.95 105.19 106.82 2kui n GLY 582 Ca 0.20 -0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.00 3.87 -0.29 1.61 -0.00 -0.97 -5.01 118.94 116.16 2kui s TRP 583 Ca 0.00 1.79 0.02 0.00 -0.00 0.00 0.00 56.10 57.91 2kui s TRP 583 Cb 0.00 -2.98 0.17 0.00 -0.00 0.00 0.00 33.47 30.66 2kui s TRP 583 CO 0.00 0.33 0.46 0.99 -0.00 0.00 0.00 176.95 178.73 2kui s THR 584 N -0.51 -0.73 0.00 5.86 2.01 -1.26 -4.63 115.64 116.37 2kui s THR 584 Ca 0.43 -0.19 0.00 0.00 0.31 0.00 0.00 61.69 62.24 2kui s THR 584 Cb -0.24 -0.97 0.00 0.00 0.01 0.00 0.00 72.50 71.30 2kui s THR 584 CO 0.29 -0.19 0.00 0.61 -0.69 0.00 0.00 174.62 174.65 2kui n GLY 585 N 5.37 3.57 3.69 4.40 0.00 -1.25 -4.67 105.19 116.31 2kui n GLY 585 Ca 0.01 -0.51 -0.38 0.00 0.00 0.00 0.00 46.02 45.15 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 2.11 4.21 -0.19 1.61 -2.45 -1.26 -5.05 119.30 118.29 2kui s MET 586 Ca 0.00 0.18 -0.08 0.00 -1.25 0.00 0.00 55.69 54.54 2kui s MET 586 Cb 0.00 -3.49 -0.04 0.00 1.25 0.00 0.00 34.83 32.54 2kui s MET 586 CO 0.00 0.06 0.09 -1.17 1.05 0.00 0.00 175.02 175.05 2kui s LEU 587 N 0.99 3.97 -0.50 4.11 1.98 -1.26 -4.20 118.68 123.76 2kui s LEU 587 Ca 0.19 0.14 -0.18 0.00 -2.89 0.00 0.00 54.13 51.39 2kui s LEU 587 Cb -0.14 -2.01 0.06 0.00 0.66 0.00 0.00 46.19 44.76 2kui s LEU 587 CO 0.07 0.18 0.56 -0.62 -1.89 0.00 0.00 176.35 174.65 2kui s ASP 588 N 0.36 6.20 -0.19 3.68 2.15 -1.26 -5.02 116.67 122.59 2kui s ASP 588 Ca 0.05 -1.05 -0.16 0.00 0.43 0.00 0.00 52.55 51.83 2kui s ASP 588 Cb -0.12 -2.26 -0.04 0.00 -0.30 0.00 0.00 42.92 40.20 2kui s ASP 588 CO -0.01 -0.83 0.39 -0.75 -0.17 0.00 0.00 175.17 173.80 2kui s LYS 589 N 2.35 4.20 0.00 4.34 2.36 -1.26 -4.88 119.74 126.86 2kui s LYS 589 Ca 0.12 0.21 0.00 0.00 -2.55 0.00 0.00 55.97 53.74 2kui s LYS 589 Cb -0.21 -3.51 0.00 0.00 -1.05 0.00 0.00 37.83 33.06 2kui s LYS 589 CO 0.10 0.03 0.00 0.41 1.55 0.00 0.00 175.35 177.44 2kui n GLY 590 N 3.77 1.75 2.98 5.54 0.00 -1.26 -5.15 105.19 112.83 2kui n GLY 590 Ca -0.09 -0.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.78 2kui n GLY 590 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kui s ALA 591 N -2.00 0.37 0.24 4.61 0.00 -1.26 -5.13 121.76 118.59 2kui s ALA 591 Ca 0.00 -0.42 -0.29 0.00 0.00 0.00 0.00 51.96 51.25 2kui s ALA 591 Cb 0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 23.12 23.02 2kui s ALA 591 CO 0.00 0.01 0.92 0.16 0.00 0.00 0.00 175.76 176.85 2kui s ASP 592 N -0.78 7.59 -0.06 0.00 -4.77 -1.26 -4.89 116.67 112.50 2kui s ASP 592 Ca -0.05 1.90 -0.01 0.00 -3.30 0.00 0.00 52.55 51.09 2kui s ASP 592 Cb -0.05 -2.59 0.03 0.00 -1.09 0.00 0.00 42.92 39.21 2kui s ASP 592 CO -0.00 0.14 0.02 -0.69 0.70 0.00 0.00 175.17 175.34 2kui s VAL 593 N -1.22 0.20 -0.47 2.11 1.01 0.49 -4.90 120.40 117.62 2kui s VAL 593 Ca 