#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 4.28 0.51 -0.61 1.10 -1.26 -5.00 121.20 120.22 2kui s ILE 356 Ca 0.00 1.57 -0.19 0.00 -0.51 0.00 0.00 60.65 61.52 2kui s ILE 356 Cb 0.00 -4.01 -0.08 0.00 0.15 0.00 0.00 42.46 38.52 2kui s ILE 356 CO 0.00 -0.08 1.02 -0.89 -2.11 0.00 0.00 174.94 172.88 2kui s THR 357 N 2.93 4.02 -0.05 4.00 2.01 -1.26 -4.95 115.64 122.33 2kui s THR 357 Ca 0.55 1.14 0.13 0.00 0.31 0.00 0.00 61.69 63.82 2kui s THR 357 Cb -0.23 -3.50 -0.18 0.00 0.01 0.00 0.00 72.50 68.60 2kui s THR 357 CO 0.18 -0.39 0.85 0.03 -0.69 0.00 0.00 174.62 174.60 2kui h ARG 358 N 1.26 0.00 -6.85 4.92 -0.00 -1.97 -3.45 114.38 108.28 2kui h ARG 358 Ca -0.48 0.00 -0.50 0.00 -0.50 0.00 0.00 59.98 58.49 2kui h ARG 358 Cb 1.21 0.00 0.03 0.00 0.00 0.00 0.00 29.97 31.20 2kui h ARG 358 CO 0.59 0.50 0.48 -0.51 0.00 0.00 0.00 179.97 181.03 2kui s ASP 359 N -6.10 7.05 0.22 7.04 1.01 -1.26 -4.67 116.67 119.96 2kui s ASP 359 Ca -0.03 2.28 0.05 0.00 0.71 0.00 0.00 52.55 55.56 2kui s ASP 359 Cb 0.08 -2.62 -0.05 0.00 1.01 0.00 0.00 42.92 41.34 2kui s ASP 359 CO 0.81 -0.30 -0.06 0.68 0.21 0.00 0.00 175.17 176.52 2kui s VAL 360 N -1.27 1.32 -0.04 -1.27 -7.23 0.24 -4.81 120.40 107.33 2kui s VAL 360 Ca 0.48 -2.09 -0.14 0.00 -1.81 0.00 0.00 61.98 58.43 2kui s VAL 360 Cb -0.31 -2.23 -0.05 0.00 0.56 0.00 0.00 36.38 34.35 2kui s VAL 360 CO 0.39 -0.44 0.36 -1.58 -0.31 0.00 0.00 175.10 173.53 2kui s GLN 361 N -3.77 3.92 -0.23 4.82 0.74 -1.26 -0.45 119.66 123.42 2kui s GLN 361 Ca 0.26 0.30 -0.15 0.00 0.05 0.00 0.00 55.36 55.82 2kui s GLN 361 Cb 0.04 -3.25 -0.04 0.00 1.10 0.00 0.00 33.01 30.85 2kui s GLN 361 CO 0.08 0.61 0.37 0.08 -0.55 0.00 0.00 175.29 175.88 2kui s VAL 362 N -0.77 5.20 0.14 1.34 1.01 0.35 -4.98 120.40 122.68 2kui s VAL 362 Ca 0.22 0.61 -0.31 0.00 0.00 0.00 0.00 61.98 62.50 2kui s VAL 362 Cb -0.15 -3.70 -0.10 0.00 0.00 0.00 0.00 36.38 32.42 2kui s VAL 362 CO 0.11 0.23 1.79 -2.84 0.00 0.00 0.00 175.10 174.38 2kui s PRO 363 N 1.54 4.14 -0.37 2.72 0.02 -1.26 -4.19 135.00 137.60 2kui s PRO 363 Ca 0.17 2.57 -0.25 0.00 0.02 0.00 0.00 61.00 63.50 2kui s PRO 363 Cb -0.15 -3.48 0.01 0.00 0.02 0.00 0.00 34.50 30.90 2kui s PRO 363 CO 0.08 -0.81 0.90 0.16 -0.33 0.00 0.00 177.00 177.01 2kui s ASP 364 N 2.35 6.65 -0.05 2.53 -4.77 -1.26 -4.88 116.67 117.24 2kui s ASP 364 Ca 0.79 0.53 0.08 0.00 -3.30 0.00 0.00 52.55 50.64 2kui s ASP 364 Cb -0.46 -2.45 0.31 0.00 -1.09 0.00 0.00 42.92 39.22 2kui s ASP 364 CO 0.35 -0.84 1.12 0.55 0.70 0.00 0.00 175.17 177.05 2kui n VAL 365 N 5.96 0.79 -1.67 2.11 3.14 -1.26 -4.94 118.33 122.46 2kui n VAL 365 Ca 0.06 -0.50 -0.39 0.00 -2.96 0.00 0.00 64.34 60.56 2kui n VAL 365 Cb 0.48 -0.11 0.04 0.00 -1.06 0.00 0.00 33.84 33.19 2kui n VAL 365 CO 0.00 0.00 0.00 -2.11 -6.46 0.00 0.00 176.83 168.26 2kui n ARG 366 N 0.33 1.36 0.00 1.45 1.85 -1.26 -3.80 116.66 116.58 2kui n ARG 366 Ca 0.11 0.50 0.00 0.00 -1.00 0.00 0.00 57.85 57.46 2kui n ARG 366 Cb 0.46 -2.31 0.00 0.00 -1.05 0.00 0.00 32.46 29.55 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 1.03 0.63 0.00 2.89 0.00 0.18 -5.00 105.19 104.92 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 -1.56 3.80 -2.67 1.61 6.02 -1.24 -4.91 117.38 118.43 2kui n GLN 368 Ca 0.00 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.76 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 0.58 5.50 0.20 1.08 1.04 -1.26 -0.71 113.70 120.12 2kui s SER 369 Ca 0.00 0.30 -0.09 0.00 0.48 0.00 0.00 55.95 56.64 2kui s SER 369 Cb 0.00 -1.32 0.13 0.00 0.10 0.00 0.00 66.02 64.94 2kui s SER 369 CO 0.00 -1.01 1.78 0.28 0.98 0.00 0.00 173.24 175.26 2kui h SER 370 N 0.07 0.99 -0.24 7.02 0.02 -1.72 -0.64 113.55 119.05 2kui h SER 370 Ca -0.45 -0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 60.33 2kui h SER 370 Cb 1.27 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.55 2kui h SER 370 CO 0.57 0.87 0.06 0.00 -1.14 0.00 0.00 176.83 177.19 2kui h ALA 371 N 1.16 0.32 -0.43 3.77 0.00 -1.94 0.20 119.26 122.34 2kui h ALA 371 Ca 0.25 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 2kui h ALA 371 Cb 0.17 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2kui h ALA 371 CO -0.03 -0.03 -0.31 0.22 0.00 0.00 0.00 179.25 179.10 2kui h ASP 372 N 0.21 1.01 -0.19 0.00 1.82 -1.92 0.14 116.42 117.48 2kui h ASP 372 Ca 0.08 -0.43 -0.04 0.00 -0.39 0.00 0.00 57.03 56.25 2kui h ASP 372 Cb 0.27 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 39.99 2kui h ASP 372 CO 0.00 1.23 -0.04 0.00 -1.61 0.00 0.00 179.24 178.82 2kui h ALA 373 N 0.83 0.27 -0.66 -0.78 0.00 -0.99 -1.46 119.26 116.47 2kui h ALA 373 Ca 0.08 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2kui h ALA 373 Cb 0.90 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2kui h ALA 373 CO 0.08 0.03 0.17 0.82 0.00 0.00 0.00 179.25 180.36 2kui h ILE 374 N 0.09 1.26 -0.83 0.00 2.04 -0.50 -2.00 117.51 117.57 2kui h ILE 374 Ca 0.05 -0.92 0.03 0.00 1.00 0.00 0.00 64.86 65.02 2kui h ILE 374 Cb 0.48 0.60 -0.05 0.00 -0.74 0.00 0.00 36.82 37.11 2kui h ILE 374 CO 0.02 0.35 0.54 0.00 0.00 0.00 0.00 178.15 179.06 2kui h ALA 375 N 1.07 1.09 -0.19 1.87 0.00 -0.60 0.19 119.26 122.68 2kui h ALA 375 Ca 0.21 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2kui h ALA 375 Cb 0.35 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2kui h ALA 375 CO -0.00 0.39 0.08 1.15 0.00 0.00 0.00 179.25 180.87 2kui h THR 376 N 1.06 1.16 -0.60 0.00 2.02 -0.96 -0.96 112.91 114.64 2kui h THR 376 Ca 0.33 -0.48 -0.06 0.00 0.77 0.00 0.00 66.41 66.97 2kui h THR 376 Cb -0.02 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.48 2kui h THR 376 CO -0.10 0.15 0.14 -0.07 0.37 0.00 0.00 175.52 176.02 2kui h LEU 377 N 0.16 0.88 -0.89 2.58 3.38 -0.85 -2.00 115.31 118.57 2kui h LEU 377 Ca 0.06 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 