#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 4.14 0.51 -0.61 1.10 -1.26 -5.03 121.20 120.05 2kui s ILE 356 Ca 0.00 1.63 -0.08 0.00 -0.51 0.00 0.00 60.65 61.68 2kui s ILE 356 Cb 0.00 -4.04 0.12 0.00 0.15 0.00 0.00 42.46 38.68 2kui s ILE 356 CO 0.00 0.18 0.70 0.35 -2.11 0.00 0.00 174.94 174.05 2kui n THR 357 N 3.40 0.00 0.63 4.00 -2.24 -1.26 -4.91 114.28 113.90 2kui n THR 357 Ca 0.06 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 2kui n THR 357 Cb 0.47 -1.72 0.00 0.00 -2.10 0.00 0.00 70.33 66.98 2kui n THR 357 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2kui n ARG 358 N -2.47 0.63 -2.44 -0.78 5.12 -1.26 -4.79 116.66 110.68 2kui n ARG 358 Ca 0.09 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.59 2kui n ARG 358 Cb 0.30 -1.31 -0.03 0.00 -1.16 0.00 0.00 32.46 30.26 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 -0.34 7.06 0.16 0.55 1.11 -1.26 -2.58 116.67 121.38 2kui s ASP 359 Ca 0.00 1.92 0.02 0.00 0.18 0.00 0.00 52.55 54.67 2kui s ASP 359 Cb 0.00 -2.57 -0.05 0.00 1.07 0.00 0.00 42.92 41.38 2kui s ASP 359 CO 0.00 -0.53 -0.02 0.68 1.18 0.00 0.00 175.17 176.48 2kui s VAL 360 N 1.66 0.74 -0.01 -1.27 -7.23 0.12 -4.83 120.40 109.59 2kui s VAL 360 Ca 0.58 -1.98 -0.13 0.00 -1.81 0.00 0.00 61.98 58.63 2kui s VAL 360 Cb -0.27 -2.03 -0.05 0.00 0.56 0.00 0.00 36.38 34.58 2kui s VAL 360 CO 0.26 -0.56 0.37 -1.58 -0.31 0.00 0.00 175.10 173.28 2kui s GLN 361 N -3.88 3.84 -0.08 4.82 0.74 -1.26 -0.26 119.66 123.58 2kui s GLN 361 Ca 0.21 0.32 -0.15 0.00 0.05 0.00 0.00 55.36 55.79 2kui s GLN 361 Cb 0.06 -3.19 -0.05 0.00 1.10 0.00 0.00 33.01 30.93 2kui s GLN 361 CO 0.02 0.69 0.39 0.08 -0.55 0.00 0.00 175.29 175.92 2kui s VAL 362 N -1.11 5.17 0.53 1.34 1.01 0.31 -4.98 120.40 122.67 2kui s VAL 362 Ca 0.24 0.77 -0.20 0.00 0.00 0.00 0.00 61.98 62.79 2kui s VAL 362 Cb -0.16 -3.71 -0.06 0.00 0.00 0.00 0.00 36.38 32.45 2kui s VAL 362 CO 0.13 0.46 1.13 -2.16 0.00 0.00 0.00 175.10 174.66 2kui s PRO 363 N -0.17 3.42 -1.28 2.72 0.04 -1.26 -4.35 135.00 134.12 2kui s PRO 363 Ca 0.22 1.63 -0.13 0.00 0.04 0.00 0.00 61.00 62.77 2kui s PRO 363 Cb -0.15 -2.06 0.14 0.00 0.04 0.00 0.00 34.50 32.47 2kui s PRO 363 CO 0.10 -0.80 1.73 -3.47 0.04 0.00 0.00 177.00 174.60 2kui n ASP 364 N -1.17 4.98 -0.26 6.66 2.03 -1.26 -4.45 116.55 123.08 2kui n ASP 364 Ca 0.11 -3.01 0.13 0.00 0.52 0.00 0.00 54.79 52.54 2kui n ASP 364 Cb 0.51 -1.57 0.32 0.00 -0.72 0.00 0.00 41.12 39.66 2kui n ASP 364 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2kui n VAL 365 N 4.41 0.00 -2.08 5.18 0.24 -1.26 -4.91 118.33 119.91 2kui n VAL 365 Ca 0.41 -0.14 -0.37 0.00 -2.04 0.00 0.00 64.34 62.20 2kui n VAL 365 Cb 0.40 0.50 0.01 0.00 -1.47 0.00 0.00 33.84 33.28 2kui n VAL 365 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2kui s ARG 366 N -2.53 3.52 0.00 7.34 0.52 -1.26 -3.90 118.95 122.65 2kui s ARG 366 Ca 0.23 1.94 0.00 0.00 -0.52 0.00 0.00 55.73 57.38 2kui s ARG 366 Cb 0.19 -2.35 0.00 0.00 0.52 0.00 0.00 34.95 33.31 2kui s ARG 366 CO 0.54 -0.79 0.00 0.41 0.02 0.00 0.00 175.30 175.48 2kui n GLY 367 N 0.55 0.67 0.13 -3.53 0.00 -1.22 -4.98 105.19 96.82 2kui n GLY 367 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.55 0.00 -3.76 1.61 6.02 -1.23 -4.71 117.38 113.76 2kui n GLN 368 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 2kui n GLN 368 Cb 0.00 -0.06 -0.08 0.00 1.02 0.00 0.00 30.24 31.12 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 -1.15 -0.15 0.38 1.08 1.04 -1.26 -3.57 113.70 110.06 2kui s SER 369 Ca 0.00 -0.09 0.07 0.00 0.48 0.00 0.00 55.95 56.40 2kui s SER 369 Cb 0.00 0.34 0.74 0.00 0.10 0.00 0.00 66.02 67.20 2kui s SER 369 CO 0.00 -0.55 1.95 -1.28 0.98 0.00 0.00 173.24 174.34 2kui h SER 370 N 3.45 0.42 -0.10 7.02 0.87 -0.78 -1.64 113.55 122.79 2kui h SER 370 Ca -0.31 -0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.16 2kui h SER 370 Cb 1.19 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 63.04 2kui h SER 370 CO 0.44 0.44 -0.06 0.00 -0.53 0.00 0.00 176.83 177.12 2kui h ALA 371 N 1.62 0.14 -0.19 6.23 0.00 -1.96 -0.27 119.26 124.84 2kui h ALA 371 Ca 0.11 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 2kui h ALA 371 Cb 0.20 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 2kui h ALA 371 CO -0.00 -0.07 -0.18 0.22 0.00 0.00 0.00 179.25 179.22 2kui h ASP 372 N -0.16 0.48 0.06 0.00 3.58 -1.93 -0.49 116.42 117.96 2kui h ASP 372 Ca 0.02 -0.47 -0.00 0.00 0.42 0.00 0.00 57.03 56.99 2kui h ASP 372 Cb 0.53 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.44 2kui h ASP 372 CO 0.02 0.85 -0.03 0.00 -2.88 0.00 0.00 179.24 177.20 2kui h ALA 373 N 0.64 -0.07 -0.38 -0.78 0.00 -1.35 -1.64 119.26 115.67 2kui h ALA 373 Ca 0.03 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 2kui h ALA 373 Cb 0.72 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2kui h ALA 373 CO 0.04 -0.51 -0.35 0.82 0.00 0.00 0.00 179.25 179.26 2kui h ILE 374 N -0.13 1.28 -0.61 0.00 5.03 -1.06 -1.84 117.51 120.18 2kui h ILE 374 Ca -0.01 -1.51 0.01 0.00 -0.12 0.00 0.00 64.86 63.23 2kui h ILE 374 Cb 0.11 1.35 -0.03 0.00 -3.03 0.00 0.00 36.82 35.22 2kui h ILE 374 CO 0.01 0.50 0.40 0.00 -0.68 0.00 0.00 178.15 178.38 2kui h ALA 375 N 0.88 0.78 -0.17 1.87 0.00 -0.95 0.26 119.26 121.92 2kui h ALA 375 Ca 0.07 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2kui h ALA 375 Cb 0.92 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2kui h ALA 375 CO 0.08 0.19 -0.01 1.15 0.00 0.00 0.00 179.25 180.66 2kui h THR 376 N 0.81 1.26 -0.69 0.00 2.02 -1.20 -1.81 112.91 113.30 2kui h THR 376 Ca 0.23 -0.89 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 2kui h THR 376 Cb -0.07 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 2kui h THR 376 CO -0.06 0.27 0.38 -0.07 0.37 0.00 0.00 175.52 176.41 2kui h LEU 377 N 0.05 0.86 -0.70 2.58 3.38 -0.92 -2.18 115.31 118.38 2kui h LEU 377 Ca 0.05 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2kui h LEU 377 Cb 0.41 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2kui h LEU 377 CO 0.01 0.70 0.41 -0.61 0.09 0.00 0.00 178.44 179.04 2kui h GLN 378 N 0.95 0.97 0.00 1.13 5.75 -0.39 0.83 115.11 124.34 2kui h GLN 378 Ca 0.24 -0.10 -0.04 0.00 -0.15 0.00 0.00 58.65 58.61 2kui h GLN 378 Cb 0.03 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.38 2kui h GLN 378 CO -0.04 0.70 -0.17 -0.91 -2.65 0.00 0.00 178.83 175.76 2kui h ASN 379 N 0.96 0.00 1.28 -0.69 2.35 -0.89 -0.38 115.58 118.21 2kui h ASN 379 Ca 0.25 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 2kui h ASN 379 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 2kui h ASN 379 CO -0.04 0.17 -0.10 0.54 -1.65 0.00 0.00 177.43 176.35 2kui n ARG 380 N -3.54 0.21 0.00 0.81 5.12 -0.61 -4.90 116.66 113.75 2kui n ARG 380 Ca -0.01 0.15 0.00 0.00 -1.93 0.00 0.00 57.85 56.06 2kui n ARG 380 Cb 0.32 -1.72 0.00 0.00 -1.16 0.00 0.00 32.46 29.90 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 1.35 0.89 3.79 -0.13 0.00 -0.15 -4.73 105.19 106.21 2kui n GLY 381 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 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 3.04 0.02 1.61 0.08 0.19 -4.38 117.98 116.53 2kui s PHE 382 Ca 0.00 1.59 -0.04 0.00 0.12 0.00 0.00 56.93 58.60 2kui s PHE 382 Cb 0.00 -3.12 -0.04 0.00 -0.57 0.00 0.00 43.02 39.29 2kui s PHE 382 CO 0.00 -0.87 0.24 0.15 -0.10 0.00 0.00 175.22 174.64 2kui s LYS 383 N -3.01 3.51 0.04 0.44 -0.14 0.75 -4.04 119.74 117.29 2kui s LYS 383 Ca 0.65 -0.21 0.02 0.00 -1.36 0.00 0.00 55.97 55.06 2kui s LYS 383 Cb -0.19 -3.06 -0.02 0.00 -1.68 0.00 0.00 37.83 32.87 2kui s LYS 383 CO 0.23 0.64 -0.07 0.96 -0.76 0.00 0.00 175.35 176.35 2kui s ILE 384 N -1.36 0.47 0.06 2.17 -0.00 -1.26 -0.76 121.20 120.52 2kui s ILE 384 Ca 0.29 -1.11 0.08 0.00 -0.00 0.00 0.00 60.65 59.92 2kui s ILE 384 Cb -0.13 -0.62 -0.03 0.00 -0.00 0.00 0.00 42.46 41.68 2kui s ILE 384 CO 0.19 -0.44 -0.20 -0.60 -0.00 0.00 0.00 174.94 173.89 2kui s ARG 385 N -1.71 1.93 -0.10 0.37 6.06 0.78 -4.86 118.95 121.42 2kui s ARG 385 Ca -0.10 -1.06 -0.02 0.00 -2.50 0.00 0.00 55.73 52.06 2kui s ARG 385 Cb -0.09 -2.12 0.03 0.00 0.06 0.00 0.00 34.95 32.83 2kui s ARG 385 CO -0.00 0.52 0.00 0.99 -2.50 0.00 0.00 175.30 174.31 2kui s THR 386 N -0.95 0.44 -0.10 4.11 2.01 -1.26 -0.32 115.64 119.56 2kui s THR 386 Ca 0.15 -0.04 0.03 0.00 0.31 0.00 0.00 61.69 62.13 2kui s THR 386 Cb -0.10 -0.67 -0.01 0.00 0.01 0.00 0.00 72.50 71.73 2kui s THR 386 CO 0.06 0.16 -0.20 -0.22 -0.69 0.00 0.00 174.62 173.73 2kui s LEU 387 N 1.94 2.32 -0.10 4.42 2.96 0.34 -4.96 118.68 125.61 2kui s LEU 387 Ca 0.04 -0.46 -0.19 0.00 -0.22 0.00 0.00 54.13 53.30 2kui s LEU 387 Cb -0.13 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 2kui s LEU 387 CO -0.06 0.18 0.51 -1.10 -1.32 0.00 0.00 176.35 174.55 2kui s GLN 388 N 0.25 4.33 0.02 1.98 1.11 -1.26 -1.30 119.66 124.79 2kui s GLN 388 Ca -0.14 0.52 0.06 0.00 0.01 0.00 0.00 55.36 55.81 2kui s GLN 388 Cb -0.17 -3.42 -0.02 0.00 -1.01 0.00 0.00 33.01 28.40 2kui s GLN 388 CO 0.07 0.20 -0.19 0.15 0.01 0.00 0.00 175.29 175.53 2kui s LYS 389 