0.41 0.22 -0.28 0.00 0.00 0.00 0.00 61.98 62.34 2kui s VAL 593 Cb -0.25 -0.38 0.00 0.00 0.00 0.00 0.00 36.38 35.75 2kui s VAL 593 CO 0.31 0.22 1.55 -0.62 0.00 0.00 0.00 175.10 176.56 2kui s ASP 594 N 1.97 6.03 0.00 3.32 2.15 -1.26 -2.12 116.67 126.76 2kui s ASP 594 Ca 0.04 0.68 0.00 0.00 0.43 0.00 0.00 52.55 53.69 2kui s ASP 594 Cb -0.12 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.96 2kui s ASP 594 CO -0.04 -1.71 0.45 0.00 -0.17 0.00 0.00 175.17 173.69 2kui n ALA 595 N 9.92 0.91 0.00 3.66 0.00 -1.26 -5.04 120.51 128.70 2kui n ALA 595 Ca 0.17 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2kui n ALA 595 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 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 -0.03 3.40 0.37 0.00 0.00 -1.26 -4.80 105.19 102.87 2kui n GLY 596 Ca 0.00 -1.53 0.14 0.00 0.00 0.00 0.00 46.02 44.63 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 0.60 2.00 -0.02 0.00 -1.98 0.26 103.07 103.93 2kui h GLY 597 Ca 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 2kui h GLY 597 CO 0.00 0.08 -0.13 1.76 0.00 0.00 0.00 176.54 178.25 2kui h SER 598 N 0.39 0.00 0.09 0.19 0.02 -2.01 -1.98 113.55 110.26 2kui h SER 598 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2kui h SER 598 Cb 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 2kui h SER 598 CO -0.09 0.13 -1.16 0.00 -1.14 0.00 0.00 176.83 174.57 2kui n GLN 599 N -3.60 0.16 -2.58 3.45 1.13 0.03 -4.77 117.38 111.21 2kui n GLN 599 Ca -0.02 -0.04 -0.41 0.00 -1.94 0.00 0.00 57.00 54.60 2kui n GLN 599 Cb 0.26 -1.52 -0.04 0.00 0.11 0.00 0.00 30.24 29.05 2kui n GLN 599 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 2kui s HIS 600 N -3.12 3.69 -0.20 1.08 3.76 -0.74 0.22 115.29 119.98 2kui s HIS 600 Ca 0.05 1.70 0.00 0.00 -0.15 0.00 0.00 55.06 56.66 2kui s HIS 600 Cb 0.16 -3.19 0.00 0.00 1.11 0.00 0.00 32.58 30.65 2kui s HIS 600 CO 0.86 -0.30 0.00 0.27 -0.85 0.00 0.00 174.74 174.72 2kui n ASN 601 N 2.02 -1.86 -4.23 1.40 0.23 -1.24 -4.83 115.26 106.76 2kui n ASN 601 Ca 0.01 0.05 -0.23 0.00 -0.53 0.00 0.00 54.58 53.87 2kui n ASN 601 Cb 0.46 -1.57 -0.13 0.00 -2.08 0.00 0.00 39.78 36.46 2kui n ASN 601 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 2kui s ARG 602 N -1.17 1.16 0.23 -3.83 3.52 -1.25 0.28 118.95 117.89 2kui s ARG 602 Ca 0.00 -0.95 -0.31 0.00 -0.13 0.00 0.00 55.73 54.34 2kui s ARG 602 Cb 0.00 -1.28 -0.12 0.00 -1.56 0.00 0.00 34.95 31.99 2kui s ARG 602 CO 0.00 0.31 1.69 0.08 -0.81 0.00 0.00 175.30 176.57 2kui s VAL 603 N -0.94 2.04 -0.11 7.11 1.01 -1.06 -4.41 120.40 124.05 2kui s VAL 603 Ca 0.05 0.03 -0.04 0.00 0.00 0.00 0.00 61.98 62.02 2kui s VAL 603 Cb -0.09 -3.02 -0.26 0.00 0.00 0.00 0.00 36.38 33.01 2kui s VAL 603 CO 0.02 0.00 0.39 0.52 0.00 0.00 0.00 175.10 176.03 2kui n VAL 604 N 3.52 1.76 -3.77 2.92 0.31 0.27 -4.62 118.33 118.73 2kui n VAL 604 Ca 0.14 -0.67 -0.10 0.00 -0.01 0.00 0.00 64.34 63.70 2kui n VAL 604 Cb 0.36 -1.65 -0.05 0.00 -0.91 0.00 0.00 33.84 31.59 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 -2.56 0.01 -0.06 3.52 1.13 -1.26 -5.01 117.35 113.10 2kui s TYR 605 Ca -0.21 -0.36 0.01 0.00 -1.41 0.00 0.00 57.07 55.11 2kui s TYR 605 Cb 0.07 0.18 0.02 0.00 -1.10 0.00 0.00 41.96 41.12 2kui s TYR 605 CO 0.77 -0.74 -0.07 -1.14 -2.51 0.00 0.00 175.55 171.86 2kui s GLN 606 N -3.87 1.21 -0.03 -3.49 0.74 -1.26 -4.21 119.66 108.75 2kui s GLN 606 Ca 0.08 -0.21 -0.12 0.00 0.05 0.00 0.00 55.36 55.15 2kui s GLN 606 Cb 0.02 -1.15 -0.07 0.00 1.10 0.00 0.00 33.01 32.91 2kui s GLN 606 CO -0.07 -0.09 0.59 -0.97 -0.55 0.00 0.00 175.29 174.20 2kui h ASN 607 N 7.34 -0.37 -3.35 6.67 -0.73 -1.83 -3.45 115.58 119.86 2kui h ASN 607 Ca -0.33 0.01 -0.56 0.00 1.87 0.00 0.00 56.30 57.29 2kui h ASN 607 Cb 1.16 0.10 -0.05 0.00 0.27 0.00 0.00 38.32 39.80 2kui h ASN 607 CO 0.45 -0.03 0.05 -2.16 -0.37 0.00 0.00 177.43 175.36 2kui s PRO 608 N -3.03 4.39 0.31 6.67 0.05 -1.26 -5.00 135.00 137.12 2kui s PRO 608 Ca -0.06 0.84 -0.29 0.00 0.05 0.00 0.00 61.00 61.54 2kui s PRO 608 Cb 0.01 -3.36 -0.11 0.00 0.05 0.00 0.00 34.50 31.09 2kui s PRO 608 CO 0.19 0.30 1.45 -1.25 0.05 0.00 0.00 177.00 177.75 2kui s PRO 609 N -0.01 4.22 0.15 0.56 0.04 -1.26 -4.95 135.00 133.74 2kui s PRO 609 Ca 0.34 2.41 -0.31 0.00 0.04 0.00 0.00 61.00 63.48 2kui s PRO 609 Cb -0.19 -3.05 -0.09 0.00 0.04 0.00 0.00 34.50 31.22 2kui s PRO 609 CO 0.19 -0.44 1.42 0.00 0.04 0.00 0.00 177.00 178.20 2kui s ALA 610 N -0.54 3.62 0.00 8.56 0.00 -1.26 -2.33 121.76 129.81 2kui s ALA 610 Ca 0.56 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.71 2kui s ALA 610 Cb -0.44 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.14 2kui s ALA 610 CO 0.51 -0.64 0.00 0.41 0.00 0.00 0.00 175.76 176.04 2kui n GLY 611 N 3.26 0.76 3.93 0.00 0.00 0.23 -4.94 105.19 108.43 2kui n GLY 611 Ca 0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.02 5.10 -0.29 2.61 2.01 -0.98 -4.83 115.64 116.23 2kui s THR 612 Ca 0.00 -0.96 -0.29 0.00 0.31 0.00 0.00 61.69 60.75 2kui s THR 612 Cb 0.00 -3.71 -0.01 0.00 0.01 0.00 0.00 72.50 68.79 2kui s THR 612 CO 0.00 -0.24 1.46 -0.83 -0.69 0.00 0.00 174.62 174.32 2kui s GLY 613 N -3.64 1.24 -0.01 4.40 0.00 -1.26 -2.16 107.32 105.89 2kui s GLY 613 Ca 0.34 0.19 -0.10 0.00 0.00 0.00 0.00 44.72 45.15 2kui s GLY 613 CO 0.28 2.80 0.31 -1.34 0.00 0.00 0.00 173.10 175.15 2kui s VAL 614 N 4.99 5.22 0.29 1.40 -7.23 0.12 -4.71 120.40 120.46 2kui s VAL 614 Ca 0.64 0.47 -0.27 0.00 -1.81 0.00 0.00 61.98 61.00 2kui s VAL 614 Cb -0.19 -3.59 -0.14 0.00 0.56 0.00 0.00 36.38 33.01 2kui s VAL 614 CO 0.27 0.49 0.86 -0.46 -0.31 0.00 0.00 175.10 175.96 2kui