2kui h LEU 377 Cb 0.17 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2kui h LEU 377 CO -0.01 0.85 0.21 -0.61 0.09 0.00 0.00 178.44 178.98 2kui h GLN 378 N 0.90 1.03 0.00 1.13 4.15 -0.41 -0.08 115.11 121.82 2kui h GLN 378 Ca 0.19 -0.21 -0.04 0.00 0.77 0.00 0.00 58.65 59.36 2kui h GLN 378 Cb 0.32 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 2kui h GLN 378 CO -0.00 0.88 -0.21 -0.91 -1.93 0.00 0.00 178.83 176.66 2kui h ASN 379 N 0.99 0.00 1.32 -0.69 2.35 -0.57 -1.56 115.58 117.43 2kui h ASN 379 Ca 0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2kui h ASN 379 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 2kui h ASN 379 CO -0.01 0.21 -0.15 0.54 -1.65 0.00 0.00 177.43 176.36 2kui n ARG 380 N -3.52 0.27 -0.30 0.81 5.12 -0.70 -4.92 116.66 113.42 2kui n ARG 380 Ca -0.01 0.18 0.00 0.00 -1.93 0.00 0.00 57.85 56.09 2kui n ARG 380 Cb 0.36 -1.77 0.00 0.00 -1.16 0.00 0.00 32.46 29.89 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 1.32 0.82 3.91 -0.13 0.00 -0.59 -4.88 105.19 105.65 2kui n GLY 381 Ca 0.05 -0.23 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 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 3.55 -0.18 1.61 0.40 -0.13 -4.52 117.98 116.71 2kui s PHE 382 Ca 0.00 0.77 -0.09 0.00 -0.60 0.00 0.00 56.93 57.01 2kui s PHE 382 Cb 0.00 -2.26 -0.05 0.00 0.51 0.00 0.00 43.02 41.23 2kui s PHE 382 CO 0.00 -0.21 0.12 0.15 0.70 0.00 0.00 175.22 175.98 2kui s LYS 383 N -4.62 3.96 -0.04 0.44 -0.14 -0.30 -4.30 119.74 114.74 2kui s LYS 383 Ca 0.47 -0.22 0.06 0.00 -1.36 0.00 0.00 55.97 54.92 2kui s LYS 383 Cb -0.10 -3.32 -0.01 0.00 -1.68 0.00 0.00 37.83 32.71 2kui s LYS 383 CO 0.43 0.42 -0.22 0.42 -0.76 0.00 0.00 175.35 175.64 2kui s ILE 384 N 0.00 1.75 -0.05 2.17 1.09 -1.26 -0.50 121.20 124.40 2kui s ILE 384 Ca 0.09 -0.92 0.05 0.00 -1.10 0.00 0.00 60.65 58.77 2kui s ILE 384 Cb -0.11 -1.48 -0.02 0.00 -1.06 0.00 0.00 42.46 39.79 2kui s ILE 384 CO -0.00 0.50 -0.19 -0.60 -0.10 0.00 0.00 174.94 174.54 2kui s ARG 385 N -0.26 2.45 -0.05 2.79 3.52 0.79 -4.89 118.95 123.30 2kui s ARG 385 Ca 0.01 -0.80 0.02 0.00 -0.13 0.00 0.00 55.73 54.84 2kui s ARG 385 Cb -0.11 -2.26 0.01 0.00 -1.56 0.00 0.00 34.95 31.03 2kui s ARG 385 CO 0.01 0.54 -0.11 0.99 -0.81 0.00 0.00 175.30 175.92 2kui s THR 386 N -0.53 0.98 -0.18 4.11 2.01 -1.26 0.04 115.64 120.81 2kui s THR 386 Ca 0.07 -0.42 -0.00 0.00 0.31 0.00 0.00 61.69 61.64 2kui s THR 386 Cb -0.11 -0.89 0.01 0.00 0.01 0.00 0.00 72.50 71.51 2kui s THR 386 CO 0.01 0.31 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.89 2kui s LEU 387 N 0.46 2.44 -0.21 4.42 1.98 0.35 -4.93 118.68 123.19 2kui s LEU 387 Ca -0.09 -0.52 -0.20 0.00 -2.89 0.00 0.00 54.13 50.42 2kui s LEU 387 Cb -0.13 -1.57 -0.02 0.00 0.66 0.00 0.00 46.19 45.12 2kui s LEU 387 CO 0.02 0.02 0.62 -1.10 -1.89 0.00 0.00 176.35 174.02 2kui s GLN 388 N 1.17 4.18 -0.02 1.98 1.11 -1.26 -0.79 119.66 126.03 2kui s GLN 388 Ca 0.02 0.58 0.02 0.00 0.01 0.00 0.00 55.36 55.99 2kui s GLN 388 Cb -0.14 -3.60 0.00 0.00 -1.01 0.00 0.00 33.01 28.27 2kui s GLN 388 CO -0.06 -0.28 -0.08 0.15 0.01 0.00 0.00 175.29 175.03 2kui s LYS 389 N 2.06 0.87 1.03 2.91 1.02 0.62 -4.95 119.74 123.30 2kui s LYS 389 Ca 0.28 -0.27 -0.16 0.00 0.02 0.00 0.00 55.97 55.83 2kui s LYS 389 Cb -0.16 -0.82 0.21 0.00 -0.52 0.00 0.00 37.83 36.54 2kui s LYS 389 CO 0.10 0.09 1.23 -1.25 -0.92 0.00 0.00 175.35 174.60 2kui s PRO 390 N 0.22 0.17 0.00 -1.68 0.04 -1.26 -0.62 135.00 131.87 2kui s PRO 390 Ca -0.03 -0.19 0.00 0.00 0.04 0.00 0.00 61.00 60.81 2kui s PRO 390 Cb -0.08 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.69 2kui s PRO 390 CO 0.00 -2.76 0.00 -3.47 0.04 0.00 0.00 177.00 170.81 2kui n ASP 391 N -4.06 0.00 -0.00 6.66 -0.08 0.11 -4.73 116.55 114.45 2kui n ASP 391 Ca 0.13 0.00 0.07 0.00 -1.51 0.00 0.00 54.79 53.49 2kui n ASP 391 Cb 0.59 0.00 -0.10 0.00 2.34 0.00 0.00 41.12 43.96 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 -1.44 0.91 -0.08 1.67 2.88 -1.26 -4.22 113.62 112.07 2kui n SER 392 Ca 0.00 -0.63 0.15 0.00 -1.33 0.00 0.00 58.87 57.06 2kui n SER 392 Cb 0.00 1.19 0.73 0.00 -0.75 0.00 0.00 64.21 65.38 2kui n SER 392 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2kui n THR 393 N -1.54 0.00 -3.25 2.46 5.66 -1.26 -4.74 114.28 111.61 2kui n THR 393 Ca 0.01 -0.04 -0.35 0.00 -3.05 0.00 0.00 64.05 60.62 2kui n THR 393 Cb 0.28 -0.26 -0.06 0.00 -1.55 0.00 0.00 70.33 68.74 2kui n THR 393 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 2kui s ILE 394 N -2.34 4.74 -0.45 1.09 -1.09 -1.26 -4.96 121.20 116.93 2kui s ILE 394 Ca 0.35 0.96 -0.41 0.00 -2.23 0.00 0.00 60.65 59.31 2kui s ILE 394 Cb 0.21 -3.74 -0.18 0.00 -1.58 0.00 0.00 42.46 37.17 2kui s ILE 394 CO 0.43 0.13 1.61 -2.65 -1.23 0.00 0.00 174.94 173.24 2kui n PRO 395 N 0.49 0.00 -1.48 2.79 -0.02 -1.26 -4.74 135.00 130.78 2kui n PRO 395 Ca -0.02 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.10 2kui n PRO 395 Cb 0.52 -1.35 0.08 0.00 -0.02 0.00 0.00 33.50 32.73 2kui n PRO 395 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2kui n PRO 396 N 4.75 0.71 0.00 0.52 -0.04 -1.26 -1.85 135.00 137.83 2kui n PRO 396 Ca 0.36 0.30 0.00 0.00 -0.04 0.00 0.00 63.50 64.12 2kui n PRO 396 Cb -0.05 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.08 2kui n PRO 396 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2kui n ASP 397 N -1.81 0.00 -4.33 3.54 5.75 -1.26 -3.71 116.55 114.73 2kui n ASP 397 Ca 0.14 0.39 -0.39 0.00 -0.01 0.00 0.00 54.79 54.92 2kui n ASP 397 Cb 0.49 -0.39 -0.12 0.00 -1.03 0.00 0.00 41.12 40.07 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 -2.78 3.25 -0.02 2.11 3.76 -1.26 -1.83 115.29 118.52 2kui s HIS 398 Ca 0.00 -1.16 -0.30 0.00 -0.15 0.00 0.00 55.06 53.45 2kui s HIS 398 Cb 0.00 -2.38 -0.07 0.00 1.11 0.00 0.00 32.58 