N 0.47 1.36 -0.21 2.91 -0.14 -0.05 -4.95 119.74 119.13 2kui s LYS 389 Ca 0.27 -0.82 -0.12 0.00 -1.36 0.00 0.00 55.97 53.95 2kui s LYS 389 Cb -0.16 -1.40 -0.05 0.00 -1.68 0.00 0.00 37.83 34.55 2kui s LYS 389 CO 0.12 0.37 0.23 -1.25 -0.76 0.00 0.00 175.35 174.05 2kui s PRO 390 N -0.91 4.16 0.00 -1.68 0.05 -1.26 -1.38 135.00 133.97 2kui s PRO 390 Ca 0.06 -0.09 0.00 0.00 0.05 0.00 0.00 61.00 61.02 2kui s PRO 390 Cb -0.08 -3.49 0.00 0.00 0.05 0.00 0.00 34.50 30.98 2kui s PRO 390 CO 0.01 0.13 0.00 -3.47 0.05 0.00 0.00 177.00 173.72 2kui n ASP 391 N 4.00 0.00 0.00 6.66 -0.08 -0.66 -4.90 116.55 121.57 2kui n ASP 391 Ca -0.13 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.15 2kui n ASP 391 Cb 0.52 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.98 2kui n ASP 391 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 2kui n SER 392 N 1.79 0.11 0.16 1.67 2.88 -1.26 -4.59 113.62 114.37 2kui n SER 392 Ca 0.00 -0.07 0.01 0.00 -1.33 0.00 0.00 58.87 57.48 2kui n SER 392 Cb 0.00 0.16 0.25 0.00 -0.75 0.00 0.00 64.21 63.88 2kui n SER 392 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2kui h THR 393 N 0.00 1.25 -3.31 2.46 1.03 -2.01 -3.37 112.91 108.96 2kui h THR 393 Ca 0.00 -1.80 -0.64 0.00 -0.01 0.00 0.00 66.41 63.96 2kui h THR 393 Cb 0.00 2.00 -0.23 0.00 -1.07 0.00 0.00 68.15 68.85 2kui h THR 393 CO 0.00 0.50 -0.69 0.27 -0.01 0.00 0.00 175.52 175.59 2kui s ILE 394 N -3.71 3.72 0.41 0.00 -0.00 -1.26 -5.12 121.20 115.24 2kui s ILE 394 Ca -0.01 -0.42 0.00 0.00 -0.00 0.00 0.00 60.65 60.22 2kui s ILE 394 Cb 0.12 -2.62 0.08 0.00 -0.00 0.00 0.00 42.46 40.05 2kui s ILE 394 CO 0.73 0.50 0.56 -0.81 -0.00 0.00 0.00 174.94 175.92 2kui n PRO 395 N 3.52 0.24 -0.68 0.37 -0.04 -1.26 -4.56 135.00 132.59 2kui n PRO 395 Ca -0.18 -1.55 -0.32 0.00 -0.04 0.00 0.00 63.50 61.41 2kui n PRO 395 Cb 0.53 -0.36 0.17 0.00 -0.04 0.00 0.00 33.50 33.79 2kui n PRO 395 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2kui n PRO 396 N -2.02 -1.39 0.00 0.54 -0.02 -1.24 -0.31 135.00 130.56 2kui n PRO 396 Ca 0.09 -0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.19 2kui n PRO 396 Cb 0.33 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 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 -2.00 0.00 -4.56 2.55 5.75 -1.26 -4.05 116.55 112.98 2kui n ASP 397 Ca 0.02 0.20 -0.38 0.00 -0.01 0.00 0.00 54.79 54.63 2kui n ASP 397 Cb 0.59 -0.20 -0.03 0.00 -1.03 0.00 0.00 41.12 40.45 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 -2.28 2.26 -0.07 2.11 3.76 -1.26 0.02 115.29 119.83 2kui s HIS 398 Ca 0.00 -0.25 -0.30 0.00 -0.15 0.00 0.00 55.06 54.37 2kui s HIS 398 Cb 0.00 -4.51 -0.05 0.00 1.11 0.00 0.00 32.58 29.13 2kui s HIS 398 CO 0.00 -1.97 1.63 0.14 -0.85 0.00 0.00 174.74 173.70 2kui s VAL 399 N 6.46 3.63 -0.07 -0.90 -7.23 -1.23 -4.88 120.40 116.17 2kui s VAL 399 Ca 0.50 0.75 0.00 0.00 -1.81 0.00 0.00 61.98 61.42 2kui s VAL 399 Cb -0.04 -3.50 -0.26 0.00 0.56 0.00 0.00 36.38 33.14 2kui s VAL 399 CO -0.00 -0.08 0.57 -0.29 -0.31 0.00 0.00 175.10 174.99 2kui h ILE 400 N 5.62 0.81 -3.90 -0.62 -0.00 -1.87 -3.23 117.51 114.33 2kui h ILE 400 Ca -0.38 -2.56 -0.10 0.00 -0.00 0.00 0.00 64.86 61.82 2kui h ILE 400 Cb 1.17 2.54 -0.13 0.00 -0.00 0.00 0.00 36.82 40.40 2kui h ILE 400 CO 0.96 0.75 -0.36 -0.83 -0.00 0.00 0.00 178.15 178.67 2kui s GLY 401 N -5.29 0.39 0.24 8.18 0.00 -1.26 -4.69 107.32 104.89 2kui s GLY 401 Ca -0.14 -0.84 -0.02 0.00 0.00 0.00 0.00 44.72 43.72 2kui s GLY 401 CO 0.81 -0.86 0.35 -1.30 0.00 0.00 0.00 173.10 172.09 2kui n THR 402 N -0.16 0.00 -3.81 0.90 -2.24 -1.26 -4.80 114.28 102.91 2kui n THR 402 Ca -0.10 -1.12 -0.37 0.00 -2.27 0.00 0.00 64.05 60.19 2kui n THR 402 Cb 0.63 0.72 -0.06 0.00 -2.10 0.00 0.00 70.33 69.52 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 -2.43 6.46 0.00 3.42 -1.08 -1.26 -4.96 116.67 116.81 2kui s ASP 403 Ca 0.18 0.55 0.00 0.00 -0.52 0.00 0.00 52.55 52.76 2kui s ASP 403 Cb -0.01 -2.10 0.00 0.00 -1.46 0.00 0.00 42.92 39.35 2kui s ASP 403 CO 0.13 0.39 0.37 -2.65 0.52 0.00 0.00 175.17 173.93 2kui n PRO 404 N 2.00 0.00 -0.13 4.34 -0.02 -1.26 -3.01 135.00 136.92 2kui n PRO 404 Ca -0.19 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.43 2kui n PRO 404 Cb 0.54 -1.42 0.51 0.00 -0.02 0.00 0.00 33.50 33.12 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 1.64 2.10 -0.03 3.55 0.00 -1.93 0.15 119.26 124.74 2kui h ALA 405 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2kui h ALA 405 Cb 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2kui h ALA 405 CO 0.00 -0.27 -0.52 0.00 0.00 0.00 0.00 179.25 178.46 2kui h ALA 406 N 1.67 1.08 -0.01 0.00 0.00 -1.86 -2.60 119.26 117.55 2kui h ALA 406 Ca 0.33 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2kui h ALA 406 Cb 0.75 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2kui h ALA 406 CO -0.10 0.66 -0.19 0.09 0.00 0.00 0.00 179.25 179.71 2kui n ASN 407 N -3.93 0.77 -4.87 0.00 4.13 0.37 -0.53 115.26 111.21 2kui n ASN 407 Ca -0.02 -0.73 -0.32 0.00 1.68 0.00 0.00 54.58 55.19 2kui n ASN 407 Cb 0.54 0.04 -0.05 0.00 -1.54 0.00 0.00 39.78 38.77 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 -2.50 4.97 -0.41 3.41 2.01 -0.33 -4.89 115.64 117.90 2kui s THR 408 Ca 0.26 0.43 -0.29 0.00 0.31 0.00 0.00 61.69 62.40 2kui s THR 408 Cb 0.20 -3.63 0.02 0.00 0.01 0.00 0.00 72.50 69.09 2kui s THR 408 CO 0.50 0.01 1.18 -0.94 -0.69 0.00 0.00 174.62 174.68 2kui s SER 409 N -2.26 6.67 0.28 3.53 1.04 -1.26 -4.24 113.70 117.45 2kui s SER 409 Ca 0.44 0.76 0.12 0.00 0.48 0.00 0.00 55.95 57.75 2kui s SER 409 Cb -0.12 -2.55 -0.05 0.00 0.10 0.00 0.00 66.02 63.41 2kui s SER 409 CO 0.21 -1.17 -0.19 0.68 0.98 0.00 0.00 173.24 173.76 2kui s VAL 410 N 4.40 2.54 0.23 5.02 -7.23 0.65 -4.69 120.40 121.31 2kui s VAL 410 Ca 0.50 -2.37 -0.30 0.00 -1.81 0.00 0.00 61.98 58.00 2kui s VAL 410 Cb -0.10 -2.33 -0.10 0.00 0.56 0.00 0.00 36.38 34.41 2kui s VAL 410 CO 0.27 -0.39 1.39 -0.44 -0.31 0.00 0.00 175.10 175.61 2kui s SER 411 N -3.51 6.75 -0.23 4.85 0.01 -1.26 0.11 113.70 120.42 2kui s SER 411 Ca 0.30 2.57 -0.34 0.00 1.31 0.00 0.00 55.95 59.78 2kui s SER 411 Cb -0.05 -2.62 -0.11 0.00 0.21 0.00 0.00 66.02 63.45 2kui s SER 411 CO 0.15 -0.63 2.05 0.00 0.41 0.00 0.00 173.24 175.22 2kui n ALA 412 N 2.42 1.02 0.00 1.44 0.00 -1.06 -1.70 120.51 122.63 2kui n ALA 412 Ca 0.06 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2kui n ALA 412 Cb 0.41 -2.57 0.00 0.00 0.00 0.00 0.00 19.45 17.30 2kui n ALA 412 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 413 N 5.45 1.44 1.72 0.00 0.00 -1.26 -4.97 105.19 107.56 2kui n GLY 413 Ca 0.31 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.20 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 0.00 -0.68 -4.24 1.61 -0.08 -0.69 -3.97 116.55 108.50 2kui n ASP 414 Ca 0.00 -1.03 -0.32 0.00 -1.51 0.00 0.00 54.79 51.93 2kui n ASP 414 Cb 0.00 -0.47 -0.17 0.00 2.34 0.00 0.00 41.12 42.82 2kui n ASP 414 CO 0.00 0.00 0.00 -1.83 0.12 0.00 0.00 177.20 175.49 2kui s GLU 415 N -4.26 3.00 -0.14 -0.67 -1.05 -1.25 -0.18 118.70 114.16 2kui s GLU 415 Ca 0.34 -0.86 0.01 0.00 -0.15 0.00 0.00 54.97 54.31 2kui s GLU 415 Cb -0.02 -2.31 -0.00 0.00 -0.44 0.00 0.00 34.13 31.36 2kui s GLU 415 CO 0.25 0.22 -0.17 0.42 0.95 0.00 0.00 175.26 176.93 2kui s ILE 416 N 0.25 2.58 -0.12 1.83 -1.09 0.06 -4.94 121.20 119.77 2kui s ILE 416 Ca -0.16 -0.82 -0.17 0.00 -2.23 0.00 0.00 60.65 57.28 2kui s ILE 416 Cb -0.17 -2.06 -0.04 0.00 -1.58 0.00 0.00 42.46 38.60 2kui s ILE 416 CO 0.08 0.53 0.42 -0.89 -1.23 0.00 0.00 174.94 173.85 2kui s THR 417 N 0.60 5.21 -0.06 2.92 2.01 -1.26 -0.15 115.64 124.91 2kui s THR 417 Ca -0.10 0.84 0.06 0.00 0.31 0.00 0.00 61.69 62.80 2kui s THR 417 Cb -0.16 -3.76 -0.01 0.00 0.01 0.00 0.00 72.50 68.58 2kui s THR 417 CO 0.03 0.36 -0.25 0.54 -0.69 0.00 0.00 174.62 174.62 2kui s VAL 418 N 0.47 2.01 -0.24 3.82 0.11 0.56 -4.45 120.40 122.68 2kui s VAL 418 Ca 0.23 -1.04 -0.10 0.00 -2.93 0.00 0.00 61.98 58.14 2kui s VAL 418 Cb -0.15 -1.70 -0.05 0.00 -1.53 0.00 0.00 36.38 32.95 2kui s VAL 418 CO 0.09 0.56 0.15 0.20 -3.33 0.00 0.00 175.10 172.77 2kui s ASN 419 N -0.15 6.05 -0.09 3.54 0.01 -1.26 -0.50 114.94 122.53 2kui s ASN 419 Ca -0.03 0.09 0.04 0.00 -0.71 0.00 0.00 52.86 52.24 2kui s ASN 419 Cb -0.14 -2.09 -0.01 0.00 0.41 0.00 0.00 41.25 39.43 2kui s ASN 419 CO 0.04 0.06 -0.22 -0.69 -1.51 0.00 0.00 177.10 174.78 2kui s VAL 420 N 1.08 2.30 -0.26 1.60 1.01 -0.42 -4.85 120.40 120.86 2kui s VAL 420 Ca 0.07 -0.95 -0.10 0.00 0.00 0.00 0.00 61.98 61.01 2kui s VAL 420 Cb -0.14 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 2kui s VAL 420 CO 0.05 0.56 0.15 -0.55 0.00 0.00 0.00 175.10 175.30 2kui s SER 421 N 0.17 5.78 -0.28 3.32 0.15 0.58 -0.87 113.70 122.55 2kui s SER 421 Ca -0.12 -0.05 0.03 0.00 0.70 0.00 0.00 55.95 56.51 2kui s SER 421 Cb -0.16 -2.06 0.07 0.00 -1.71 0.00 0.00 66.02 62.16 2kui s SER 421 CO 0.07 -0.03 -0.05 0.28 1.20 0.00 0.00 173.24 174.71 2kui s THR 422 N 1.60 2.01 0.00 6.45 -1.32 -0.48 -3.68 115.64 120.22 2kui s THR 422 Ca 0.07 -1.71 0.00 