n ASN 615 N 1.54 0.57 0.12 4.85 6.94 -1.26 -1.40 115.26 126.61 2kui n ASN 615 Ca -0.14 1.14 0.19 0.00 -0.02 0.00 0.00 54.58 55.76 2kui n ASN 615 Cb 0.53 -1.20 0.76 0.00 -2.36 0.00 0.00 39.78 37.51 2kui n ASN 615 CO 0.00 0.00 0.00 0.08 -1.03 0.00 0.00 177.26 176.31 2kui h ARG 616 N 1.66 0.00 0.00 -3.83 0.11 -1.76 0.34 114.38 110.89 2kui h ARG 616 Ca -0.37 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.62 2kui h ARG 616 Cb 1.37 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.43 2kui h ARG 616 CO 0.59 0.00 -0.42 0.38 0.10 0.00 0.00 179.97 180.62 2kui h ASP 617 N 0.00 0.00 -0.78 0.08 2.03 -1.89 -3.47 116.42 112.40 2kui h ASP 617 Ca 0.17 0.00 -0.26 0.00 -0.73 0.00 0.00 57.03 56.21 2kui h ASP 617 Cb 0.91 0.00 -0.09 0.00 -0.83 0.00 0.00 39.33 39.32 2kui h ASP 617 CO -0.00 0.42 -0.25 0.61 -1.03 0.00 0.00 179.24 178.99 2kui n GLY 618 N 0.64 1.16 3.65 7.15 0.00 0.12 -3.97 105.19 113.95 2kui n GLY 618 Ca 0.01 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.50 3.63 -0.23 -0.61 -1.16 -1.26 -4.74 121.20 114.33 2kui s ILE 619 Ca 0.00 0.75 -0.04 0.00 -0.51 0.00 0.00 60.65 60.85 2kui s ILE 619 Cb 0.00 -3.54 -0.00 0.00 0.61 0.00 0.00 42.46 39.53 2kui s ILE 619 CO 0.00 -0.13 -0.04 -0.51 -2.81 0.00 0.00 174.94 171.46 2kui s ILE 620 N 4.46 3.34 -0.31 2.00 1.10 -1.26 -4.43 121.20 126.10 2kui s ILE 620 Ca 0.73 -0.57 -0.13 0.00 -0.51 0.00 0.00 60.65 60.17 2kui s ILE 620 Cb -0.30 -2.55 -0.03 0.00 0.15 0.00 0.00 42.46 39.72 2kui s ILE 620 CO 0.29 0.38 0.28 -0.89 -2.11 0.00 0.00 174.94 172.88 2kui s THR 621 N 1.46 5.25 0.07 4.00 2.01 -1.26 -4.53 115.64 122.64 2kui s THR 621 Ca 0.05 0.09 -0.01 0.00 0.31 0.00 0.00 61.69 62.14 2kui s THR 621 Cb -0.15 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 2kui s THR 621 CO -0.03 0.07 -0.02 -1.48 -0.69 0.00 0.00 174.62 172.47 2kui s LEU 622 N 1.86 2.40 -0.01 4.42 2.34 -1.26 -2.70 118.68 125.74 2kui s LEU 622 Ca 0.09 -1.03 -0.17 0.00 0.06 0.00 0.00 54.13 53.08 2kui s LEU 622 Cb -0.16 0.17 0.03 0.00 -0.56 0.00 0.00 46.19 45.66 2kui s LEU 622 CO 0.11 -0.59 0.36 -0.60 -1.06 0.00 0.00 176.35 174.57 2kui s ARG 623 N -3.92 0.75 0.08 1.48 6.06 -1.26 -4.88 118.95 117.26 2kui s ARG 623 Ca 0.10 -0.19 -0.00 0.00 -2.50 0.00 0.00 55.73 53.14 2kui s ARG 623 Cb 0.08 0.34 -0.04 0.00 0.06 0.00 0.00 34.95 35.38 2kui s ARG 623 CO -0.08 -0.22 -0.02 -0.59 -2.50 0.00 0.00 175.30 171.89 2kui s PHE 624 N -1.55 0.68 0.00 5.12 -0.71 -1.26 -0.57 117.98 119.70 2kui s PHE 624 Ca -0.12 -1.06 0.00 0.00 -1.04 0.00 0.00 56.93 54.72 2kui s PHE 624 Cb -0.04 -0.45 0.00 0.00 -1.21 0.00 0.00 43.02 41.33 2kui s PHE 624 CO 0.04 -0.34 0.00 0.41 -1.34 0.00 0.00 175.22 173.98 2kui n GLY 625 N 0.03 1.55 0.00 1.99 0.00 0.13 -4.63 105.19 104.27 2kui n GLY 625 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14