31.24 2kui s HIS 398 CO 0.00 -0.69 1.87 0.14 -0.85 0.00 0.00 174.74 175.21 2kui s VAL 399 N 1.49 3.23 -0.10 -0.90 -7.23 0.11 -4.86 120.40 112.14 2kui s VAL 399 Ca 0.00 0.27 0.15 0.00 -1.81 0.00 0.00 61.98 60.60 2kui s VAL 399 Cb -0.19 -3.19 -0.21 0.00 0.56 0.00 0.00 36.38 33.35 2kui s VAL 399 CO 0.05 -0.04 0.61 2.30 -0.31 0.00 0.00 175.10 177.71 2kui n ILE 400 N 5.72 1.37 -3.90 -0.62 -0.00 -1.26 0.47 119.36 121.14 2kui n ILE 400 Ca 0.20 -0.76 -0.08 0.00 -0.00 0.00 0.00 62.75 62.10 2kui n ILE 400 Cb 0.42 -0.80 -0.08 0.00 -0.00 0.00 0.00 39.64 39.18 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 -5.05 0.17 0.33 3.28 0.00 -1.26 -4.46 107.32 100.33 2kui s GLY 401 Ca -0.05 -0.73 0.02 0.00 0.00 0.00 0.00 44.72 43.96 2kui s GLY 401 CO 0.82 -0.90 0.13 -1.30 0.00 0.00 0.00 173.10 171.86 2kui n THR 402 N -0.03 0.00 -3.80 0.90 -2.24 -1.26 -4.89 114.28 102.95 2kui n THR 402 Ca -0.15 -1.42 -0.37 0.00 -2.27 0.00 0.00 64.05 59.85 2kui n THR 402 Cb 0.62 0.04 -0.06 0.00 -2.10 0.00 0.00 70.33 68.83 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 -2.87 6.38 0.42 3.42 -1.08 -1.26 -4.97 116.67 116.72 2kui s ASP 403 Ca 0.10 0.46 0.21 0.00 -0.52 0.00 0.00 52.55 52.80 2kui s ASP 403 Cb -0.01 -2.09 1.15 0.00 -1.46 0.00 0.00 42.92 40.51 2kui s ASP 403 CO 0.06 0.34 1.60 1.55 0.52 0.00 0.00 175.17 179.24 2kui h PRO 404 N 5.42 0.00 0.00 4.34 0.13 -1.99 -0.61 132.00 139.28 2kui h PRO 404 Ca -0.51 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 2kui h PRO 404 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2kui h PRO 404 CO 0.63 0.00 -0.03 0.00 -0.23 0.00 0.00 178.00 178.37 2kui h ALA 405 N 1.49 1.82 -0.10 -0.56 0.00 -1.93 -0.88 119.26 119.10 2kui h ALA 405 Ca 0.00 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.67 2kui h ALA 405 Cb 0.41 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.21 2kui h ALA 405 CO 0.00 0.04 -0.81 0.00 0.00 0.00 0.00 179.25 178.47 2kui h ALA 406 N 1.97 0.37 -0.00 0.00 0.00 -1.40 -3.07 119.26 117.13 2kui h ALA 406 Ca -0.00 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2kui h ALA 406 Cb 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2kui h ALA 406 CO 0.00 0.72 -0.03 0.09 0.00 0.00 0.00 179.25 180.03 2kui n ASN 407 N -3.88 0.12 -4.87 0.00 4.13 -0.52 -0.50 115.26 109.74 2kui n ASN 407 Ca -0.07 -0.30 -0.35 0.00 1.68 0.00 0.00 54.58 55.54 2kui n ASN 407 Cb 0.76 -0.21 -0.06 0.00 -1.54 0.00 0.00 39.78 38.73 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 -2.52 5.16 -0.35 3.41 2.01 -0.45 -4.90 115.64 118.01 2kui s THR 408 Ca 0.30 0.44 -0.29 0.00 0.31 0.00 0.00 61.69 62.45 2kui s THR 408 Cb 0.20 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 69.09 2kui s THR 408 CO 0.46 0.39 1.40 -0.44 -0.69 0.00 0.00 174.62 175.75 2kui s SER 409 N -1.55 6.45 0.32 3.53 0.01 -1.26 -4.17 113.70 117.03 2kui s SER 409 Ca 0.28 1.07 0.04 0.00 1.31 0.00 0.00 55.95 58.66 2kui s SER 409 Cb -0.14 -2.54 -0.06 0.00 0.21 0.00 0.00 66.02 63.49 2kui s SER 409 CO 0.16 -1.29 0.04 0.68 0.41 0.00 0.00 173.24 173.24 2kui s VAL 410 N 5.05 1.27 0.14 3.43 -7.23 0.40 -4.73 120.40 118.73 2kui s VAL 410 Ca 0.61 -2.01 -0.30 0.00 -1.81 0.00 0.00 61.98 58.46 2kui s VAL 410 Cb -0.16 -2.75 -0.07 0.00 0.56 0.00 0.00 36.38 33.96 2kui s VAL 410 CO 0.29 -0.05 1.26 -0.55 -0.31 0.00 0.00 175.10 175.73 2kui s SER 411 N -3.48 7.00 0.22 4.85 0.15 -1.26 -0.60 113.70 120.57 2kui s SER 411 Ca 0.35 2.22 -0.30 0.00 0.70 0.00 0.00 55.95 58.92 2kui s SER 411 Cb 0.08 -2.60 -0.10 0.00 -1.71 0.00 0.00 66.02 61.70 2kui s SER 411 CO 0.15 -0.48 1.46 0.00 1.20 0.00 0.00 173.24 175.57 2kui s ALA 412 N 0.49 3.66 0.00 5.45 0.00 -1.26 -4.06 121.76 126.04 2kui s ALA 412 Ca 0.57 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.85 2kui s ALA 412 Cb -0.33 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.22 2kui s ALA 412 CO 0.34 -0.74 0.00 0.41 0.00 0.00 0.00 175.76 175.77 2kui n GLY 413 N 2.68 0.70 2.80 0.00 0.00 -1.26 -5.03 105.19 105.07 2kui n GLY 413 Ca 0.09 -0.40 -0.21 0.00 0.00 0.00 0.00 46.02 45.50 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 2.57 -4.30 1.61 -0.08 -1.26 -4.79 116.55 110.30 2kui n ASP 414 Ca 0.00 -2.50 -0.39 0.00 -1.51 0.00 0.00 54.79 50.39 2kui n ASP 414 Cb 0.00 0.07 -0.12 0.00 2.34 0.00 0.00 41.12 43.42 2kui n ASP 414 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2kui s GLU 415 N -3.58 2.66 -0.32 -0.67 2.02 -1.25 -1.15 118.70 116.41 2kui s GLU 415 Ca 0.15 -1.22 -0.14 0.00 0.02 0.00 0.00 54.97 53.79 2kui s GLU 415 Cb -0.01 -3.60 -0.02 0.00 0.10 0.00 0.00 34.13 30.60 2kui s GLU 415 CO 0.10 -0.74 0.31 0.42 0.02 0.00 0.00 175.26 175.37 2kui s ILE 416 N 1.44 5.22 -0.17 -1.63 -1.09 0.34 -4.88 121.20 120.43 2kui s ILE 416 Ca 0.00 0.09 -0.12 0.00 -2.23 0.00 0.00 60.65 58.39 2kui s ILE 416 Cb -0.20 -3.73 -0.05 0.00 -1.58 0.00 0.00 42.46 36.90 2kui s ILE 416 CO 0.04 0.02 0.23 -0.89 -1.23 0.00 0.00 174.94 173.10 2kui s THR 417 N 1.92 5.35 -0.06 2.92 2.01 -1.25 -0.15 115.64 126.38 2kui s THR 417 Ca 0.10 0.40 0.06 0.00 0.31 0.00 0.00 61.69 62.56 2kui s THR 417 Cb -0.17 -3.56 -0.01 0.00 0.01 0.00 0.00 72.50 68.77 2kui s THR 417 CO 0.11 0.42 -0.23 0.54 -0.69 0.00 0.00 174.62 174.77 2kui s VAL 418 N 0.31 2.23 -0.26 3.82 0.11 0.11 -4.65 120.40 122.06 2kui s VAL 418 Ca 0.13 -1.01 -0.16 0.00 -2.93 0.00 0.00 61.98 58.01 2kui s VAL 418 Cb -0.12 -1.82 -0.03 0.00 -1.53 0.00 0.00 36.38 32.88 2kui s VAL 418 CO 0.02 0.57 0.45 0.20 -3.33 0.00 0.00 175.10 173.01 2kui s ASN 419 N -0.26 6.35 -0.11 3.54 0.01 -1.26 -0.50 114.94 122.71 2kui s ASN 419 Ca -0.00 0.41 0.01 0.00 -0.71 0.00 0.00 52.86 52.56 2kui s ASN 419 Cb -0.13 -2.25 -0.02 0.00 0.41 0.00 0.00 41.25 39.27 2kui s ASN 419 CO 0.03 -0.24 -0.13 0.54 -1.51 0.00 0.00 177.10 175.79 2kui s VAL 420 N 2.18 3.10 -0.16 1.60 0.11 0.03 -4.62 120.40 122.65 2kui