0.00 -1.21 0.00 0.00 61.69 58.84 2kui s THR 422 Cb -0.15 -2.25 0.00 0.00 -1.51 0.00 0.00 72.50 68.59 2kui s THR 422 CO 0.08 -0.20 0.00 0.61 -2.21 0.00 0.00 174.62 172.90 2kui n GLY 423 N 4.46 2.51 3.77 6.08 0.00 -1.26 -4.22 105.19 116.53 2kui n GLY 423 Ca -0.09 -0.81 -0.32 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.24 2.53 0.91 1.61 0.02 -1.26 -1.66 135.00 134.91 2kui s PRO 424 Ca 0.00 1.24 -0.12 0.00 0.02 0.00 0.00 61.00 62.14 2kui s PRO 424 Cb 0.00 -1.93 0.14 0.00 0.02 0.00 0.00 34.50 32.73 2kui s PRO 424 CO 0.00 -1.44 1.10 -1.21 -0.33 0.00 0.00 177.00 175.13 2kui s GLU 425 N -4.58 1.17 0.45 5.54 2.02 -1.26 -4.81 118.70 117.23 2kui s GLU 425 Ca 0.63 0.57 -0.07 0.00 0.02 0.00 0.00 54.97 56.12 2kui s GLU 425 Cb -0.18 -1.82 -0.05 0.00 0.10 0.00 0.00 34.13 32.18 2kui s GLU 425 CO 0.50 -2.24 0.77 -0.65 0.02 0.00 0.00 175.26 173.66 2kui s GLN 426 N -5.07 3.62 0.15 1.61 -0.21 -1.26 -4.74 119.66 113.76 2kui s GLN 426 Ca 0.63 0.28 0.10 0.00 0.02 0.00 0.00 55.36 56.40 2kui s GLN 426 Cb -0.17 -2.39 -0.04 0.00 1.00 0.00 0.00 33.01 31.41 2kui s GLN 426 CO 0.56 -0.13 -0.24 1.03 -2.12 0.00 0.00 175.29 174.38 2kui s ARG 427 N -4.40 1.37 0.20 2.91 1.81 0.06 -4.85 118.95 116.05 2kui s ARG 427 Ca 0.48 -1.38 -0.26 0.00 -1.72 0.00 0.00 55.73 52.85 2kui s ARG 427 Cb -0.10 -1.72 -0.08 0.00 -0.45 0.00 0.00 34.95 32.59 2kui s ARG 427 CO 0.40 0.39 0.83 -1.21 -0.68 0.00 0.00 175.30 175.03 2kui s GLU 428 N -2.31 4.64 -0.38 3.54 8.01 -1.26 0.28 118.70 131.21 2kui s GLU 428 Ca 0.15 1.24 -0.29 0.00 0.01 0.00 0.00 54.97 56.08 2kui s GLU 428 Cb -0.09 -3.23 0.02 0.00 -4.31 0.00 0.00 34.13 26.52 2kui s GLU 428 CO 0.07 0.54 1.16 0.42 0.01 0.00 0.00 175.26 177.46 2kui s ILE 429 N -1.20 4.29 0.33 -1.63 1.01 -0.79 -4.90 121.20 118.31 2kui s ILE 429 Ca 0.38 1.41 -0.28 0.00 0.00 0.00 0.00 60.65 62.16 2kui s ILE 429 Cb -0.23 -4.42 -0.10 0.00 0.01 0.00 0.00 42.46 37.72 2kui s ILE 429 CO 0.27 -0.69 1.19 -2.84 0.00 0.00 0.00 174.94 172.87 2kui s PRO 430 N 4.13 4.39 -0.16 2.79 0.02 -1.26 -4.36 135.00 140.55 2kui s PRO 430 Ca 0.49 1.96 -0.18 0.00 0.02 0.00 0.00 61.00 63.29 2kui s PRO 430 Cb -0.11 -3.02 -0.04 0.00 0.02 0.00 0.00 34.50 31.35 2kui s PRO 430 CO 0.24 -0.06 0.49 0.16 -0.33 0.00 0.00 177.00 177.50 2kui s ASP 431 N -0.81 6.61 0.12 2.53 -4.77 -1.26 -4.97 116.67 114.12 2kui s ASP 431 Ca 0.49 0.73 0.10 0.00 -3.30 0.00 0.00 52.55 50.57 2kui s ASP 431 Cb -0.34 -2.28 -0.04 0.00 -1.09 0.00 0.00 42.92 39.16 2kui s ASP 431 CO 0.45 -0.08 -0.25 -0.69 0.70 0.00 0.00 175.17 175.29 2kui s VAL 432 N 1.12 2.07 0.47 2.11 1.01 -1.26 -5.10 120.40 120.82 2kui s VAL 432 Ca 0.24 -1.69 -0.23 0.00 0.00 0.00 0.00 61.98 60.31 2kui s VAL 432 Cb -0.15 -1.85 -0.08 0.00 0.00 0.00 0.00 36.38 34.29 2kui s VAL 432 CO 0.10 0.04 1.12 -1.20 0.00 0.00 0.00 175.10 175.16 2kui n SER 433 N 0.97 1.73 0.22 3.32 7.64 -1.26 -4.88 113.62 121.35 2kui n SER 433 Ca -0.18 1.00 0.08 0.00 1.01 0.00 0.00 58.87 60.78 2kui n SER 433 Cb 0.53 -1.43 0.48 0.00 -1.01 0.00 0.00 64.21 62.78 2kui n SER 433 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2kui h THR 434 N 1.49 0.77 0.00 0.44 1.35 -1.99 -0.82 112.91 114.15 2kui h THR 434 Ca -0.47 -1.10 0.00 0.00 -0.55 0.00 0.00 66.41 64.29 2kui h THR 434 Cb 1.33 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 69.43 2kui h THR 434 CO 0.57 0.26 -0.61 0.00 -0.25 0.00 0.00 175.52 175.48 2kui n LEU 435 N -3.61 0.58 -2.45 3.87 -0.00 -1.26 -0.24 117.00 113.89 2kui n LEU 435 Ca -0.01 0.06 -0.34 0.00 -0.00 0.00 0.00 56.01 55.73 2kui n LEU 435 Cb 0.40 -0.21 0.05 0.00 -0.00 0.00 0.00 43.42 43.66 2kui n LEU 435 CO 0.34 0.06 1.46 0.41 -0.00 0.00 0.00 177.39 179.67 2kui n THR 436 N -1.74 3.50 -0.33 1.47 -1.04 -0.31 -4.68 114.28 111.15 2kui n THR 436 Ca 0.04 -3.15 0.11 0.00 -2.04 0.00 0.00 64.05 59.01 2kui n THR 436 Cb 0.38 -1.23 0.31 0.00 -1.82 0.00 0.00 70.33 67.97 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 2.28 1.01 -0.83 -1.42 3.20 -1.72 -0.21 116.97 119.27 2kui h TYR 437 Ca 0.54 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.42 2kui h TYR 437 Cb 0.60 -0.31 -0.04 0.00 1.54 0.00 0.00 36.73 38.52 2kui h TYR 437 CO 1.29 0.34 0.42 0.00 -1.64 0.00 0.00 178.16 178.58 2kui h ALA 438 N 1.59 1.07 -0.11 1.82 0.00 -1.94 -1.61 119.26 120.07 2kui h ALA 438 Ca 0.50 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 55.12 2kui h ALA 438 Cb 0.69 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2kui h ALA 438 CO -0.27 0.62 -0.57 1.49 0.00 0.00 0.00 179.25 180.51 2kui h GLU 439 N 1.18 0.36 -0.32 0.00 4.81 -1.57 -2.66 114.58 116.37 2kui h GLU 439 Ca 0.29 -0.23 0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2kui h GLU 439 Cb 0.08 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 2kui h GLU 439 CO -0.04 0.83 0.19 0.00 -0.73 0.00 0.00 179.01 179.26 2kui h ALA 440 N 1.12 0.40 -0.46 2.92 0.00 -0.16 0.42 119.26 123.50 2kui h ALA 440 Ca 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2kui h ALA 440 Cb 1.08 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2kui h ALA 440 CO 0.10 -0.16 -0.03 -0.39 0.00 0.00 0.00 179.25 178.76 2kui h VAL 441 N 0.39 1.25 -0.27 0.00 -1.51 -1.43 -1.45 116.25 113.22 2kui h VAL 441 Ca 0.13 -1.04 0.00 0.00 -1.23 0.00 0.00 66.70 64.55 2kui h VAL 441 Cb -0.01 0.93 -0.01 0.00 -2.13 0.00 0.00 31.29 30.07 2kui h VAL 441 CO -0.05 0.36 0.18 0.50 -1.23 0.00 0.00 177.57 177.33 2kui h LYS 442 N 0.72 0.36 -0.66 5.19 1.63 -0.95 -1.35 116.57 121.52 2kui h LYS 442 Ca 0.14 -0.02 -0.06 0.00 -0.85 0.00 0.00 60.65 59.85 2kui h LYS 442 Cb 0.49 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.01 2kui h LYS 442 CO 0.02 0.25 0.17 0.87 -3.45 0.00 0.00 179.45 177.31 2kui h LYS 443 N 0.37 1.03 -0.36 1.90 1.79 0.06 0.69 116.57 122.05 2kui h LYS 443 Ca 0.10 -0.23 -0.05 0.00 -2.18 0.00 0.00 60.65 58.29 2kui h LYS 443 Cb -0.03 -0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 30.46 2kui h LYS 443 CO -0.02 0.90 0.01 -0.07 -1.08 0.00 0.00 179.45 179.19 2kui h LEU 444 N 0.98 0.52 -0.26 2.94 3.38 -1.05 -1.08 115.31 120.73 2kui h LEU 444 Ca 0.21 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.96 2kui h LEU 444 Cb 0.33 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2kui h LEU 444 CO -0.00 0.58 -0.31 0.74 0.09 0.00 0.00 178.44 179.54 2kui h THR 445 N 0.53 1.31 0.00 0.22 2.02 -0.18 -0.39 112.91 116.42 2kui h THR 445 Ca 0.11 -1.49 -0.02 0.00 0.77 0.00 0.00 66.41 65.78 2kui h THR 445 Cb 0.33 1.65 -0.00 0.00 -1.74 0.00 0.00 68.15 68.38 2kui h THR 445 CO 0.01 0.47 -0.12 0.00 0.37 0.00 0.00 175.52 176.26 2kui h ALA 446 N 0.68 1.12 -0.06 6.16 0.00 -0.57 -1.63 119.26 124.96 2kui h ALA 446 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2kui h ALA 446 Cb 0.88 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2kui h ALA 446 CO 0.07 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.47 2kui n ALA 447 N -2.21 2.57 0.00 0.00 0.00 -0.44 -4.96 120.51 115.47 2kui n ALA 447 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2kui n ALA 447 Cb 0.29 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.55 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 0.86 1.77 0.34 0.00 0.00 -0.61 -4.67 105.19 102.87 2kui n GLY 448 Ca 0.13 -0.69 -0.05 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 -0.19 -2.54 1.61 1.16 -1.26 -4.79 117.46 111.45 2kui n PHE 449 Ca 0.00 1.06 -0.18 0.00 -1.87 0.00 0.00 57.45 56.46 2kui n PHE 449 Cb 0.00 -0.68 -0.00 0.00 -1.61 0.00 0.00 39.48 37.18 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 -1.30 -0.50 3.32 4.97 0.00 -0.17 -4.91 105.19 106.60 2kui n GLY 450 Ca 0.05 0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 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 -5.17 3.37 0.02 1.61 1.81 -1.26 -4.73 118.95 114.60 2kui s ARG 451 Ca 0.06 -0.64 -0.06 0.00 -1.72 0.00 0.00 55.73 53.36 2kui s ARG 451 Cb -0.03 -2.89 -0.00 0.00 -0.45 0.00 0.00 34.95 31.58 2kui s ARG 451 CO 0.07 -0.08 0.12 -0.59 -0.68 0.00 0.00 175.30 174.14 2kui s PHE 452 N 1.14 0.11 -0.01 -0.53 -0.12 -1.26 -0.28 117.98 117.03 2kui s PHE 452 Ca 0.01 -0.30 0.03 0.00 -0.05 0.00 0.00 56.93 56.62 2kui s PHE 452 Cb -0.14 -0.09 -0.00 0.00 -0.63 0.00 0.00 43.02 42.15 2kui s PHE 452 CO -0.02 -0.32 -0.10 0.15 -0.05 0.00 0.00 175.22 174.88 2kui s LYS 453 N -1.93 0.93 -0.27 1.99 -0.14 -0.12 -4.88 119.74 115.32 2kui s LYS 453 Ca -0.11 -0.37 -0.13 0.00 -1.36 0.00 0.00 55.97 54.01 2kui s LYS 453 Cb -0.05 -0.88 -0.04 0.00 -1.68 0.00 0.00 37.83 35.18 2kui s LYS 453 CO -0.01 0.20 0.27 -1.14 -0.76 0.00 0.00 175.35 173.90 2kui s GLN 454 N -0.11 4.01 0.10 1.68 0.74 -1.26 0.12 119.66 124.94 2kui s GLN 454 Ca 0.02 -0.15 0.09 0.00 0.05 0.00 0.00 55.36 55.37 2kui s GLN 454 Cb -0.06 -3.63 -0.04 0.00 1.10 0.00 0.00 33.01 30.38 2kui s GLN 454 CO -0.00 -0.17 -0.20 0.00 -0.55 0.00 0.00 175.29 174.37 2kui s ALA 455 N 1.74 2.60 0.05 1.58 0.00 0.93 -4.96 121.76 123.70 2kui s ALA 455 Ca 0.11 -1.33 0.06 0.00 0.00 0.00 0.00 51.96 50.80 2kui s ALA 455 Cb -0.15 -0.62 -0.03 0.00 0.00 0.00 0.00 23.12 22.31 2kui s ALA 455 CO 0.09 0.58 -0.13 -0.80 0.00 0.00 0.00 175.76 175.50 2kui s ASN 456 N -1.92 4.19 -0.06 0.00 0.01 -1.26 -0.17 114.94 115.72 2kui s ASN 456 Ca 0.16 -0.34 -0.04 0.00 -0.71 0.00 0.00 52.86 51.93 2kui s ASN 456 Cb -0.10 -0.80 0.03 0.00 0.41 0.00 0.00 41.25 40.79 2kui s ASN 456 CO 0.08 0.24 0.15 -0.55 -1.51 0.00 0.00 177.10 175.51 2kui s SER 457 N -1.64 -0.14 -0.10 -1.22 0.15 -0.61 -4.90 113.70 105.25 2kui s SER 457 Ca 0.17 0.31 -0.30 0.00 0.70 0.00 0.00 55.95 56.83 2kui s SER 457 Cb -0.11 0.25 -0.02 0.00 -1.71 0.00 0.00 66.02 64.43 2kui s SER 457 CO 0.08 -0.11 1.15 -2.16 1.20 0.00 0.00 173.24 173.41 2kui s PRO 458 N 0.69 4.34 0.37 5.44 0.04 -1.25 -0.15 135.00 144.49 2kui s PRO 458 Ca -0.05 1.58 -0.05 0.00 0.04 0.00 0.00 61.00 62.52 2kui s PRO 458 Cb -0.07 -3.59 0.02 0.00 0.04 0.00 0.00 34.50 30.90 2kui s PRO 458 CO -0.03 -0.47 0.57 -1.12 0.04 0.00 0.00 177.00 175.99 2kui s SER 459 N 1.44 0.81 0.25 6.66 0.01 0.04 -4.90 113.70 118.00 2kui s SER 459 Ca 0.53 -1.46 -0.29 0.00 1.31 0.00 0.00 55.95 56.04 2kui s SER 459 Cb -0.22 0.74 -0.15 0.00 0.21 0.00 0.00 66.02 66.59 2kui s SER 459 CO 0.19 -1.44 0.89 1.07 0.41 0.00 0.00 173.24 174.35 2kui n THR 460 N -0.59 1.84 -0.13 1.44 5.66 -1.26 -4.45 114.28 116.80 2kui n THR 460 Ca -0.01 -0.46 0.27 0.00 -3.05 0.00 0.00 64.05 60.79 2kui n THR 460 Cb 0.61 -0.68 0.72 0.00 -1.55 0.00 0.00 70.33 69.43 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 1.87 0.00 0.00 1.09 0.13 -1.96 0.28 132.00 133.42 2kui h PRO 461 Ca -0.37 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.73 2kui h PRO 461 Cb 1.37 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.50 2kui h PRO 461 CO 0.61 0.00 -0.16 1.05 -0.23 0.00 0.00 178.00 179.27 2kui h GLU 462 N 0.00 0.00 0.00 0.86 4.11 -2.01 -2.40 114.58 115.15 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 1.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.82 2kui h GLU 462 CO -0.00 0.16 -1.30 1.28 0.07 0.00 0.00 179.01 179.21 2kui n LEU 463 N -3.56 0.65 -4.71 3.06 4.77 0.07 -4.87 117.00 112.42 2kui n LEU 463 Ca -0.01 -0.29 -0.42 0.00 -0.03 0.00 0.00 56.01 55.25 2kui n LEU 463 Cb 0.30 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 2kui n LEU 463 CO 0.31 0.15 1.41 -0.69 -1.33 0.00 0.00 177.39 177.24 2kui s VAL 464 N -3.18 2.33 0.00 4.08 1.01 -0.90 -1.27 120.40 122.48 2kui s VAL 464 Ca 0.03 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.08 2kui s VAL 464 Cb 0.15 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.48 2kui s VAL 464 CO 0.87 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.59 2kui n GLY 465 N 4.09 1.49 3.77 4.51 0.00 0.08 -4.95 105.19 114.17 2kui n GLY 465 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.63 2.73 0.42 1.61 3.01 -0.40 -4.90 119.74 121.59 2kui s LYS 466 Ca 0.00 -1.14 -0.23 0.00 -1.01 0.00 0.00 55.97 53.59 2kui s LYS 466 Cb 0.00 -2.45 -0.09 0.00 -1.01 0.00 0.00 37.83 34.28 2kui s LYS 466 CO 0.00 0.40 1.04 0.08 0.51 0.00 0.00 175.35 177.38 2kui s VAL 467 N -2.14 3.77 -0.16 3.17 1.01 0.67 -0.77 120.40 125.95 2kui s VAL 467 Ca 0.32 1.29 0.17 0.00 0.00 0.00 0.00 61.98 63.76 2kui s VAL 467 Cb -0.08 -3.63 -0.25 0.00 0.00 0.00 0.00 36.38 32.42 2kui s VAL 467 CO 0.23 -0.06 0.23 -0.38 0.00 0.00 0.00 175.10 175.12 2kui n ILE 468 N -0.27 1.42 -3.76 2.22 5.41 0.93 -4.72 119.36 120.60 2kui n ILE 468 Ca 0.06 -0.84 0.00 0.00 1.00 0.00 0.00 62.75 62.97 2kui n ILE 468 Cb 0.50 -0.60 0.00 0.00 -0.71 0.00 0.00 39.64 38.84 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 1.69 -0.46 3.46 7.39 0.00 -1.18 -5.04 105.19 111.06 2kui n GLY 469 Ca -0.28 -1.17 -0.32 0.00 0.00 0.00 0.00 46.02 44.24 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 2.92 0.03 2.61 -4.23 -1.26 -1.98 115.64 110.73 2kui s THR 470 Ca 0.00 -0.84 -0.26 0.00 -1.18 0.00 0.00 61.69 59.41 2kui s THR 470 Cb 0.00 -2.15 -0.17 0.00 1.34 0.00 0.00 72.50 71.53 2kui s THR 470 CO 0.00 0.55 1.34 -1.13 -0.54 0.00 0.00 174.62 174.84 2kui h ASN 471 N 5.21 -0.40 -3.44 3.99 -1.24 -1.48 -3.41 115.58 114.82 2kui h ASN 471 Ca -0.46 -0.12 -0.52 0.00 0.71 0.00 0.00 56.30 55.90 2kui h ASN 471 Cb 1.15 0.10 0.03 0.00 0.73 0.00 0.00 38.32 40.34 2kui h ASN 471 CO 0.50 -0.09 0.64 -2.16 -1.29 0.00 0.00 177.43 175.03 2kui s PRO 472 N -5.03 4.40 0.41 6.67 0.04 -1.26 -4.97 135.00 135.26 2kui s PRO 472 Ca -0.15 2.04 -0.26 0.00 0.04 0.00 0.00 61.00 62.67 2kui s PRO 472 Cb 0.03 -3.19 -0.09 0.00 0.04 0.00 0.00 34.50 31.29 2kui s PRO 472 CO 0.57 -0.22 1.40 -2.14 0.04 0.00 0.00 177.00 176.65 2kui s PRO 473 N -0.29 3.91 0.00 0.56 0.02 -1.26 -4.86 135.00 133.09 2kui s PRO 473 Ca 0.55 2.38 0.00 0.00 0.02 0.00 0.00 61.00 63.95 2kui s PRO 473 Cb -0.36 -2.79 0.00 0.00 0.02 0.00 0.00 34.50 31.36 2kui s PRO 473 CO 0.39 -0.62 0.49 0.00 -0.33 0.00 0.00 177.00 176.93 2kui n ALA 474 N 0.13 2.17 0.12 -1.55 0.00 -1.26 -1.49 120.51 118.63 2kui n ALA 474 Ca 0.03 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.53 2kui n ALA 474 Cb 0.42 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.78 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 0.26 1.91 -4.97 0.00 5.03 -1.26 -4.56 115.26 111.68 2kui n ASN 475 Ca 0.00 -0.18 -0.21 0.00 0.87 0.00 0.00 54.58 55.06 2kui n ASN 475 Cb 0.24 1.41 0.01 0.00 -1.02 0.00 0.00 39.78 40.42 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 -2.63 3.01 -0.32 3.52 -1.52 -0.55 -4.91 119.66 116.25 2kui s GLN 476 Ca -0.02 -0.73 -0.08 0.00 -1.95 0.00 0.00 55.36 52.58 2kui s GLN 476 Cb 0.08 -2.65 0.01 0.00 -0.22 0.00 0.00 33.01 30.23 2kui s GLN 476 CO 0.48 -0.21 0.13 0.99 -0.25 0.00 0.00 175.29 176.42 2kui s THR 477 N -2.44 4.22 -0.01 -0.19 2.01 -1.26 -1.88 115.64 116.09 2kui s THR 477 Ca 0.49 -0.72 -0.01 0.00 0.31 0.00 0.00 61.69 61.75 2kui s THR 477 Cb -0.10 -3.24 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 2kui s THR 477 CO 0.35 -0.02 0.12 -0.94 -0.69 0.00 0.00 174.62 173.44 2kui s SER 478 N 1.53 5.95 0.84 3.53 1.04 0.14 -4.79 113.70 121.95 2kui s SER 478 Ca 0.02 0.23 -0.11 0.00 0.48 0.00 0.00 55.95 56.57 2kui s SER 478 Cb -0.18 -1.78 0.10 0.00 0.10 0.00 0.00 66.02 64.26 2kui s SER 478 CO 0.04 0.27 1.09 0.00 0.98 0.00 0.00 173.24 175.63 2kui s ALA 479 N -1.24 1.89 -1.13 5.32 0.00 -1.26 -0.76 121.76 124.58 2kui s ALA 479 Ca 0.24 -0.08 0.22 0.00 0.00 0.00 0.00 51.96 52.34 2kui s ALA 479 Cb -0.12 -3.17 0.98 0.00 0.00 0.00 0.00 23.12 20.81 2kui s ALA 479 CO 0.15 -2.05 1.70 -0.89 0.00 0.00 0.00 175.76 174.67 2kui n ILE 480 N -3.67 0.45 0.29 0.00 2.08 -1.26 -1.29 119.36 115.95 2kui n ILE 480 Ca 0.07 0.11 0.12 0.00 0.56 0.00 0.00 62.75 63.61 2kui n ILE 480 Cb 0.55 -0.74 0.22 0.00 -0.75 0.00 0.00 39.64 38.92 2kui n ILE 480 CO 0.00 0.00 0.00 1.07 0.56 0.00 0.00 176.55 178.18 2kui n THR 481 N -1.43 0.52 -3.20 1.39 5.66 -1.26 -3.98 114.28 111.97 2kui n THR 481 Ca 0.07 -0.76 -0.34 0.00 -3.05 0.00 0.00 64.05 59.97 2kui n THR 481 Cb 0.23 0.98 -0.06 0.00 -1.55 0.00 0.00 70.33 69.93 2kui n THR 481 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2kui s ASN 482 N -1.48 6.85 -0.27 1.09 -0.87 -0.41 -5.06 114.94 114.79 2kui s ASN 482 Ca 0.39 1.25 -0.07 0.00 -1.57 0.00 0.00 52.86 52.86 2kui s ASN 482 Cb 0.23 -2.36 -0.01 0.00 -0.02 0.00 0.00 41.25 39.10 2kui s ASN 482 CO 0.32 -0.06 0.07 -0.69 -2.57 0.00 0.00 177.10 174.17 2kui s VAL 483 N -1.73 4.11 -0.25 1.60 1.01 -1.26 -4.32 120.40 119.56 2kui s VAL 483 Ca 0.47 -0.44 -0.20 0.00 0.00 0.00 0.00 61.98 61.81 2kui s VAL 483 Cb -0.13 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 2kui s VAL 483 CO 0.19 0.22 0.63 -0.69 0.00 0.00 0.00 175.10 175.45 2kui s VAL 484 N 1.56 4.98 -0.22 2.92 1.01 0.62 -4.91 120.40 126.35 2kui s VAL 484 Ca 0.05 1.14 -0.16 0.00 0.00 0.00 0.00 61.98 63.01 2kui s VAL 484 Cb -0.16 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 2kui s VAL 484 CO 0.03 0.03 0.43 -0.51 0.00 0.00 0.00 175.10 175.07 2kui s ILE 485 N 2.50 5.17 -0.15 2.22 -1.16 -1.26 -0.95 121.20 127.57 2kui s ILE 485 Ca 0.26 0.74 -0.01 0.00 -0.51 0.00 0.00 60.65 61.14 2kui s ILE 485 Cb -0.15 -3.75 -0.01 0.00 0.61 0.00 0.00 42.46 39.15 2kui s ILE 485 CO 0.08 0.21 -0.11 -0.63 -2.81 0.00 0.00 174.94 171.68 2kui s ILE 486 N 1.58 3.13 -0.21 2.00 1.01 0.12 -1.06 121.20 127.77 2kui s ILE 486 Ca 0.19 -0.62 -0.08 0.00 0.00 0.00 0.00 60.65 60.14 2kui s ILE 486 Cb -0.15 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 39.95 2kui s ILE 486 CO 0.09 0.51 0.08 -0.51 0.00 0.00 0.00 174.94 175.10 2kui s ILE 487 N 0.54 4.73 0.12 2.92 2.07 -0.84 -0.05 121.20 130.69 2kui s ILE 487 Ca -0.08 -0.05 0.06 0.00 -1.41 0.00 0.00 60.65 59.18 2kui s ILE 487 Cb -0.15 -3.16 -0.04 0.00 0.13 0.00 0.00 42.46 39.23 2kui s ILE 487 CO 0.04 0.41 -0.02 0.68 -1.91 0.00 0.00 174.94 174.14 2kui s VAL 488 N 0.83 3.82 0.02 4.00 -7.23 0.76 -0.05 120.40 122.55 2kui s VAL 488 Ca 0.04 -1.17 -0.27 0.00 -1.81 0.00 0.00 61.98 58.77 2kui s VAL 488 Cb -0.13 -2.84 -0.04 0.00 0.56 0.00 0.00 36.38 33.92 2kui s VAL 488 CO 0.02 0.05 0.85 -0.83 -0.31 0.00 0.00 175.10 174.89 2kui s GLY 489 N -2.48 2.83 0.17 2.32 0.00 0.05 -1.57 107.32 108.65 2kui s GLY 489 Ca 0.25 0.39 0.08 0.00 0.00 0.00 0.00 44.72 45.44 2kui s GLY 489 