s VAL 420 Ca 0.18 -0.66 -0.22 0.00 -2.93 0.00 0.00 61.98 58.36 2kui s VAL 420 Cb -0.16 -2.28 -0.03 0.00 -1.53 0.00 0.00 36.38 32.38 2kui s VAL 420 CO 0.09 0.54 0.66 -0.94 -3.33 0.00 0.00 175.10 172.12 2kui s SER 421 N 0.08 6.78 -0.30 3.54 1.04 -0.77 -0.27 113.70 123.79 2kui s SER 421 Ca -0.05 0.95 0.02 0.00 0.48 0.00 0.00 55.95 57.34 2kui s SER 421 Cb -0.15 -2.37 0.07 0.00 0.10 0.00 0.00 66.02 63.68 2kui s SER 421 CO 0.04 -0.23 -0.02 0.28 0.98 0.00 0.00 173.24 174.29 2kui s THR 422 N 1.61 2.46 0.05 2.02 -1.32 0.21 -4.27 115.64 116.38 2kui s THR 422 Ca 0.31 -1.81 0.00 0.00 -1.21 0.00 0.00 61.69 58.98 2kui s THR 422 Cb -0.16 -2.56 0.00 0.00 -1.51 0.00 0.00 72.50 68.27 2kui s THR 422 CO 0.12 -0.25 0.00 0.61 -2.21 0.00 0.00 174.62 172.89 2kui n GLY 423 N 4.43 -4.36 3.76 6.08 0.00 -1.26 -3.99 105.19 109.85 2kui n GLY 423 Ca -0.08 -0.36 -0.39 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.55 3.48 0.36 1.61 0.02 -1.26 -0.71 135.00 136.94 2kui s PRO 424 Ca 0.00 2.29 0.07 0.00 0.02 0.00 0.00 61.00 63.38 2kui s PRO 424 Cb 0.00 -2.48 -0.01 0.00 0.02 0.00 0.00 34.50 32.03 2kui s PRO 424 CO 0.00 -0.94 0.47 -1.21 -0.33 0.00 0.00 177.00 174.99 2kui s GLU 425 N -2.64 2.98 0.42 5.54 2.02 -1.26 -4.73 118.70 121.03 2kui s GLU 425 Ca 0.65 -1.12 -0.06 0.00 0.02 0.00 0.00 54.97 54.46 2kui s GLU 425 Cb -0.41 -2.75 -0.05 0.00 0.10 0.00 0.00 34.13 31.03 2kui s GLU 425 CO 0.51 -0.02 0.72 -0.65 0.02 0.00 0.00 175.26 175.84 2kui s GLN 426 N -4.19 3.62 0.17 1.61 -0.21 -1.26 -4.45 119.66 114.95 2kui s GLN 426 Ca 0.47 0.21 0.10 0.00 0.02 0.00 0.00 55.36 56.16 2kui s GLN 426 Cb -0.09 -2.45 -0.04 0.00 1.00 0.00 0.00 33.01 31.43 2kui s GLN 426 CO 0.31 -0.06 -0.22 1.03 -2.12 0.00 0.00 175.29 174.23 2kui s ARG 427 N -4.25 1.39 0.18 2.91 1.81 -0.35 -4.93 118.95 115.70 2kui s ARG 427 Ca 0.47 -1.44 -0.23 0.00 -1.72 0.00 0.00 55.73 52.82 2kui s ARG 427 Cb -0.10 -1.63 -0.08 0.00 -0.45 0.00 0.00 34.95 32.69 2kui s ARG 427 CO 0.38 0.35 0.75 -2.00 -0.68 0.00 0.00 175.30 174.10 2kui s GLU 428 N -2.59 4.45 -0.07 3.54 2.12 -1.26 0.05 118.70 124.94 2kui s GLU 428 Ca 0.17 1.05 -0.30 0.00 0.36 0.00 0.00 54.97 56.25 2kui s GLU 428 Cb -0.08 -3.13 -0.02 0.00 0.26 0.00 0.00 34.13 31.16 2kui s GLU 428 CO 0.08 0.52 1.08 0.42 -0.54 0.00 0.00 175.26 176.82 2kui s ILE 429 N -1.27 4.56 0.45 -3.70 1.01 0.72 -4.91 121.20 118.07 2kui s ILE 429 Ca 0.38 1.85 -0.24 0.00 0.00 0.00 0.00 60.65 62.64 2kui s ILE 429 Cb -0.21 -4.19 -0.07 0.00 0.01 0.00 0.00 42.46 38.00 2kui s ILE 429 CO 0.24 0.02 1.23 -2.84 0.00 0.00 0.00 174.94 173.59 2kui s PRO 430 N 1.96 3.77 -0.56 2.79 0.02 -1.26 -4.35 135.00 137.38 2kui s PRO 430 Ca 0.52 1.94 -0.28 0.00 0.02 0.00 0.00 61.00 63.20 2kui s PRO 430 Cb -0.21 -2.52 0.01 0.00 0.02 0.00 0.00 34.50 31.80 2kui s PRO 430 CO 0.21 -0.59 1.47 0.34 -0.33 0.00 0.00 177.00 178.10 2kui s ASP 431 N -1.11 6.05 -0.05 2.53 2.15 -1.26 -4.94 116.67 120.03 2kui s ASP 431 Ca 0.62 0.33 0.05 0.00 0.43 0.00 0.00 52.55 53.97 2kui s ASP 431 Cb -0.33 -2.54 -0.02 0.00 -0.30 0.00 0.00 42.92 39.73 2kui s ASP 431 CO 0.41 -1.77 -0.19 -0.69 -0.17 0.00 0.00 175.17 172.76 2kui s VAL 432 N 6.34 2.61 0.61 1.11 1.01 -1.26 -5.11 120.40 125.70 2kui s VAL 432 Ca 0.55 -0.88 -0.17 0.00 0.00 0.00 0.00 61.98 61.47 2kui s VAL 432 Cb -0.11 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 2kui s VAL 432 CO 0.25 0.58 1.13 -0.44 0.00 0.00 0.00 175.10 176.62 2kui s SER 433 N -0.47 5.34 0.34 3.32 0.01 -1.26 -4.94 113.70 116.03 2kui s SER 433 Ca 0.06 2.13 0.04 0.00 1.31 0.00 0.00 55.95 59.49 2kui s SER 433 Cb -0.12 -2.57 0.61 0.00 0.21 0.00 0.00 66.02 64.15 2kui s SER 433 CO 0.01 -1.48 1.88 0.71 0.41 0.00 0.00 173.24 174.77 2kui h THR 434 N 0.60 1.19 0.00 1.44 1.35 -1.98 -1.51 112.91 114.01 2kui h THR 434 Ca -0.49 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 64.60 2kui h THR 434 Cb 1.26 0.94 0.00 0.00 -1.73 0.00 0.00 68.15 68.62 2kui h THR 434 CO 0.55 0.27 -0.24 0.00 -0.25 0.00 0.00 175.52 175.85 2kui n LEU 435 N -4.28 0.36 -2.23 3.87 -0.00 -1.26 0.10 117.00 113.55 2kui n LEU 435 Ca 0.01 0.32 -0.26 0.00 -0.00 0.00 0.00 56.01 56.08 2kui n LEU 435 Cb 0.24 -0.36 0.03 0.00 -0.00 0.00 0.00 43.42 43.34 2kui n LEU 435 CO 0.39 0.01 1.39 0.41 -0.00 0.00 0.00 177.39 179.58 2kui n THR 436 N -1.69 3.22 -0.35 1.47 -1.04 -0.57 -4.67 114.28 110.66 2kui n THR 436 Ca 0.06 -2.54 0.12 0.00 -2.04 0.00 0.00 64.05 59.64 2kui n THR 436 Cb 0.36 -1.32 0.31 0.00 -1.82 0.00 0.00 70.33 67.87 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 2.06 1.06 -0.66 -1.42 3.20 -1.72 0.98 116.97 120.46 2kui h TYR 437 Ca 0.43 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.30 2kui h TYR 437 Cb 0.76 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.68 2kui h TYR 437 CO 1.15 0.29 0.27 0.00 -1.64 0.00 0.00 178.16 178.23 2kui h ALA 438 N 1.62 0.86 -0.12 1.82 0.00 -1.95 -1.34 119.26 120.15 2kui h ALA 438 Ca 0.55 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 55.14 2kui h ALA 438 Cb 0.81 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2kui h ALA 438 CO -0.34 0.48 -0.55 1.49 0.00 0.00 0.00 179.25 180.33 2kui h GLU 439 N 0.94 0.36 0.10 0.00 4.81 -1.53 -2.68 114.58 116.57 2kui h GLU 439 Ca 0.22 -0.22 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2kui h GLU 439 Cb 0.20 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.60 2kui h GLU 439 CO -0.02 0.81 -0.07 0.00 -0.73 0.00 0.00 179.01 179.01 2kui h ALA 440 N 1.14 -0.15 -0.70 2.92 0.00 -0.04 0.41 119.26 122.84 2kui h ALA 440 Ca 0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2kui h ALA 440 Cb 1.05 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 2kui h ALA 440 CO 0.09 -0.59 0.37 -0.39 0.00 0.00 0.00 179.25 178.73 2kui h VAL 441 N -0.17 1.21 -0.18 0.00 -1.51 -1.32 0.06 116.25 114.35 2kui h VAL 441 Ca -0.00 -0.54 