CO 0.18 1.36 -0.16 -0.56 0.00 0.00 0.00 173.10 173.92 2kui s SER 490 N 0.46 2.53 -0.08 1.64 0.01 0.78 -0.74 113.70 118.31 2kui s SER 490 Ca 0.44 -0.91 -0.04 0.00 1.31 0.00 0.00 55.95 56.75 2kui s SER 490 Cb -0.21 -0.13 0.04 0.00 0.21 0.00 0.00 66.02 65.93 2kui s SER 490 CO 0.25 -0.10 0.18 -0.83 0.41 0.00 0.00 173.24 173.15 2kui s GLY 491 N -2.88 -0.07 0.82 3.44 0.00 -1.26 -0.78 107.32 106.60 2kui s GLY 491 Ca 0.17 0.80 -0.12 0.00 0.00 0.00 0.00 44.72 45.57 2kui s GLY 491 CO 0.06 1.13 1.11 2.56 0.00 0.00 0.00 173.10 177.96 2kui s PRO 492 N 1.26 1.86 -0.90 2.90 0.04 -1.26 -4.92 135.00 133.98 2kui s PRO 492 Ca -0.09 0.50 -0.08 0.00 0.04 0.00 0.00 61.00 61.37 2kui s PRO 492 Cb -0.11 -1.90 -0.12 0.00 0.04 0.00 0.00 34.50 32.40 2kui s PRO 492 CO -0.07 -1.75 3.14 0.00 0.04 0.00 0.00 177.00 178.37 2kui n ALA 493 N -3.49 6.97 -2.34 8.56 0.00 -1.26 -4.83 120.51 124.12 2kui n ALA 493 Ca 0.07 -2.91 -0.30 0.00 0.00 0.00 0.00 53.44 50.29 2kui n ALA 493 Cb 0.57 -2.82 -0.15 0.00 0.00 0.00 0.00 19.45 17.05 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 1.04 2.09 0.10 0.00 -4.23 -1.26 -1.33 115.64 112.04 2kui s THR 494 Ca 0.66 -1.29 0.05 0.00 -1.18 0.00 0.00 61.69 59.94 2kui s THR 494 Cb 0.25 -1.77 -0.03 0.00 1.34 0.00 0.00 72.50 72.29 2kui s THR 494 CO -0.05 0.43 -0.13 -0.54 -0.54 0.00 0.00 174.62 173.78 2kui s LYS 495 N -1.03 0.91 -0.33 3.99 1.02 0.50 -4.83 119.74 119.97 2kui s LYS 495 Ca 0.11 -1.11 -0.26 0.00 0.02 0.00 0.00 55.97 54.74 2kui s LYS 495 Cb -0.10 -0.82 0.01 0.00 -0.52 0.00 0.00 37.83 36.41 2kui s LYS 495 CO 0.01 0.16 0.92 0.34 -0.92 0.00 0.00 175.35 175.86 2kui s ASP 496 N -2.15 6.74 -0.04 2.83 2.15 -1.26 -0.73 116.67 124.21 2kui s ASP 496 Ca 0.04 0.74 -0.26 0.00 0.43 0.00 0.00 52.55 53.49 2kui s ASP 496 Cb -0.07 -2.47 -0.03 0.00 -0.30 0.00 0.00 42.92 40.05 2kui s ASP 496 CO 0.02 -0.78 0.82 0.27 -0.17 0.00 0.00 175.17 175.33 2kui s ILE 497 N 3.33 4.97 0.00 4.11 -4.36 -0.45 -4.96 121.20 123.84 2kui s ILE 497 Ca 0.38 1.70 0.00 0.00 -0.26 0.00 0.00 60.65 62.47 2kui s ILE 497 Cb -0.13 -4.16 0.00 0.00 1.25 0.00 0.00 42.46 39.42 2kui s ILE 497 CO 0.15 0.22 0.00 -0.81 0.24 0.00 0.00 174.94 174.74 2kui n PRO 498 N 3.81 0.25 -2.67 0.37 -0.04 -1.26 -0.05 135.00 135.41 2kui n PRO 498 Ca 0.02 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.07 2kui n PRO 498 Cb 0.51 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.92 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 7.51 0.00 3.54 -4.77 -1.26 -4.49 116.67 116.20 2kui s ASP 499 Ca 0.00 2.00 0.00 0.00 -3.30 0.00 0.00 52.55 51.25 2kui s ASP 499 Cb 0.00 -2.61 0.00 0.00 -1.09 0.00 0.00 42.92 39.22 2kui s ASP 499 CO 0.00 0.02 0.00 0.55 0.70 0.00 0.00 175.17 176.44 2kui n VAL 500 N 1.76 0.00 -1.95 2.11 3.14 -1.26 -5.00 118.33 117.13 2kui n VAL 500 Ca -0.01 -0.16 -0.43 0.00 -2.96 0.00 0.00 64.34 60.78 2kui n VAL 500 Cb 0.47 0.66 -0.03 0.00 -1.06 0.00 0.00 33.84 33.89 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 -0.98 3.02 0.00 1.55 0.00 -1.26 -2.31 121.76 121.79 2kui s ALA 501 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 51.96 52.45 2kui s ALA 501 Cb 0.00 -3.96 0.00 0.00 0.00 0.00 0.00 23.12 19.16 2kui s ALA 501 CO 0.00 -2.37 0.00 0.41 0.00 0.00 0.00 175.76 173.80 2kui n GLY 502 N 5.18 1.27 3.96 0.00 0.00 -0.41 -4.98 105.19 110.20 2kui n GLY 502 Ca 0.23 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.05 2kui n GLY 502 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2kui s GLN 503 N 0.00 2.59 0.45 1.61 -2.07 -0.98 -4.84 119.66 116.42 2kui s GLN 503 Ca 0.00 -1.48 -0.03 0.00 -1.82 0.00 0.00 55.36 52.03 2kui s GLN 503 Cb 0.00 -2.56 -0.03 0.00 -1.09 0.00 0.00 33.01 29.33 2kui s GLN 503 CO 0.00 -0.39 0.72 0.95 -1.32 0.00 0.00 175.29 175.25 2kui s THR 504 N -2.48 4.74 0.26 3.63 -4.23 -1.26 -0.09 115.64 116.20 2kui s THR 504 Ca 0.52 -0.08 -0.02 0.00 -1.18 0.00 0.00 61.69 60.93 2kui s THR 504 Cb -0.06 -3.78 0.23 0.00 1.34 0.00 0.00 72.50 70.23 2kui s THR 504 CO 0.31 -0.68 1.80 0.58 -0.54 0.00 0.00 174.62 176.10 2kui h VAL 505 N 0.35 0.85 -0.56 2.29 2.07 -1.46 0.17 116.25 119.95 2kui h VAL 505 Ca -0.47 -0.26 -0.06 0.00 0.82 0.00 0.00 66.70 66.73 2kui h VAL 505 Cb 1.22 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 2kui h VAL 505 CO 0.61 0.14 0.13 0.44 0.02 0.00 0.00 177.57 178.91 2kui h ASP 506 N 0.76 0.86 -0.24 0.57 5.19 -1.94 -0.01 116.42 121.61 2kui h ASP 506 Ca 0.43 -0.24 -0.16 0.00 -0.62 0.00 0.00 57.03 56.45 2kui h ASP 506 Cb 0.48 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 39.77 2kui h ASP 506 CO -0.29 0.87 -0.46 0.58 -3.12 0.00 0.00 179.24 176.83 2kui h VAL 507 N 0.80 1.30 -0.04 -1.35 2.07 -1.72 -2.53 116.25 114.79 2kui h VAL 507 Ca 0.18 -1.67 0.00 0.00 0.82 0.00 0.00 66.70 66.03 2kui h VAL 507 Cb 0.35 1.76 -0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2kui h VAL 507 CO 0.00 0.53 0.02 0.00 0.02 0.00 0.00 177.57 178.14 2kui h ALA 508 N 0.63 0.05 -0.39 1.67 0.00 -0.52 0.21 119.26 120.90 2kui h ALA 508 Ca 0.01 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2kui h ALA 508 Cb 1.06 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 2kui h ALA 508 CO 0.10 -0.45 -0.03 -0.56 0.00 0.00 0.00 179.25 178.31 2kui h GLN 509 N 0.03 0.64 -0.20 0.00 3.07 -1.03 0.01 115.11 117.64 2kui h GLN 509 Ca 0.01 -0.17 -0.02 0.00 0.09 0.00 0.00 58.65 58.57 2kui h GLN 509 Cb 0.01 -0.08 -0.01 0.00 0.08 0.00 0.00 27.48 27.49 2kui h GLN 509 CO -0.00 0.69 0.04 -0.22 0.09 0.00 0.00 178.83 179.43 2kui h LYS 510 N 0.60 0.33 -0.15 0.06 1.63 -1.06 -0.64 116.57 117.34 2kui h LYS 510 Ca 0.12 -0.08 -0.01 0.00 -0.85 0.00 0.00 60.65 59.83 2kui h LYS 510 Cb 0.43 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 32.01 2kui h LYS 510 CO 0.02 0.46 0.06 -0.91 -3.45 0.00 0.00 179.45 175.63 2kui h ASN 511 N 0.14 0.21 -0.87 4.20 2.35 -0.50 -1.69 115.58 119.41 2kui h ASN 511 Ca 0.06 -0.17 -0.02 0.00 -0.55 0.00 0.00 56.30 55.62 2kui h ASN 511 Cb 0.29 -0.05 -0.04 0.00 0.05 0.00 0.00 38.32 38.56 2kui h ASN 511 CO 0.00 0.32 0.46 -0.07 -1.65 0.00 0.00 177.43 176.50 2kui h LEU 512 N 0.08 1.10 -1.10 1.61 -0.00 -0.98 -2.07 115.31 113.96 2kui h LEU 512 Ca 0.05 -0.11 -0.02 0.00 -0.00 0.00 0.00 57.88 57.80 2kui h LEU 512 Cb 0.18 -0.28 -0.03 0.00 -0.00 0.00 0.00 40.66 40.53 2kui h LEU 512 CO -0.00 0.90 0.35 0.78 -0.00 0.00 0.00 178.44 180.46 2kui h ASN 513 N 1.23 0.88 -0.58 -0.43 -0.26 -0.88 -0.62 115.58 114.91 2kui h ASN 513 Ca 0.31 -0.09 -0.03 0.00 -0.56 0.00 0.00 56.30 55.93 2kui h ASN 513 Cb 0.05 -0.23 -0.03 0.00 -1.06 0.00 0.00 38.32 37.06 2kui h ASN 513 CO -0.05 0.74 0.26 0.58 -1.06 0.00 0.00 177.43 177.90 2kui h VAL 514 N 0.98 1.21 0.00 2.81 2.07 -0.66 -1.75 116.25 120.92 2kui h VAL 514 Ca 0.24 -0.64 -0.04 0.00 0.82 0.00 0.00 66.70 67.08 2kui h VAL 514 Cb 0.07 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 2kui h VAL 514 CO -0.03 0.26 -0.21 1.88 0.02 0.00 0.00 177.57 179.48 2kui h TYR 515 N 0.88 0.00 0.00 1.57 0.05 -0.62 -3.46 116.97 115.39 2kui h TYR 515 Ca 0.21 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.99 2kui h TYR 515 Cb 0.14 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.88 2kui h TYR 515 CO 0.01 0.21 0.00 0.41 -1.05 0.00 0.00 178.16 177.74 2kui n GLY 516 N 0.20 1.45 3.55 3.88 0.00 -0.66 -5.03 105.19 108.59 2kui n GLY 516 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.54 2.36 -1.21 1.61 0.08 -0.36 -4.62 117.98 114.31 2kui s PHE 517 Ca 0.00 0.01 0.22 0.00 0.12 0.00 0.00 56.93 57.28 2kui s PHE 517 Cb 0.00 -4.59 -0.02 0.00 -0.57 0.00 0.00 43.02 37.84 2kui s PHE 517 CO 0.00 -1.96 1.05 2.41 -0.10 0.00 0.00 175.22 176.62 2kui n THR 518 N 6.41 0.00 -3.76 0.64 -1.04 -1.24 -2.78 114.28 112.51 2kui n THR 518 Ca 0.04 -0.05 -0.37 0.00 -2.04 0.00 0.00 64.05 61.62 2kui n THR 518 Cb 0.49 0.89 -0.13 0.00 -1.82 0.00 0.00 70.33 69.76 2kui n THR 518 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2kui s LYS 519 N -2.89 3.08 -0.01 -2.82 1.02 -1.26 -5.01 119.74 111.85 2kui s LYS 519 Ca 0.11 -0.87 0.04 0.00 0.02 0.00 0.00 55.97 55.27 2kui s LYS 519 Cb 0.17 -3.39 -0.01 0.00 -0.52 0.00 0.00 37.83 34.08 2kui s LYS 519 CO 0.78 -0.45 -0.12 -0.59 -0.92 0.00 0.00 175.35 174.04 2kui s PHE 520 N 1.50 1.05 0.01 3.18 -0.71 -1.26 -0.81 117.98 120.94 2kui s PHE 520 Ca 0.02 -0.21 0.05 0.00 -1.04 0.00 0.00 56.93 55.76 2kui s PHE 520 Cb -0.17 -0.67 -0.02 0.00 -1.21 0.00 0.00 43.02 40.95 2kui s PHE 520 CO 0.03 -0.02 -0.15 -1.12 -1.34 0.00 0.00 175.22 172.62 2kui s SER 521 N -0.32 1.82 -0.01 1.98 0.01 -0.14 -4.94 113.70 112.10 2kui s SER 521 Ca 0.04 -0.36 0.07 0.00 1.31 0.00 0.00 55.95 57.01 2kui s SER 521 Cb -0.05 -0.17 -0.02 0.00 0.21 0.00 0.00 66.02 65.99 2kui s SER 521 CO -0.00 0.14 -0.22 0.00 0.41 0.00 0.00 173.24 173.57 2kui s GLN 522 N -0.69 2.18 -0.04 12.44 0.00 -1.26 0.11 119.66 132.40 2kui s GLN 522 Ca 0.05 -0.89 0.01 0.00 -0.00 0.00 0.00 55.36 54.52 2kui s GLN 522 Cb -0.07 -2.14 0.02 0.00 0.00 0.00 0.00 33.01 30.82 2kui s GLN 522 CO 0.00 0.57 -0.03 0.00 0.00 0.00 0.00 175.29 175.84 2kui s ALA 523 N -0.70 0.58 -0.08 2.60 0.00 0.10 -4.93 121.76 119.33 2kui s ALA 523 Ca 0.11 -0.00 -0.15 0.00 0.00 0.00 0.00 51.96 51.91 2kui s ALA 523 Cb -0.10 -0.43 -0.05 0.00 0.00 0.00 0.00 23.12 22.54 2kui s ALA 523 CO 0.00 -0.08 0.39 -1.12 0.00 0.00 0.00 175.76 174.95 2kui s SER 524 N 1.07 6.66 0.12 0.00 0.01 -1.26 0.05 113.70 120.35 2kui s SER 524 Ca -0.09 0.78 0.10 0.00 1.31 0.00 0.00 55.95 58.05 2kui s SER 524 Cb -0.14 -2.24 -0.04 0.00 0.21 0.00 0.00 66.02 63.81 2kui s SER 524 CO -0.01 0.16 -0.25 0.68 0.41 0.00 0.00 173.24 174.23 2kui s VAL 525 N -0.10 2.05 0.27 3.43 -7.23 0.70 -4.90 120.40 114.62 2kui s VAL 525 Ca 0.22 -1.68 -0.30 0.00 -1.81 0.00 0.00 61.98 58.41 2kui s VAL 525 Cb -0.15 -1.83 -0.10 0.00 0.56 0.00 0.00 36.38 34.86 2kui s VAL 525 CO 0.10 0.03 1.37 1.51 -0.31 0.00 0.00 175.10 177.79 2kui s ASP 526 N -2.02 6.74 0.23 4.85 -4.77 -1.26 -0.59 116.67 119.86 2kui s ASP 526 Ca 0.11 2.62 -0.11 0.00 -3.30 0.00 0.00 52.55 51.88 2kui s ASP 526 Cb -0.10 -2.63 -0.01 0.00 -1.09 0.00 0.00 42.92 39.09 2kui s ASP 526 CO 0.05 -0.61 0.41 -0.44 0.70 0.00 0.00 175.17 175.29 2kui s SER 527 N 0.04 -0.05 0.18 2.11 0.01 0.18 -4.73 113.70 111.45 2kui s SER 527 Ca 0.55 -0.96 0.15 0.00 1.31 0.00 0.00 55.95 57.01 2kui s SER 527 Cb -0.40 0.54 -0.03 0.00 0.21 0.00 0.00 66.02 66.34 2kui s SER 527 CO 0.46 -1.07 1.17 -0.65 0.41 0.00 0.00 173.24 173.56 2kui h PRO 528 N 2.34 0.00 -7.00 12.44 0.11 -1.82 -3.36 132.00 134.71 2kui h PRO 528 Ca -0.28 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.38 2kui h PRO 528 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 2kui h PRO 528 CO 0.39 0.43 0.30 -0.98 -0.21 0.00 0.00 178.00 177.92 2kui s ARG 529 N -2.94 4.19 0.60 1.05 1.70 -1.26 -4.80 118.95 117.48 2kui s ARG 529 Ca 0.01 1.04 -0.19 0.00 -0.47 0.00 0.00 55.73 56.11 2kui s ARG 529 Cb 0.08 -2.23 -0.04 0.00 -0.57 0.00 0.00 34.95 32.19 2kui s ARG 529 CO 0.78 0.00 1.10 -2.30 -1.08 0.00 0.00 175.30 173.80 2kui n PRO 530 N -0.60 1.07 -1.81 3.89 -0.02 -1.26 -2.60 135.00 133.68 2kui n PRO 530 Ca 0.06 0.41 -0.42 0.00 -2.02 0.00 0.00 63.50 61.53 2kui n PRO 530 Cb 0.54 -2.30 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 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 -1.44 3.62 0.00 3.55 0.00 -1.24 -2.67 121.76 123.58 2kui s ALA 531 Ca 0.76 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.93 2kui s ALA 531 Cb -0.41 -3.79 0.00 0.00 0.00 0.00 0.00 23.12 18.92 2kui s ALA 531 CO 0.46 -1.42 0.00 0.41 0.00 0.00 0.00 175.76 175.21 2kui n GLY 532 N 4.32 1.37 3.80 0.00 0.00 -1.03 -4.93 105.19 108.71 2kui n GLY 532 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.16 1.61 2.12 -1.09 -1.16 118.70 124.41 2kui s GLU 533 Ca 0.00 1.05 -0.20 0.00 0.36 0.00 0.00 54.97 56.18 2kui s GLU 533 Cb 0.00 -2.86 -0.03 0.00 0.26 0.00 0.00 34.13 31.50 2kui s GLU 533 CO 0.00 0.36 0.60 0.08 -0.54 0.00 0.00 175.26 175.76 2kui s VAL 534 N -1.54 5.07 -0.90 3.70 1.01 0.87 0.39 120.40 128.98 2kui s VAL 534 Ca 0.45 1.16 0.20 0.00 0.00 0.00 0.00 61.98 63.79 2kui s VAL 534 Cb -0.18 -3.92 -0.23 0.00 0.00 0.00 0.00 36.38 32.05 2kui s VAL 534 CO 0.22 0.18 0.84 1.07 0.00 0.00 0.00 175.10 177.41 2kui n THR 535 N 4.35 0.00 -1.57 3.92 5.66 0.82 -1.29 114.28 126.16 2kui n THR 535 Ca -0.03 -0.05 0.00 0.00 -3.05 0.00 0.00 64.05 60.93 2kui n THR 535 Cb 0.50 0.94 0.00 0.00 -1.55 0.00 0.00 70.33 70.23 2kui n THR 535 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kui n GLY 536 N 1.47 -1.62 3.08 1.09 0.00 -1.08 -4.73 105.19 103.40 2kui n GLY 536 Ca 0.03 -1.07 -0.08 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.46 0.28 0.04 2.61 -4.23 -1.26 0.13 115.64 110.74 2kui s THR 537 Ca 0.00 -1.65 -0.27 0.00 -1.18 0.00 0.00 61.69 58.59 2kui s THR 537 Cb 0.00 -1.30 -0.17 0.00 1.34 0.00 0.00 72.50 72.37 2kui s THR 537 CO 0.00 -0.88 1.40 -1.13 -0.54 0.00 0.00 174.62 173.48 2kui h ASN 538 N 3.42 -0.45 -2.93 3.99 -0.73 -1.05 -3.38 115.58 114.45 2kui h ASN 538 Ca -0.34 -0.09 -0.56 0.00 1.87 0.00 0.00 56.30 57.19 2kui h ASN 538 Cb 1.16 0.12 -0.02 0.00 0.27 0.00 0.00 38.32 39.84 2kui h ASN 538 CO 0.61 -0.17 0.85 -2.16 -0.37 0.00 0.00 177.43 176.18 2kui s PRO 539 N -5.25 4.27 0.36 6.67 0.04 -1.26 -4.99 135.00 134.85 2kui s PRO 539 Ca -0.15 1.78 -0.28 0.00 0.04 0.00 0.00 61.00 62.39 2kui s PRO 539 Cb 0.03 -3.69 -0.10 0.00 0.04 0.00 0.00 34.50 30.78 2kui s PRO 539 CO 0.58 -0.62 1.31 -1.25 0.04 0.00 0.00 177.00 177.06 2kui s PRO 540 N 2.95 4.18 0.27 0.56 0.04 -1.26 -4.94 135.00 136.81 2kui s PRO 540 Ca 0.59 2.20 -0.31 0.00 0.04 0.00 0.00 61.00 63.53 2kui s PRO 540 Cb -0.26 -2.93 -0.12 0.00 0.04 0.00 0.00 34.50 31.23 2kui s PRO 540 CO 0.21 -0.33 1.58 0.00 0.04 0.00 0.00 177.00 178.50 2kui n ALA 541 N 0.50 2.33 0.00 8.56 0.00 -1.26 -1.95 120.51 128.69 2kui n ALA 541 Ca 0.02 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.84 2kui n ALA 541 Cb 0.42 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.43 2kui n ALA 541 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 542 N 2.43 0.35 3.79 0.00 0.00 0.93 -4.98 105.19 107.72 2kui n GLY 542 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.00 4.80 -0.21 2.61 2.01 -0.82 -4.80 115.64 117.23 2kui s THR 543 Ca 0.00 1.24 -0.21 0.00 0.31 0.00 0.00 61.69 63.04 2kui s THR 543 Cb 0.00 -3.92 -0.02 0.00 0.01 0.00 0.00 72.50 68.57 2kui s THR 543 CO 0.00 0.49 0.63 -0.89 -0.69 0.00 0.00 174.62 174.16 2kui s THR 544 N -0.70 5.01 0.11 -0.82 2.01 -1.26 -1.34 115.64 118.65 2kui s THR 544 Ca 0.30 1.18 0.04 0.00 0.31 0.00 0.00 61.69 63.52 2kui s THR 544 Cb -0.19 -3.94 -0.04 0.00 0.01 0.00 0.00 72.50 68.34 2kui s THR 544 CO 0.18 0.09 -0.11 0.68 -0.69 0.00 0.00 174.62 174.78 2kui s VAL 545 N 2.04 1.09 0.37 3.82 -7.23 0.09 -4.83 120.40 115.75 2kui s VAL 545 Ca 0.28 -1.75 -0.28 0.00 -1.81 0.00 0.00 61.98 58.42 2kui s VAL 545 Cb -0.16 -1.51 -0.11 0.00 0.56 0.00 0.00 36.38 35.16 2kui s VAL 545 CO 0.10 -0.56 1.49 -2.65 -0.31 0.00 0.00 175.10 173.17 2kui n PRO 546 N 0.39 2.65 0.29 4.82 -0.02 -1.26 -0.37 135.00 141.50 2kui n PRO 546 Ca -0.15 0.93 0.18 0.00 -2.02 0.00 0.00 63.50 62.44 2kui n PRO 546 Cb 0.58 -2.66 0.88 0.00 -0.02 0.00 0.00 33.50 32.28 2kui n PRO 546 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2kui h VAL 547 N 2.96 0.16 0.00 -1.45 -1.51 -1.54 -1.08 116.25 113.78 2kui h VAL 547 Ca -0.50 -0.36 0.00 0.00 -1.23 0.00 0.00 66.70 64.61 2kui h VAL 547 Cb 1.24 1.30 0.00 0.00 -2.13 0.00 0.00 31.29 31.70 2kui h VAL 547 CO 0.65 0.03 -0.43 -0.67 -1.23 0.00 0.00 177.57 175.93 2kui n ASP 548 N -3.23 0.50 -4.77 4.19 2.03 -1.26 -3.56 116.55 110.45 2kui n ASP 548 Ca -0.01 0.05 -0.33 0.00 0.52 0.00 0.00 54.79 55.02 2kui n ASP 548 Cb 0.21 0.03 0.05 0.00 -0.72 0.00 0.00 41.12 40.69 2kui n ASP 548 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2kui s SER 549 N -3.51 5.11 -0.15 1.67 0.01 -0.41 -4.66 113.70 111.76 2kui s SER 549 Ca 0.10 1.99 -0.21 0.00 1.31 0.00 0.00 55.95 59.14 2kui s SER 549 Cb 0.16 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.81 2kui s SER 549 CO 0.67 -1.63 0.63 -0.69 0.41 0.00 0.00 173.24 172.64 2kui s VAL 550 N -2.35 5.05 -0.20 3.43 1.01 -1.26 -4.29 120.40 121.79 2kui s VAL 550 Ca 0.67 1.23 -0.08 0.00 0.00 0.00 0.00 61.98 63.79 2kui s VAL 550 Cb -0.20 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 2kui s VAL 550 CO 0.42 0.17 0.09 0.27 0.00 0.00 0.00 175.10 176.05 2kui s ILE 551 N 1.47 5.00 -0.28 2.22 -0.00 0.01 -4.91 121.20 124.71 2kui s ILE 551 Ca 0.31 0.04 -0.10 0.00 -0.00 0.00 0.00 60.65 60.91 2kui s ILE 551 Cb -0.16 -3.27 -0.04 0.00 -0.00 0.00 0.00 42.46 38.99 2kui s ILE 551 CO 0.12 0.44 0.14 -0.70 -0.00 0.00 0.00 174.94 174.94 2kui s GLU 552 N 0.49 3.75 -0.22 0.37 2.12 -1.26 -0.96 118.70 122.99 2kui s GLU 552 Ca 0.05 -0.44 -0.18 0.00 0.36 0.00 0.00 54.97 54.76 2kui s GLU 552 Cb -0.12 -3.53 -0.03 0.00 0.26 0.00 0.00 34.13 30.70 2kui s GLU 552 CO 0.00 -0.22 0.50 -0.51 -0.54 0.00 0.00 175.26 174.49 2kui s LEU 553 N 1.69 4.11 -0.40 2.70 1.43 0.12 -0.33 118.68 128.00 2kui s LEU 553 Ca 0.06 0.61 -0.25 0.00 -1.03 0.00 0.00 54.13 53.53 2kui s LEU 553 Cb -0.16 -2.67 0.02 0.00 0.03 0.00 0.00 46.19 43.41 2kui s LEU 553 CO 0.08 -0.21 0.86 -1.10 0.23 0.00 0.00 176.35 176.21 2kui s GLN 554 N 1.83 3.68 -0.04 1.70 1.11 0.12 -0.72 119.66 127.34 2kui s GLN 554 Ca 0.23 0.30 -0.12 0.00 0.01 0.00 0.00 55.36 55.78 2kui s GLN 554 Cb -0.15 -3.85 -0.05 0.00 -1.01 0.00 0.00 33.01 27.94 2kui s GLN 554 CO 0.09 -1.01 0.32 0.08 0.01 0.00 0.00 175.29 174.78 2kui s VAL 555 N 3.41 5.20 0.29 1.09 1.01 0.11 -0.12 120.40 131.38 2kui s VAL 555 Ca 0.35 0.61 -0.28 0.00 0.00 0.00 0.00 61.98 62.65 2kui s VAL 555 Cb -0.12 -3.60 -0.09 0.00 0.00 0.00 0.00 36.38 32.56 2kui s VAL 555 CO 0.21 0.58 1.04 -0.44 0.00 0.00 0.00 175.10 176.49 2kui s SER 556 N -1.08 7.27 -0.21 3.32 0.01 0.16 -0.21 113.70 122.96 2kui s SER 556 Ca 0.21 2.13 -0.02 0.00 1.31 0.00 0.00 55.95 59.58 2kui s SER 556 Cb -0.15 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.47 2kui s SER 556 CO 0.10 -0.13 -0.09 -0.75 0.41 0.00 0.00 173.24 172.78 2kui s LYS 557 N -1.61 3.22 0.38 12.44 2.20 0.24 -2.46 119.74 134.16 2kui s LYS 557 Ca 0.46 -0.71 0.20 0.00 -0.36 0.00 0.00 55.97 55.56 2kui s LYS 557 Cb -0.28 -2.87 0.59 0.00 -1.51 0.00 0.00 37.83 33.75 2kui s LYS 557 CO 0.35 -0.22 1.68 0.78 -0.36 0.00 0.00 175.35 177.59 2kui h GLY 558 N 8.05 0.00 -0.22 5.54 0.00 -1.64 0.52 103.07 115.32 2kui h GLY 558 Ca -0.42 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.81 2kui h GLY 558 CO 0.61 0.00 -0.09 0.70 0.00 0.00 0.00 176.54 177.77 2kui n ASN 559 N -3.34 -3.72 -4.06 0.19 3.02 -1.26 -4.62 115.26 101.47 2kui n ASN 559 Ca 0.01 0.12 -0.19 0.00 -0.03 0.00 0.00 54.58 54.48 2kui n ASN 559 Cb 0.54 -1.63 -0.14 0.00 -0.61 0.00 0.00 39.78 37.94 2kui n ASN 559 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2kui s GLN 560 N -2.13 0.84 -0.00 3.52 2.00 -1.26 -1.07 119.66 121.56 2kui s GLN 560 Ca 0.00 -0.44 0.01 0.00 -2.00 0.00 0.00 55.36 52.93 2kui s GLN 560 Cb 0.00 -0.81 -0.00 0.00 0.80 0.00 0.00 33.01 33.00 2kui s GLN 560 CO 0.00 0.22 -0.03 -0.59 -0.50 0.00 0.00 175.29 174.39 2kui s PHE 561 N -0.37 0.27 0.17 1.67 -0.71 -0.12 -4.87 117.98 114.01 2kui s PHE 561 Ca 0.03 -0.05 -0.32 0.00 -1.04 0.00 0.00 56.93 55.56 2kui s PHE 561 Cb -0.05 -0.19 -0.11 0.00 -1.21 0.00 0.00 43.02 41.47 2kui s PHE 561 CO -0.00 -0.01 1.64 0.54 -1.34 0.00 0.00 175.22 176.05 2kui s VAL 562 N 0.01 2.46 -0.19 -2.49 0.11 -1.26 0.04 120.40 119.08 2kui s VAL 562 Ca 0.00 0.28 -0.13 0.00 -2.93 0.00 0.00 61.98 59.21 2kui s VAL 562 Cb -0.02 -3.18 -0.05 0.00 -1.53 0.00 0.00 36.38 31.60 2kui s VAL 562 CO -0.00 0.02 0.24 -0.32 -3.33 0.00 0.00 175.10 171.71 2kui s MET 563 N 1.39 4.21 0.97 1.54 1.75 0.30 -4.85 119.30 124.60 2kui s MET 563 Ca 0.73 -0.03 -0.13 0.00 -1.25 0.00 0.00 55.69 55.01 2kui s MET 563 Cb -0.45 -3.45 0.17 0.00 2.84 0.00 0.00 34.83 33.94 2kui s MET 563 CO 0.32 0.20 1.12 -1.25 -0.65 0.00 0.00 175.02 174.76 2kui s PRO 564 N 0.60 0.67 -0.20 4.11 0.04 -1.26 -1.29 135.00 137.67 2kui s PRO 564 Ca 0.13 0.37 -0.23 0.00 0.04 0.00 0.00 61.00 61.31 2kui s PRO 564 Cb -0.13 -1.78 -0.02 0.00 0.04 0.00 0.00 34.50 32.62 2kui s PRO 564 CO 0.03 -2.53 0.76 0.16 0.04 0.00 0.00 177.00 175.45 2kui s ASP 565 N -3.75 6.82 0.00 6.66 -4.77 -1.26 -4.72 116.67 115.65 2kui s ASP 565 Ca 0.65 1.00 0.00 0.00 -3.30 0.00 0.00 52.55 50.90 2kui s ASP 565 Cb -0.16 -2.41 0.00 0.00 -1.09 0.00 0.00 42.92 39.26 2kui s ASP 565 CO 0.55 -0.39 0.48 0.00 0.70 0.00 0.00 175.17 176.52 2kui n LEU 566 N 5.41 0.00 -4.79 2.11 -0.00 -1.26 -5.13 117.00 113.35 2kui n LEU 566 Ca 0.03 -0.44 -0.33 0.00 -0.00 0.00 0.00 56.01 55.26 2kui n LEU 566 Cb 0.49 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.92 2kui n LEU 566 CO 0.46 0.29 0.73 -0.44 -0.00 0.00 0.00 177.39 178.43 2kui s SER 567 N -0.21 5.71 -0.22 1.45 0.01 -1.26 -4.22 113.70 114.96 2kui s SER 567 Ca 0.00 1.94 -0.01 0.00 1.31 0.00 0.00 55.95 59.19 2kui s SER 567 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2kui s SER 567 CO 0.00 -1.22 0.11 0.61 0.41 0.00 0.00 173.24 173.15 2kui n GLY 568 N -0.56 0.56 3.49 3.44 0.00 -1.26 -5.06 105.19 105.80 2kui n GLY 568 Ca 0.10 -0.63 -0.24 0.00 0.00 0.00 0.00 46.02 45.25 2kui n GLY 568 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2kui s MET 569 N -4.80 1.81 0.33 1.61 0.23 -1.26 -4.93 119.30 112.29 2kui s MET 569 Ca 0.05 -2.07 -0.26 0.00 -1.03 0.00 0.00 55.69 52.38 2kui s MET 569 Cb -0.02 -0.72 -0.10 0.00 -1.53 0.00 0.00 34.83 32.46 2kui s MET 569 CO 0.07 -0.36 0.95 -0.06 -2.03 0.00 0.00 175.02 173.59 2kui s PHE 570 N -3.26 3.67 -0.03 3.16 0.40 -1.26 -0.95 117.98 119.71 2kui s PHE 570 Ca 0.28 1.78 0.31 0.00 -0.60 0.00 0.00 56.93 58.70 2kui s PHE 570 Cb 0.05 -2.94 1.38 0.00 0.51 0.00 0.00 43.02 42.02 2kui s PHE 570 CO 0.14 0.15 1.92 2.35 0.70 0.00 0.00 175.22 180.49 2kui h TRP 571 N 3.15 0.00 0.00 0.36 2.91 -1.24 0.50 115.95 121.64 2kui h TRP 571 Ca -0.47 0.00 -0.07 0.00 1.13 0.00 0.00 58.89 59.48 2kui h TRP 571 Cb 1.19 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.83 2kui h TRP 571 CO 0.61 0.00 -0.34 -0.39 -1.03 0.00 0.00 178.44 177.29 2kui h VAL 572 N 0.00 1.07 0.00 2.65 -1.51 -1.92 -2.47 116.25 114.07 2kui h VAL 572 Ca 0.00 -1.24 -0.34 0.00 -1.23 0.00 0.00 66.70 63.89 2kui h VAL 572 Cb 0.35 1.70 -0.06 0.00 -2.13 0.00 0.00 31.29 31.14 2kui h VAL 572 CO 0.00 0.33 -2.30 0.47 -1.23 0.00 0.00 177.57 174.84 2kui n ASP 573 N -3.88 1.17 -0.13 4.19 8.00 -0.73 -4.56 116.55 120.60 2kui n ASP 573 Ca -0.01 -0.05 -0.06 0.00 0.71 0.00 0.00 54.79 55.38 2kui n ASP 573 Cb 0.41 0.40 0.03 0.00 -0.02 0.00 0.00 41.12 41.93 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 0.53 0.51 0.26 2.24 0.00 -0.77 0.16 119.26 122.19 2kui h ALA 574 Ca -0.51 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 2kui h ALA 574 Cb 2.01 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.76 2kui h ALA 574 CO -0.02 -0.19 -0.16 1.49 0.00 0.00 0.00 179.25 180.37 2kui h GLU 575 N 0.38 -0.39 -0.93 0.00 4.22 -1.71 -1.18 114.58 114.97 2kui h GLU 575 Ca 0.18 0.03 0.14 0.00 0.08 0.00 0.00 59.36 59.79 2kui h GLU 575 Cb 0.12 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.38 2kui h GLU 575 CO -0.15 -0.26 0.59 -1.35 -2.18 0.00 0.00 179.01 175.66 2kui h PRO 576 N -0.41 0.75 -0.71 0.92 0.11 -1.74 -2.29 132.00 128.64 2kui h PRO 576 Ca -0.03 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 66.06 2kui h PRO 576 Cb 0.34 -0.17 -0.04 0.00 0.11 0.00 0.00 31.00 31.24 2kui h PRO 576 CO 0.03 0.49 0.45 0.00 -0.21 0.00 0.00 178.00 178.76 2kui h ARG 577 N 0.77 0.86 -0.63 1.05 2.47 0.06 0.17 114.38 119.13 2kui h ARG 577 Ca 0.47 -0.05 -0.03 0.00 -1.26 0.00 0.00 59.98 59.11 2kui h ARG 577 Cb 0.68 -0.19 -0.03 0.00 -1.65 0.00 0.00 29.97 28.78 2kui h ARG 577 CO -0.23 0.57 0.26 -0.07 0.56 0.00 0.00 179.97 181.05 2kui h LEU 578 N 0.89 0.86 -0.65 3.04 3.38 -0.69 -0.25 115.31 121.88 2kui h LEU 578 Ca 0.28 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 2kui h LEU 578 Cb -0.01 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 2kui h LEU 578 CO -0.10 0.79 0.18 0.03 0.09 0.00 0.00 178.44 179.43 2kui h ARG 579 N 0.87 1.03 0.00 1.13 3.08 -0.99 0.93 114.38 120.44 2kui h ARG 579 Ca 0.21 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 59.99 2kui h ARG 579 Cb 0.19 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 2kui h ARG 579 CO -0.02 0.92 -0.17 0.00 -1.07 0.00 0.00 179.97 179.63 2kui h ALA 580 N 1.07 1.13 -0.00 0.04 0.00 -0.11 -0.57 119.26 120.82 2kui h ALA 580 Ca 0.21 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2kui h ALA 580 Cb 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2kui h ALA 580 CO -0.00 0.21 -0.15 1.28 0.00 0.00 0.00 179.25 180.59 2kui n LEU 581 N -3.48 0.27 0.00 0.00 4.77 -0.16 -4.90 117.00 113.49 2kui n LEU 581 Ca -0.01 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 2kui n LEU 581 Cb 0.33 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2kui n LEU 581 CO 0.31 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 2kui n GLY 582 N 1.41 0.59 3.70 -0.72 0.00 -0.22 -5.03 105.19 104.92 2kui n GLY 582 Ca 0.10 -0.76 -0.40 0.00 0.00 0.00 0.00 46.02 44.96 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 3.50 -0.43 1.61 -0.00 0.27 -4.94 118.94 116.95 2kui s TRP 583 Ca 0.00 1.10 0.08 0.00 -0.00 0.00 0.00 56.10 57.28 2kui s TRP 583 Cb 0.00 -2.77 0.28 0.00 -0.00 0.00 0.00 33.47 30.98 2kui s TRP 583 CO 0.00 0.01 0.79 2.41 -0.00 0.00 0.00 176.95 180.16 2kui n THR 584 N 4.06 -0.25 0.00 5.86 -1.04 -1.26 -4.06 114.28 117.58 2kui n THR 584 Ca -0.02 -2.88 0.00 0.00 -2.04 0.00 0.00 64.05 59.12 2kui n THR 584 Cb 0.51 0.08 0.00 0.00 -1.82 0.00 0.00 70.33 69.10 2kui n THR 584 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2kui n GLY 585 N 1.07 0.78 3.16 3.41 0.00 -1.26 -5.07 105.19 107.29 2kui n GLY 585 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 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 3.97 2.87 -0.17 1.61 -2.45 -1.25 -5.01 119.30 118.87 2kui s MET 586 Ca 0.00 -0.81 -0.07 0.00 -1.25 0.00 0.00 55.69 53.56 2kui s MET 586 Cb 0.00 -2.28 -0.04 0.00 1.25 0.00 0.00 34.83 33.76 2kui s MET 586 CO 0.00 0.04 0.06 -1.17 1.05 0.00 0.00 175.02 175.01 2kui s LEU 587 N 0.68 3.85 -0.45 4.11 1.98 -1.26 -3.16 118.68 124.42 2kui s LEU 587 Ca -0.11 0.11 -0.19 0.00 -2.89 0.00 0.00 54.13 51.05 2kui s LEU 587 Cb -0.16 -1.97 0.04 0.00 0.66 0.00 0.00 46.19 44.76 2kui s LEU 587 CO 0.02 0.20 0.56 -0.62 -1.89 0.00 0.00 176.35 174.62 2kui s ASP 588 N 0.21 6.24 -0.39 3.68 2.15 -1.26 -5.01 116.67 122.29 2kui s ASP 588 Ca 0.04 -0.67 -0.22 0.00 0.43 0.00 0.00 52.55 52.14 2kui s ASP 588 Cb -0.12 -2.27 0.01 0.00 -0.30 0.00 0.00 42.92 40.24 2kui s ASP 588 CO 0.00 -0.74 0.70 -0.75 -0.17 0.00 0.00 175.17 174.22 2kui s LYS 589 N 2.48 3.60 0.00 4.34 2.36 -1.26 -4.72 119.74 126.54 2kui s LYS 589 Ca 0.16 0.04 0.00 0.00 -2.55 0.00 0.00 55.97 53.62 2kui s LYS 589 Cb -0.17 -3.85 0.00 0.00 -1.05 0.00 0.00 37.83 32.76 2kui s LYS 589 CO 0.14 -0.87 0.00 0.41 1.55 0.00 0.00 175.35 176.58 2kui n GLY 590 N 4.74 1.63 2.94 5.54 0.00 -1.26 -5.07 105.19 113.72 2kui n GLY 590 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -4.00 0.08 0.03 4.61 0.00 -1.26 -5.12 121.76 