0.00 0.00 -1.23 0.00 0.00 66.70 64.92 2kui h VAL 441 Cb 0.15 0.27 -0.01 0.00 -2.13 0.00 0.00 31.29 29.57 2kui h VAL 441 CO -0.00 0.24 0.11 0.50 -1.23 0.00 0.00 177.57 177.19 2kui h LYS 442 N 0.98 0.24 -0.51 5.19 1.63 -1.03 -0.65 116.57 122.42 2kui h LYS 442 Ca 0.25 -0.02 -0.10 0.00 -0.85 0.00 0.00 60.65 59.93 2kui h LYS 442 Cb 0.04 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.60 2kui h LYS 442 CO -0.04 0.18 -0.07 0.87 -3.45 0.00 0.00 179.45 176.95 2kui h LYS 443 N 0.22 0.92 -0.24 1.90 1.79 0.27 0.10 116.57 121.52 2kui h LYS 443 Ca 0.06 -0.30 -0.08 0.00 -2.18 0.00 0.00 60.65 58.15 2kui h LYS 443 Cb 0.00 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.56 2kui h LYS 443 CO -0.01 0.95 -0.18 -0.07 -1.08 0.00 0.00 179.45 179.06 2kui h LEU 444 N 0.83 0.42 -0.18 2.94 4.07 -0.85 -0.45 115.31 122.09 2kui h LEU 444 Ca 0.14 -0.12 -0.08 0.00 0.08 0.00 0.00 57.88 57.90 2kui h LEU 444 Cb 0.59 -0.11 -0.00 0.00 1.08 0.00 0.00 40.66 42.21 2kui h LEU 444 CO 0.04 0.63 -0.21 0.74 -1.08 0.00 0.00 178.44 178.55 2kui h THR 445 N 0.39 1.34 0.00 0.22 2.02 -0.38 0.40 112.91 116.90 2kui h THR 445 Ca 0.07 -1.39 0.00 0.00 0.77 0.00 0.00 66.41 65.86 2kui h THR 445 Cb 0.55 1.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.79 2kui h THR 445 CO 0.04 0.42 0.00 0.00 0.37 0.00 0.00 175.52 176.35 2kui h ALA 446 N 0.62 1.00 -0.06 6.16 0.00 -0.79 -1.80 119.26 124.39 2kui h ALA 446 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2kui h ALA 446 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2kui h ALA 446 CO 0.05 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.30 2kui n ALA 447 N -1.87 2.56 0.00 0.00 0.00 -0.19 -4.94 120.51 116.06 2kui n ALA 447 Ca 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.23 2kui n ALA 447 Cb 0.20 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2kui n ALA 447 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 448 N 0.83 2.06 0.47 0.00 0.00 -0.68 -4.73 105.19 103.15 2kui n GLY 448 Ca 0.12 -0.63 -0.16 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.46 -0.95 1.61 -5.15 -1.73 -3.46 116.94 105.80 2kui h PHE 449 Ca 0.00 0.04 -0.41 0.00 -0.20 0.00 0.00 57.97 57.40 2kui h PHE 449 Cb 0.00 0.62 -0.16 0.00 0.22 0.00 0.00 35.95 36.63 2kui h PHE 449 CO 0.00 -0.59 -0.37 0.41 -2.00 0.00 0.00 178.31 175.76 2kui n GLY 450 N -1.49 1.92 3.37 6.09 0.00 0.11 -4.93 105.19 110.26 2kui n GLY 450 Ca -0.08 -0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 2kui n GLY 450 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kui s ARG 451 N -3.69 2.90 0.02 1.61 0.52 -1.26 -4.72 118.95 114.33 2kui s ARG 451 Ca 0.00 -1.02 0.02 0.00 -0.52 0.00 0.00 55.73 54.21 2kui s ARG 451 Cb 0.00 -3.65 -0.02 0.00 0.52 0.00 0.00 34.95 31.81 2kui s ARG 451 CO 0.00 -0.63 -0.07 -0.59 0.02 0.00 0.00 175.30 174.02 2kui s PHE 452 N 1.54 0.65 -0.04 -0.53 -0.12 -1.25 -0.49 117.98 117.74 2kui s PHE 452 Ca 0.02 -0.31 0.00 0.00 -0.05 0.00 0.00 56.93 56.59 2kui s PHE 452 Cb -0.19 -0.40 0.03 0.00 -0.63 0.00 0.00 43.02 41.83 2kui s PHE 452 CO 0.06 -0.04 -0.01 0.15 -0.05 0.00 0.00 175.22 175.33 2kui s LYS 453 N -0.92 0.50 -0.15 1.99 -0.14 -0.47 -4.93 119.74 115.62 2kui s LYS 453 Ca -0.04 0.04 -0.19 0.00 -1.36 0.00 0.00 55.97 54.43 2kui s LYS 453 Cb -0.06 -0.69 -0.04 0.00 -1.68 0.00 0.00 37.83 35.36 2kui s LYS 453 CO 0.00 -0.16 0.54 -1.14 -0.76 0.00 0.00 175.35 173.83 2kui s GLN 454 N 1.24 4.29 0.06 1.68 0.74 -1.26 0.32 119.66 126.73 2kui s GLN 454 Ca -0.06 0.52 0.07 0.00 0.05 0.00 0.00 55.36 55.93 2kui s GLN 454 Cb -0.13 -3.50 -0.03 0.00 1.10 0.00 0.00 33.01 30.45 2kui s GLN 454 CO -0.02 -0.01 -0.18 0.00 -0.55 0.00 0.00 175.29 174.53 2kui s ALA 455 N 1.15 1.56 0.07 1.58 0.00 0.84 -4.94 121.76 122.01 2kui s ALA 455 Ca 0.27 -1.05 0.09 0.00 0.00 0.00 0.00 51.96 51.27 2kui s ALA 455 Cb -0.16 -0.24 -0.03 0.00 0.00 0.00 0.00 23.12 22.69 2kui s ALA 455 CO 0.11 0.31 -0.24 0.54 0.00 0.00 0.00 175.76 176.48 2kui s ASN 456 N -1.46 2.91 -0.04 0.00 2.20 -1.26 0.12 114.94 117.41 2kui s ASN 456 Ca 0.04 -0.62 -0.03 0.00 -0.94 0.00 0.00 52.86 51.31 2kui s ASN 456 Cb -0.09 -0.23 0.02 0.00 -2.00 0.00 0.00 41.25 38.95 2kui s ASN 456 CO 0.02 0.19 0.11 -0.55 -2.94 0.00 0.00 177.10 173.93 2kui s SER 457 N -1.49 -0.10 0.03 3.54 0.15 -0.75 -4.92 113.70 110.17 2kui s SER 457 Ca 0.10 0.21 -0.30 0.00 0.70 0.00 0.00 55.95 56.66 2kui s SER 457 Cb -0.10 0.19 -0.08 0.00 -1.71 0.00 0.00 66.02 64.33 2kui s SER 457 CO 0.03 -0.06 1.69 -2.84 1.20 0.00 0.00 173.24 173.26 2kui s PRO 458 N 0.33 4.19 0.30 5.44 0.02 -1.25 -0.41 135.00 143.62 2kui s PRO 458 Ca -0.02 2.32 -0.02 0.00 0.02 0.00 0.00 61.00 63.30 2kui s PRO 458 Cb -0.03 -3.78 0.01 0.00 0.02 0.00 0.00 34.50 30.72 2kui s PRO 458 CO -0.01 -0.79 0.43 0.43 -0.33 0.00 0.00 177.00 176.73 2kui n SER 459 N 6.27 -1.20 -4.53 2.53 7.64 0.16 -4.86 113.62 119.62 2kui n SER 459 Ca 0.17 -2.63 -0.51 0.00 1.01 0.00 0.00 58.87 56.91 2kui n SER 459 Cb 0.41 2.23 -0.05 0.00 -1.01 0.00 0.00 64.21 65.80 2kui n SER 459 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2kui n THR 460 N -0.50 0.88 -0.10 0.44 5.66 -1.26 -4.44 114.28 114.96 2kui n THR 460 Ca 0.00 -0.22 0.26 0.00 -3.05 0.00 0.00 64.05 61.04 2kui n THR 460 Cb 0.51 -0.53 0.72 0.00 -1.55 0.00 0.00 70.33 69.48 2kui n THR 460 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2kui h PRO 461 N 2.91 0.00 0.00 1.09 0.13 -1.92 0.41 132.00 134.62 2kui h PRO 461 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2kui h PRO 461 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 2kui h PRO 461 CO 0.67 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.49 2kui h GLU 462 N 0.00 0.00 -0.02 0.86 4.11 -1.98 -2.49 114.58 115.06 2kui h GLU 462 Ca 0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.78 2kui h GLU 462 Cb 1.