116.09 2kui s ALA 591 Ca 0.00 -0.40 -0.30 0.00 0.00 0.00 0.00 51.96 51.26 2kui s ALA 591 Cb 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 23.12 23.17 2kui s ALA 591 CO 0.00 -0.11 1.16 0.16 0.00 0.00 0.00 175.76 176.97 2kui s ASP 592 N -0.98 7.12 -0.12 0.00 -4.77 -1.26 -4.82 116.67 111.84 2kui s ASP 592 Ca -0.11 1.91 -0.01 0.00 -3.30 0.00 0.00 52.55 51.05 2kui s ASP 592 Cb -0.07 -2.57 -0.02 0.00 -1.09 0.00 0.00 42.92 39.17 2kui s ASP 592 CO -0.01 -0.46 -0.10 -0.69 0.70 0.00 0.00 175.17 174.62 2kui s VAL 593 N 1.28 3.38 -0.50 2.11 1.01 -0.38 -4.85 120.40 122.44 2kui s VAL 593 Ca 0.57 -0.56 -0.28 0.00 0.00 0.00 0.00 61.98 61.71 2kui s VAL 593 Cb -0.27 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 33.70 2kui s VAL 593 CO 0.28 0.53 1.39 -0.62 0.00 0.00 0.00 175.10 176.68 2kui s ASP 594 N 0.06 6.24 -0.00 3.32 2.15 -1.26 -1.43 116.67 125.75 2kui s ASP 594 Ca -0.03 0.49 0.09 0.00 0.43 0.00 0.00 52.55 53.52 2kui s ASP 594 Cb -0.14 -2.54 -0.10 0.00 -0.30 0.00 0.00 42.92 39.84 2kui s ASP 594 CO 0.04 -1.58 0.36 0.00 -0.17 0.00 0.00 175.17 173.82 2kui n ALA 595 N 9.19 3.09 0.00 3.66 0.00 -1.26 -5.02 120.51 130.17 2kui n ALA 595 Ca 0.14 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2kui n ALA 595 Cb 0.49 -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 1.24 2.67 0.07 0.00 0.00 -1.26 -4.58 105.19 103.33 2kui n GLY 596 Ca 0.01 -2.01 -0.13 0.00 0.00 0.00 0.00 46.02 43.90 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 -0.06 2.00 -0.02 0.00 -1.99 0.74 103.07 103.75 2kui h GLY 597 Ca 0.00 0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.31 2kui h GLY 597 CO 0.00 -0.02 -0.19 1.48 0.00 0.00 0.00 176.54 177.81 2kui h SER 598 N -0.28 0.00 -0.02 0.19 4.64 -2.04 -2.88 113.55 113.16 2kui h SER 598 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2kui h SER 598 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2kui h SER 598 CO 0.01 0.19 -0.04 0.00 -0.87 0.00 0.00 176.83 176.12 2kui n GLN 599 N -3.40 1.13 0.00 4.77 1.13 -1.19 -4.86 117.38 114.96 2kui n GLN 599 Ca -0.00 -1.26 0.00 0.00 -1.94 0.00 0.00 57.00 53.80 2kui n GLN 599 Cb 0.39 -1.26 0.00 0.00 0.11 0.00 0.00 30.24 29.48 2kui n GLN 599 CO 0.00 0.00 0.00 -2.39 -1.44 0.00 0.00 177.06 173.23 2kui n HIS 600 N 0.66 0.00 -2.86 1.08 1.44 0.25 -3.60 115.22 112.18 2kui n HIS 600 Ca 0.08 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.36 2kui n HIS 600 Cb 0.35 -0.27 0.01 0.00 0.12 0.00 0.00 29.99 30.20 2kui n HIS 600 CO 0.00 0.00 0.00 -1.71 -2.81 0.00 0.00 176.34 171.82 2kui n ASN 601 N -1.47 6.01 -3.92 4.39 2.85 -1.26 -0.11 115.26 121.74 2kui n ASN 601 Ca 0.00 -3.30 -0.10 0.00 -0.11 0.00 0.00 54.58 51.07 2kui n ASN 601 Cb 0.00 -1.34 -0.10 0.00 1.24 0.00 0.00 39.78 39.58 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 -1.79 0.46 0.19 1.20 3.52 -1.24 -0.75 118.95 120.54 2kui s ARG 602 Ca 0.33 -0.53 -0.31 0.00 -0.13 0.00 0.00 55.73 55.09 2kui s ARG 602 Cb 0.05 0.18 -0.09 0.00 -1.56 0.00 0.00 34.95 33.52 2kui s ARG 602 CO 0.07 -0.10 1.44 0.08 -0.81 0.00 0.00 175.30 175.97 2kui s VAL 603 N -1.66 2.91 -0.20 7.11 1.01 -0.13 -2.89 120.40 126.55 2kui s VAL 603 Ca -0.13 0.70 -0.17 0.00 0.00 0.00 0.00 61.98 62.38 2kui s VAL 603 Cb -0.07 -3.45 -0.13 0.00 0.00 0.00 0.00 36.38 32.73 2kui s VAL 603 CO -0.00 0.08 -0.01 0.52 0.00 0.00 0.00 175.10 175.69 2kui n VAL 604 N 3.18 1.50 -3.57 2.92 0.31 0.17 -4.46 118.33 118.39 2kui n VAL 604 Ca 0.10 -0.02 -0.11 0.00 -0.01 0.00 0.00 64.34 64.30 2kui n VAL 604 Cb 0.41 -2.12 -0.04 0.00 -0.91 0.00 0.00 33.84 31.18 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 -2.39 -0.32 -0.01 3.52 1.13 -1.26 -4.89 117.35 113.13 2kui s TYR 605 Ca -0.27 0.03 0.05 0.00 -1.41 0.00 0.00 57.07 55.47 2kui s TYR 605 Cb 0.06 0.38 -0.01 0.00 -1.10 0.00 0.00 41.96 41.29 2kui s TYR 605 CO 0.48 -0.77 -0.16 1.14 -2.51 0.00 0.00 175.55 173.72 2kui s GLN 606 N -3.79 1.31 0.13 -3.49 1.03 -1.26 -2.62 119.66 110.97 2kui s GLN 606 Ca 0.03 -0.59 -0.27 0.00 0.04 0.00 0.00 55.36 54.57 2kui s GLN 606 Cb 0.01 -1.27 -0.04 0.00 0.03 0.00 0.00 33.01 31.74 2kui s GLN 606 CO -0.12 0.35 1.61 -0.97 -2.54 0.00 0.00 175.29 173.62 2kui h ASN 607 N 5.71 -0.99 -3.35 12.60 -0.73 -1.17 -3.40 115.58 124.24 2kui h ASN 607 Ca -0.36 0.14 -0.60 0.00 1.87 0.00 0.00 56.30 57.35 2kui h ASN 607 Cb 1.15 0.41 -0.11 0.00 0.27 0.00 0.00 38.32 40.04 2kui h ASN 607 CO 0.48 -0.38 -0.38 -2.16 -0.37 0.00 0.00 177.43 174.63 2kui s PRO 608 N -6.00 4.21 0.65 6.67 0.05 -1.26 -5.09 135.00 134.23 2kui s PRO 608 Ca -0.15 -0.02 -0.15 0.00 0.05 0.00 0.00 61.00 60.72 2kui s PRO 608 Cb 0.10 -3.46 -0.00 0.00 0.05 0.00 0.00 34.50 31.19 2kui s PRO 608 CO 0.65 0.19 1.11 -1.25 0.05 0.00 0.00 177.00 177.75 2kui s PRO 609 N 0.64 2.85 0.15 0.56 0.04 -1.26 -4.90 135.00 133.07 2kui s PRO 609 Ca 0.13 1.40 -0.34 0.00 0.04 0.00 0.00 61.00 62.23 2kui s PRO 609 Cb -0.13 -1.96 -0.15 0.00 0.04 0.00 0.00 34.50 32.31 2kui s PRO 609 CO 0.03 -1.21 1.50 0.00 0.04 0.00 0.00 177.00 177.36 2kui n ALA 610 N -2.34 0.74 -0.11 8.56 0.00 -1.26 -1.55 120.51 124.55 2kui n ALA 610 Ca 0.10 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.01 2kui n ALA 610 Cb 0.52 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.69 2kui n ALA 610 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 611 N 3.11 0.56 3.94 0.00 0.00 -0.41 -4.97 105.19 107.42 2kui n GLY 611 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.22 5.26 0.06 2.61 2.01 -0.60 -4.80 115.64 117.96 2kui s THR 612 Ca 0.00 -0.57 -0.21 0.00 0.31 0.00 0.00 61.69 61.22 2kui s THR 612 Cb 0.00 -3.76 -0.06 0.00 0.01 0.00 0.00 72.50 68.69 2kui s THR 612 CO 0.00 -0.18 0.62 -0.83 -0.69 0.00 0.00 174.62 173.54 2kui s GLY 613 N -3.34 2.70 -0.04 4.40 0.00 -1.26 -0.54 107.32 109.25 2kui s GLY 613 Ca 0.36 0.09 -0.02 0.00 0.00 0.00 0.00 44.72 45.16 2kui s GLY 613 CO 0.29 0.64 0.08 -1.34 0.00 0.00 0.00 173.10 172.77 2kui s VAL 614 N -0.80 4.78 0.37 1.40 -7.23 0.11 -4.71 120.40 114.31 2kui s VAL 614 Ca 0.31 -0.28 -0.27 0.00 -1.81 0.00 0.00 61.98 59.93 2kui s VAL 614 Cb -0.20 -3.14 -0.12 0.00 0.56 0.00 0.00 36.38 33.49 2kui s VAL 614 CO 0.20 0.44 1.28 -0.46 -0.31 0.00 0.00 175.10 176.25 2kui n ASN 615 N 1.48 2.68 -0.22 4.85 6.94 -1.25 -0.95 115.26 128.79 2kui n ASN 615 Ca -0.15 1.18 0.27 0.00 -0.02 0.00 0.00 54.58 55.86 2kui n ASN 615 Cb 0.53 -1.49 0.67 0.00 -2.36 0.00 0.00 39.78 37.13 2kui n ASN 615 CO 0.00 0.00 0.00 0.03 -1.03 0.00 0.00 177.26 176.26 2kui h ARG 616 N 2.41 0.11 0.00 -3.83 2.47 -1.47 0.14 114.38 114.21 2kui h ARG 616 Ca -0.47 -0.01 -0.05 0.00 -1.26 0.00 0.00 59.98 58.20 2kui h ARG 616 Cb 1.29 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 29.57 2kui h ARG 616 CO 0.62 0.07 -0.23 0.38 0.56 0.00 0.00 179.97 181.37 2kui h ASP 617 N 0.12 0.00 0.00 7.04 2.03 -1.90 -3.47 116.42 120.24 2kui h ASP 617 Ca 0.47 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.77 2kui h ASP 617 Cb 1.66 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.16 2kui h ASP 617 CO -0.07 0.23 0.00 0.61 -1.03 0.00 0.00 179.24 178.98 2kui n GLY 618 N 0.19 0.57 3.68 7.15 0.00 0.48 -4.46 105.19 112.80 2kui n GLY 618 Ca 0.00 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.00 4.05 -0.11 -0.61 -1.16 -1.26 -3.90 121.20 116.21 2kui s ILE 619 Ca 0.00 1.38 0.04 0.00 -0.51 0.00 0.00 60.65 61.56 2kui s ILE 619 Cb 0.00 -3.89 0.00 0.00 0.61 0.00 0.00 42.46 39.18 2kui s ILE 619 CO 0.00 -0.02 -0.23 -0.51 -2.81 0.00 0.00 174.94 171.37 2kui s ILE 620 N 2.49 2.05 -0.31 2.00 1.10 -1.19 -4.81 121.20 122.54 2kui s ILE 620 Ca 0.59 -1.01 -0.10 0.00 -0.51 0.00 0.00 60.65 59.62 2kui s ILE 620 Cb -0.27 -1.79 -0.02 0.00 0.15 0.00 0.00 42.46 40.54 2kui s ILE 620 CO 0.23 0.56 0.17 -0.89 -2.11 0.00 0.00 174.94 172.90 2kui s THR 621 N 0.45 4.87 0.06 4.00 2.01 -1.26 -4.05 115.64 121.71 2kui s THR 621 Ca -0.16 -0.24 -0.01 0.00 0.31 0.00 0.00 61.69 61.59 2kui s THR 621 Cb -0.17 -3.44 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 2kui s THR 621 CO 0.06 0.11 -0.03 -1.48 -0.69 0.00 0.00 174.62 172.60 2kui s LEU 622 N 1.67 2.45 0.06 4.42 0.05 -1.26 -0.46 118.68 125.60 2kui s LEU 622 Ca 0.06 -1.01 0.06 0.00 0.05 0.00 0.00 54.13 53.28 2kui s LEU 622 Cb -0.17 0.20 -0.03 0.00 -2.05 0.00 0.00 46.19 44.15 2kui s LEU 622 CO 0.08 -0.60 -0.16 -0.60 -0.55 0.00 0.00 176.35 174.51 2kui s ARG 623 N -3.92 1.00 0.25 1.48 6.06 -1.08 -4.85 118.95 117.89 2kui s ARG 623 Ca 0.08 -0.88 0.05 0.00 -2.50 0.00 0.00 55.73 52.48 2kui s ARG 623 Cb 0.08 -1.06 -0.05 0.00 0.06 0.00 0.00 34.95 33.97 2kui s ARG 623 CO -0.09 0.26 -0.03 -0.59 -2.50 0.00 0.00 175.30 172.35 2kui s PHE 624 N -0.98 1.74 0.00 5.12 -0.12 -1.26 0.43 117.98 122.91 2kui s PHE 624 Ca 0.02 -0.82 0.00 0.00 -0.05 0.00 0.00 56.93 56.08 2kui s PHE 624 Cb -0.09 -1.01 0.00 0.00 -0.63 0.00 0.00 43.02 41.30 2kui s PHE 624 CO 0.02 0.11 0.00 0.41 -0.05 0.00 0.00 175.22 175.71 2kui n GLY 625 N -0.50 0.69 0.37 1.99 0.00 -1.03 -3.91 105.19 102.81 2kui n GLY 625 Ca -0.05 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.11 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14