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.74 2kui h GLU 462 CO -0.00 0.00 -0.20 1.28 0.07 0.00 0.00 179.01 180.15 2kui n LEU 463 N -3.00 2.00 -4.70 3.06 4.77 0.13 -4.85 117.00 114.41 2kui n LEU 463 Ca 0.01 -0.68 -0.42 0.00 -0.03 0.00 0.00 56.01 54.90 2kui n LEU 463 Cb 0.33 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 2kui n LEU 463 CO 0.28 0.35 1.41 -0.69 -1.33 0.00 0.00 177.39 177.41 2kui s VAL 464 N -2.25 2.37 0.00 4.08 1.01 -0.94 -1.17 120.40 123.50 2kui s VAL 464 Ca 0.26 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.32 2kui s VAL 464 Cb 0.19 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.52 2kui s VAL 464 CO 0.44 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.15 2kui n GLY 465 N 4.09 2.34 3.74 4.51 0.00 -0.26 -4.93 105.19 114.68 2kui n GLY 465 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.23 2.34 0.36 1.61 1.02 -0.31 -4.90 119.74 119.62 2kui s LYS 466 Ca 0.00 -1.61 -0.23 0.00 0.02 0.00 0.00 55.97 54.14 2kui s LYS 466 Cb 0.00 -2.14 -0.10 0.00 -0.52 0.00 0.00 37.83 35.07 2kui s LYS 466 CO 0.00 0.05 0.93 0.08 -0.92 0.00 0.00 175.35 175.49 2kui s VAL 467 N -2.46 4.31 -0.21 3.17 1.01 0.11 -0.34 120.40 126.00 2kui s VAL 467 Ca 0.39 1.64 0.09 0.00 0.00 0.00 0.00 61.98 64.10 2kui s VAL 467 Cb -0.01 -3.83 -0.21 0.00 0.00 0.00 0.00 36.38 32.33 2kui s VAL 467 CO 0.23 -0.05 0.00 -0.38 0.00 0.00 0.00 175.10 174.90 2kui n ILE 468 N 0.05 1.48 -0.70 2.22 5.41 0.11 -4.67 119.36 123.26 2kui n ILE 468 Ca 0.04 -0.71 0.00 0.00 1.00 0.00 0.00 62.75 63.08 2kui n ILE 468 Cb 0.52 -1.02 0.00 0.00 -0.71 0.00 0.00 39.64 38.42 2kui n ILE 468 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2kui n GLY 469 N 1.98 -0.28 3.21 7.39 0.00 -1.16 -5.04 105.19 111.30 2kui n GLY 469 Ca -0.38 -0.98 -0.15 0.00 0.00 0.00 0.00 46.02 44.51 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 -3.79 1.06 0.01 2.61 -4.23 -1.26 -1.65 115.64 108.39 2kui s THR 470 Ca 0.00 -1.82 -0.21 0.00 -1.18 0.00 0.00 61.69 58.48 2kui s THR 470 Cb 0.00 -1.57 -0.18 0.00 1.34 0.00 0.00 72.50 72.09 2kui s THR 470 CO 0.00 -0.62 1.24 -1.13 -0.54 0.00 0.00 174.62 173.57 2kui h ASN 471 N 3.24 0.35 -3.88 3.99 -1.24 -1.97 -3.42 115.58 112.65 2kui h ASN 471 Ca -0.37 -0.58 -0.51 0.00 0.71 0.00 0.00 56.30 55.55 2kui h ASN 471 Cb 1.19 -0.10 0.04 0.00 0.73 0.00 0.00 38.32 40.18 2kui h ASN 471 CO 0.57 0.86 0.52 -2.84 -1.29 0.00 0.00 177.43 175.26 2kui s PRO 472 N -3.91 4.34 0.14 6.67 0.02 -1.26 -4.96 135.00 136.04 2kui s PRO 472 Ca -0.14 1.91 -0.31 0.00 0.02 0.00 0.00 61.00 62.47 2kui s PRO 472 Cb 0.04 -2.95 -0.10 0.00 0.02 0.00 0.00 34.50 31.51 2kui s PRO 472 CO 0.76 -0.09 1.70 -2.14 -0.33 0.00 0.00 177.00 176.89 2kui s PRO 473 N -1.88 4.17 0.00 5.54 0.02 -1.26 -4.86 135.00 136.73 2kui s PRO 473 Ca 0.51 2.48 0.18 0.00 0.02 0.00 0.00 61.00 64.18 2kui s PRO 473 Cb -0.33 -3.36 1.07 0.00 0.02 0.00 0.00 34.50 31.89 2kui s PRO 473 CO 0.43 -0.74 1.51 0.00 -0.33 0.00 0.00 177.00 177.86 2kui n ALA 474 N 4.83 2.31 0.12 -1.55 0.00 -1.26 -1.08 120.51 123.87 2kui n ALA 474 Ca 0.16 -0.11 0.06 0.00 0.00 0.00 0.00 53.44 53.54 2kui n ALA 474 Cb 0.38 -1.29 0.11 0.00 0.00 0.00 0.00 19.45 18.65 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 -0.90 2.50 -4.90 0.00 5.03 -1.26 -4.34 115.26 111.39 2kui n ASN 475 Ca 0.13 -1.76 -0.25 0.00 0.87 0.00 0.00 54.58 53.57 2kui n ASN 475 Cb 0.06 -0.13 -0.01 0.00 -1.02 0.00 0.00 39.78 38.68 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 -0.98 2.29 0.04 3.52 -1.52 -0.24 -4.80 119.66 117.98 2kui s GLN 476 Ca 0.19 -1.92 -0.06 0.00 -1.95 0.00 0.00 55.36 51.62 2kui s GLN 476 Cb 0.11 -2.16 -0.05 0.00 -0.22 0.00 0.00 33.01 30.69 2kui s GLN 476 CO 0.15 -0.54 0.30 0.95 -0.25 0.00 0.00 175.29 175.91 2kui s THR 477 N -2.71 5.25 0.03 -0.19 -4.23 -1.26 -0.20 115.64 112.33 2kui s THR 477 Ca 0.38 0.16 0.01 0.00 -1.18 0.00 0.00 61.69 61.06 2kui s THR 477 Cb -0.02 -3.59 -0.02 0.00 1.34 0.00 0.00 72.50 70.21 2kui s THR 477 CO 0.23 0.29 -0.06 -0.44 -0.54 0.00 0.00 174.62 174.10 2kui s SER 478 N -1.88 0.61 0.64 3.99 0.01 0.11 -4.92 113.70 112.25 2kui s SER 478 Ca 0.31 -0.44 -0.11 0.00 1.31 0.00 0.00 55.95 57.01 2kui s SER 478 Cb -0.13 0.04 -0.02 0.00 0.21 0.00 0.00 66.02 66.11 2kui s SER 478 CO 0.19 -0.18 1.04 0.00 0.41 0.00 0.00 173.24 174.69 2kui s ALA 479 N -1.15 2.93 0.14 1.44 0.00 -1.26 -1.22 121.76 122.64 2kui s ALA 479 Ca -0.09 0.00 0.34 0.00 0.00 0.00 0.00 51.96 52.21 2kui s ALA 479 Cb -0.08 -3.12 1.61 0.00 0.00 0.00 0.00 23.12 21.53 2kui s ALA 479 CO -0.00 -0.87 2.02 0.82 0.00 0.00 0.00 175.76 177.73 2kui h ILE 480 N -0.38 0.00 -0.06 0.00 5.03 -1.89 -0.64 117.51 119.56 2kui h ILE 480 Ca -0.44 -0.23 0.00 0.00 -0.12 0.00 0.00 64.86 64.06 2kui h ILE 480 Cb 1.20 1.12 0.00 0.00 -3.03 0.00 0.00 36.82 36.11 2kui h ILE 480 CO 0.60 0.00 0.00 1.07 -0.68 0.00 0.00 178.15 179.14 2kui n THR 481 N -2.83 0.07 -3.53 -0.27 5.66 -1.26 -4.18 114.28 107.94 2kui n THR 481 Ca -0.01 -0.22 -0.32 0.00 -3.05 0.00 0.00 64.05 60.45 2kui n THR 481 Cb 0.18 0.22 -0.05 0.00 -1.55 0.00 0.00 70.33 69.13 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 -1.81 6.59 -0.19 1.09 -0.87 -0.25 -5.07 114.94 114.43 2kui s ASN 482 Ca 0.36 0.79 -0.05 0.00 -1.57 0.00 0.00 52.86 52.40 2kui s ASN 482 Cb 0.19 -2.17 -0.03 0.00 -0.02 0.00 0.00 41.25 39.22 2kui s ASN 482 CO 0.30 0.02 -0.01 0.54 -2.57 0.00 0.00 177.10 175.38 2kui s VAL 483 N -1.67 3.95 -0.14 1.60 0.11 -1.26 -4.54 120.40 118.45 2kui s VAL 483 Ca 0.42 -0.32 -0.05 0.00 -2.93 0.00 0.00 61.98 59.10 2kui s VAL 483 Cb -0.12 -2.77 -0.04 0.00 -1.53 0.00 0.00 36.38 31.92 2kui s VAL 483 CO 0.22 0.45 0.03 0.68 -3.33 0.00 0.00 175.10 173.15 2kui s VAL 484 N 0.79 4.55 -0.23 2.04 -7.23 0.36 -4.97 120.40 115.71 2kui s VAL 484 Ca -0.00 -0.14 -0.17 0.00 -1.81 0.00 0.00 61.98 59.86 2kui s VAL 484 Cb -0.14 -2.99 -0.03 0.00 0.56 0.00 0.00 36.38 33.78 2kui s VAL 484 CO 0.02 0.53 0.48 -0.51 -0.31 0.00 0.00 175.10 175.31 2kui s ILE 485 N -0.19 5.12 -0.37 -0.62 -1.16 -1.26 -1.37 121.20 121.35 2kui s ILE 485 Ca 0.06 0.84 -0.15 0.00 -0.51 0.00 0.00 60.65 60.89 2kui s ILE 485 Cb -0.12 -3.80 0.00 0.00 0.61 0.00 0.00 42.46 39.15 2kui s ILE 485 CO 0.02 0.16 0.35 -0.63 -2.81 0.00 0.00 174.94 172.03 2kui s ILE 486 N 1.83 5.18 -0.22 2.00 -1.09 0.15 -3.19 121.20 125.86 2kui s ILE 486 Ca 0.21 -0.21 -0.11 0.00 -2.23 0.00 0.00 60.65 58.31 2kui s ILE 486 Cb -0.15 -3.88 -0.05 0.00 -1.58 0.00 0.00 42.46 36.80 2kui s ILE 486 CO 0.09 -0.20 0.19 -0.51 -1.23 0.00 0.00 174.94 173.28 2kui s ILE 487 N 1.95 5.35 0.13 2.92 2.07 -0.66 -0.11 121.20 132.84 2kui s ILE 487 Ca 0.10 0.27 0.07 0.00 -1.41 0.00 0.00 60.65 59.67 2kui s ILE 487 Cb -0.17 -3.53 -0.04 0.00 0.13 0.00 0.00 42.46 38.85 2kui s ILE 487 CO 0.12 0.35 -0.04 0.68 -1.91 0.00 0.00 174.94 174.14 2kui s VAL 488 N 0.93 3.64 0.09 4.00 -7.23 0.12 0.05 120.40 122.00 2kui s VAL 488 Ca 0.10 -1.28 -0.30 0.00 -1.81 0.00 0.00 61.98 58.68 2kui s VAL 488 Cb -0.13 -2.77 -0.06 0.00 0.56 0.00 0.00 36.38 33.99 2kui s VAL 488 CO 0.04 0.02 1.06 -0.83 -0.31 0.00 0.00 175.10 175.08 2kui s GLY 489 N -2.54 2.79 0.26 2.32 0.00 0.54 -1.80 107.32 108.90 2kui s GLY 489 Ca 0.25 0.70 0.10 0.00 0.00 0.00 0.00 44.72 45.77 2kui s GLY 489 CO 0.17 1.71 -0.16 -0.45 0.00 0.00 0.00 173.10 174.37 2kui s SER 490 N 0.48 3.20 0.00 1.64 0.15 0.46 -1.10 113.70 118.52 2kui s SER 490 Ca 0.52 -1.05 0.00 0.00 0.70 0.00 0.00 55.95 56.12 2kui s SER 490 Cb -0.26 -0.24 0.00 0.00 -1.71 0.00 0.00 66.02 63.81 2kui s SER 490 CO 0.31 -0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.28 2kui n GLY 491 N -0.55 2.04 3.84 9.45 0.00 -1.26 0.37 105.19 119.07 2kui n GLY 491 Ca -0.06 0.23 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 0.00 4.10 -1.11 1.61 0.04 -1.26 -4.95 135.00 133.43 2kui s PRO 492 Ca 0.00 0.83 -0.22 0.00 0.04 0.00 0.00 61.00 61.65 2kui s PRO 492 Cb 0.00 -2.40 -0.00 0.00 0.04 0.00 0.00 34.50 32.14 2kui s PRO 492 CO 0.00 0.12 1.76 0.00 0.04 0.00 0.00 177.00 178.93 2kui s ALA 493 N -2.00 2.41 0.04 8.56 0.00 -1.26 -4.89 121.76 124.62 2kui s ALA 493 Ca 0.55 -2.24 0.08 0.00 0.00 0.00 0.00 51.96 50.35 2kui s ALA 493 Cb -0.11 -4.61 -0.03 0.00 0.00 0.00 0.00 23.12 18.38 2kui s ALA 493 CO 0.17 -4.21 -0.23 0.95 0.00 0.00 0.00 175.76 172.44 2kui s THR 494 N 7.44 1.88 0.02 0.00 -4.23 -1.26 -0.94 115.64 118.54 2kui s THR 494 Ca 0.59 -1.26 0.00 0.00 -1.18 0.00 0.00 61.69 59.84 2kui s THR 494 Cb -0.01 -1.62 -0.02 0.00 1.34 0.00 0.00 72.50 72.20 2kui s THR 494 CO 0.03 0.30 -0.03 -0.54 -0.54 0.00 0.00 174.62 173.83 2kui s LYS 495 N -1.16 0.30 0.01 3.99 -0.14 0.53 -4.89 119.74 118.38 2kui s LYS 495 Ca 0.09 -0.58 -0.18 0.00 -1.36 0.00 0.00 55.97 53.94 2kui s LYS 495 Cb -0.09 0.10 -0.06 0.00 -1.68 0.00 0.00 37.83 36.10 2kui s LYS 495 CO 0.02 -0.05 0.52 0.16 -0.76 0.00 0.00 175.35 175.24 2kui s ASP 496 N -1.39 6.92 -0.43 2.83 -4.77 -1.26 -0.54 116.67 118.03 2kui s ASP 496 Ca -0.15 1.09 -0.21 0.00 -3.30 0.00 0.00 52.55 49.98 2kui s ASP 496 Cb -0.09 -2.32 0.02 0.00 -1.09 0.00 0.00 42.92 39.44 2kui s ASP 496 CO -0.01 0.21 0.67 0.27 0.70 0.00 0.00 175.17 177.01 2kui s ILE 497 N -0.63 4.79 0.24 2.11 -4.36 -0.53 -4.97 121.20 117.85 2kui s ILE 497 Ca 0.28 0.22 -0.09 0.00 -0.26 0.00 0.00 60.65 60.79 2kui s ILE 497 Cb -0.18 -4.22 -0.07 0.00 1.25 0.00 0.00 42.46 39.24 2kui s ILE 497 CO 0.16 -0.60 0.56 -2.16 0.24 0.00 0.00 174.94 173.14 2kui s PRO 498 N 2.91 3.80 -0.96 0.37 0.04 -1.26 -0.01 135.00 139.88 2kui s PRO 498 Ca 0.24 0.27 -0.24 0.00 0.04 0.00 0.00 61.00 61.32 2kui s PRO 498 Cb -0.14 -2.64 0.04 0.00 0.04 0.00 0.00 34.50 31.80 2kui s PRO 498 CO 0.19 0.30 1.48 0.16 0.04 0.00 0.00 177.00 179.17 2kui s ASP 499 N -2.43 6.31 0.00 6.66 -4.77 -1.26 -4.61 116.67 116.57 2kui s ASP 499 Ca 0.47 -1.22 0.19 0.00 -3.30 0.00 0.00 52.55 48.69 2kui s ASP 499 Cb -0.11 -2.57 0.26 0.00 -1.09 0.00 0.00 42.92 39.41 2kui s ASP 499 CO 0.22 -1.68 1.19 0.52 0.70 0.00 0.00 175.17 176.12 2kui n VAL 500 N 6.92 0.29 -1.50 2.11 0.31 -1.26 -4.99 118.33 120.21 2kui n VAL 500 Ca 0.29 -0.65 -0.46 0.00 -0.01 0.00 0.00 64.34 63.52 2kui n VAL 500 Cb 0.50 1.13 -0.06 0.00 -0.91 0.00 0.00 33.84 34.51 2kui n VAL 500 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2kui n ALA 501 N 1.10 1.14 0.00 3.52 0.00 -1.26 -4.50 120.51 120.51 2kui n ALA 501 Ca 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2kui n ALA 501 Cb 0.49 -2.73 0.00 0.00 0.00 0.00 0.00 19.45 17.21 2kui n ALA 501 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 502 N 6.28 0.00 0.29 0.00 0.00 -1.19 -4.86 105.19 105.71 2kui n GLY 502 Ca 0.40 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.40 2kui n GLY 502 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kui n GLN 503 N 0.00 0.05 -2.46 1.61 0.00 -1.26 -4.92 117.38 110.40 2kui n GLN 503 Ca 0.00 -0.27 -0.30 0.00 0.00 0.00 0.00 57.00 56.43 2kui n GLN 503 Cb 0.00 0.24 -0.01 0.00 0.00 0.00 0.00 30.24 30.47 2kui n GLN 503 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.06 176.98 2kui s THR 504 N -2.28 4.78 0.30 -0.39 -1.32 -1.26 -0.37 115.64 115.10 2kui s THR 504 Ca 0.03 0.62 0.05 0.00 -1.21 0.00 0.00 61.69 61.18 2kui s THR 504 Cb 0.00 -3.81 0.29 0.00 -1.51 0.00 0.00 72.50 67.47 2kui s THR 504 CO 0.02 -0.82 1.72 1.62 -2.21 0.00 0.00 174.62 174.94 2kui h VAL 505 N 0.40 0.53 -0.77 5.08 3.04 -1.71 -0.02 116.25 122.78 2kui h VAL 505 Ca -0.46 -0.17 -0.01 0.00 -1.01 0.00 0.00 66.70 65.05 2kui h VAL 505 Cb 1.19 -0.01 -0.04 0.00 -2.01 0.00 0.00 31.29 30.43 2kui h VAL 505 CO 0.62 0.09 0.43 -0.78 -1.01 0.00 0.00 177.57 176.92 2kui h ASP 506 N 0.49 0.96 0.01 3.17 3.58 -1.92 0.64 116.42 123.35 2kui h ASP 506 Ca 0.58 -0.09 -0.25 0.00 0.42 0.00 0.00 57.03 57.68 2kui h ASP 506 Cb 1.06 -0.24 0.02 0.00 1.72 0.00 0.00 39.33 41.89 2kui h ASP 506 CO -0.49 0.78 -0.98 0.58 -2.88 0.00 0.00 179.24 176.25 2kui h VAL 507 N 1.07 1.30 -0.25 2.25 2.07 -1.44 -1.60 116.25 119.65 2kui h VAL 507 Ca 0.27 -2.23 -0.02 0.00 0.82 0.00 0.00 66.70 65.55 2kui h VAL 507 Cb 0.03 2.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 2kui h VAL 507 CO -0.04 0.68 0.10 0.00 0.02 0.00 0.00 177.57 178.32 2kui h ALA 508 N 0.38 0.32 -0.50 1.67 0.00 -0.96 -1.78 119.26 118.39 2kui h ALA 508 Ca -0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2kui h ALA 508 Cb 1.65 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.31 2kui h ALA 508 CO 0.19 -0.08 0.22 0.37 0.00 0.00 0.00 179.25 179.96 2kui h GLN 509 N 0.25 0.71 -0.67 0.00 4.15 -0.89 -1.03 115.11 117.63 2kui h GLN 509 Ca 0.08 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.41 2kui h GLN 509 Cb 0.19 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.71 2kui h GLN 509 CO -0.01 0.57 0.42 -0.22 -1.93 0.00 0.00 178.83 177.67 2kui h LYS 510 N 0.71 0.91 -0.23 1.69 3.11 -0.88 0.54 116.57 122.41 2kui h LYS 510 Ca 0.18 -0.07 -0.01 0.00 -2.81 0.00 0.00 60.65 57.93 2kui h LYS 510 Cb 0.11 -0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 31.14 2kui h LYS 510 CO -0.02 0.63 0.11 -0.91 -2.81 0.00 0.00 179.45 176.44 2kui h ASN 511 N 0.92 0.30 -0.89 4.20 2.35 -0.34 -0.34 115.58 121.78 2kui h ASN 511 Ca 0.24 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 2kui h ASN 511 Cb -0.06 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.19 2kui h ASN 511 CO -0.05 0.35 0.47 -0.07 -1.65 0.00 0.00 177.43 176.48 2kui h LEU 512 N 0.23 1.12 -1.03 1.61 -0.00 -1.07 -1.65 115.31 114.53 2kui h LEU 512 Ca 0.08 -0.11 -0.03 0.00 -0.00 0.00 0.00 57.88 57.82 2kui h LEU 512 Cb 0.13 -0.29 -0.03 0.00 -0.00 0.00 0.00 40.66 40.47 2kui h LEU 512 CO -0.01 0.92 0.32 0.78 -0.00 0.00 0.00 178.44 180.45 2kui h ASN 513 N 1.25 0.92 0.19 -0.43 -0.26 -0.57 -0.29 115.58 116.39 2kui h ASN 513 Ca 0.31 -0.11 -0.07 0.00 -0.56 0.00 0.00 56.30 55.87 2kui h ASN 513 Cb 0.06 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.07 2kui h ASN 513 CO -0.05 0.79 -0.26 0.58 -1.06 0.00 0.00 177.43 177.43 2kui h VAL 514 N 1.00 1.22 0.00 2.81 2.07 -0.41 -1.69 116.25 121.26 2kui h VAL 514 Ca 0.24 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.72 2kui h VAL 514 Cb 0.13 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 2kui h VAL 514 CO -0.03 0.31 0.00 -1.22 0.02 0.00 0.00 177.57 176.65 2kui n TYR 515 N -4.18 0.00 0.00 1.57 4.01 -0.48 -4.87 117.16 113.21 2kui n TYR 515 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 2kui n TYR 515 Cb 0.34 -0.43 0.00 0.00 -0.31 0.00 0.00 39.34 38.94 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 1.21 0.64 3.53 2.72 0.00 -0.64 -4.88 105.19 107.77 2kui n GLY 516 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.00 2.45 -2.19 1.61 0.08 -0.24 -4.60 117.98 113.09 2kui s PHE 517 Ca 0.00 -0.06 0.23 0.00 0.12 0.00 0.00 56.93 57.21 2kui s PHE 517 Cb 0.00 -4.50 0.02 0.00 -0.57 0.00 0.00 43.02 37.97 2kui s PHE 517 CO 0.00 -1.85 1.11 2.41 -0.10 0.00 0.00 175.22 176.79 2kui n THR 518 N 6.33 0.00 -3.99 0.64 -1.04 -1.23 -3.57 114.28 111.42 2kui n THR 518 Ca 0.03 -0.30 -0.34 0.00 -2.04 0.00 0.00 64.05 61.40 2kui n THR 518 Cb 0.48 1.30 -0.15 0.00 -1.82 0.00 0.00 70.33 70.14 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 -2.41 2.70 0.08 -2.82 1.02 -1.26 -5.09 119.74 111.97 2kui s LYS 519 Ca 0.20 -1.06 0.04 0.00 0.02 0.00 0.00 55.97 55.17 2kui s LYS 519 Cb 0.18 -2.94 -0.03 0.00 -0.52 0.00 0.00 37.83 34.52 2kui s LYS 519 CO 0.53 -0.43 -0.12 -0.59 -0.92 0.00 0.00 175.35 173.82 2kui s PHE 520 N 1.27 1.10 -0.03 3.18 -0.12 -1.26 -1.51 117.98 120.61 2kui s PHE 520 Ca -0.02 -0.54 -0.01 0.00 -0.05 0.00 0.00 56.93 56.32 2kui s PHE 520 Cb -0.17 -0.61 0.02 0.00 -0.63 0.00 0.00 43.02 41.63 2kui s PHE 520 CO -0.05 0.02 0.05 -1.12 -0.05 0.00 0.00 175.22 174.08 2kui s SER 521 N -2.00 -0.01 -0.04 1.98 0.01 -0.52 -4.92 113.70 108.21 2kui s SER 521 Ca 0.00 0.10 0.07 0.00 1.31 0.00 0.00 55.95 57.43 2kui s SER 521 Cb -0.07 0.04 -0.02 0.00 0.21 0.00 0.00 66.02 66.17 2kui s SER 521 CO 0.01 -0.08 -0.23 0.00 0.41 0.00 0.00 173.24 173.34 2kui s GLN 522 N 0.66 2.30 0.02 12.44 0.00 -1.26 0.15 119.66 133.96 2kui s GLN 522 Ca -0.05 -0.88 0.04 0.00 -0.00 0.00 0.00 55.36 54.47 2kui s GLN 522 Cb -0.07 -2.14 -0.02 0.00 0.00 0.00 0.00 33.01 30.78 2kui s GLN 522 CO -0.02 0.53 -0.11 0.00 0.00 0.00 0.00 175.29 175.68 2kui s ALA 523 N -0.52 0.95 -0.08 2.60 0.00 -0.10 -4.96 121.76 119.66 2kui s ALA 523 Ca 0.07 -0.63 0.05 0.00 0.00 0.00 0.00 51.96 51.44 2kui s ALA 523 Cb -0.11 -0.17 -0.00 0.00 0.00 0.00 0.00 23.12 22.84 2kui s ALA 523 CO 0.00 0.19 -0.23 0.45 0.00 0.00 0.00 175.76 176.17 2kui s SER 524 N -0.76 2.89 0.10 0.00 0.15 -1.26 -0.21 113.70 114.61 2kui s SER 524 Ca 0.01 -0.50 0.08 0.00 0.70 0.00 0.00 55.95 56.24 2kui s SER 524 Cb -0.06 -1.06 -0.03 0.00 -1.71 0.00 0.00 66.02 63.15 2kui s SER 524 CO 0.00 0.18 -0.21 -0.69 1.20 0.00 0.00 173.24 173.73 2kui s VAL 525 N 0.14 1.73 0.23 4.45 1.01 -0.94 -4.90 120.40 122.11 2kui s VAL 525 Ca -0.11 -1.52 -0.30 0.00 0.00 0.00 0.00 61.98 60.05 2kui s VAL 525 Cb -0.16 -1.56 -0.10 0.00 0.00 0.00 0.00 36.38 34.57 2kui s VAL 525 CO 0.06 -0.03 1.40 1.51 0.00 0.00 0.00 175.10 178.04 2kui s ASP 526 N -1.85 6.72 0.21 3.32 -4.77 -1.26 -1.04 116.67 118.01 2kui s ASP 526 Ca 0.07 2.59 -0.15 0.00 -3.30 0.00 0.00 52.55 51.76 2kui s ASP 526 Cb -0.10 -2.62 0.01 0.00 -1.09 0.00 0.00 42.92 39.12 2kui s ASP 526 CO 0.04 -0.65 0.48 -0.44 0.70 0.00 0.00 175.17 175.30 2kui s SER 527 N 0.38 -0.14 0.49 2.11 0.01 0.86 -4.83 113.70 112.57 2kui s SER 527 Ca 0.59 -0.72 0.25 0.00 1.31 0.00 0.00 55.95 57.38 2kui s SER 527 Cb -0.40 0.57 1.25 0.00 0.21 0.00 0.00 66.02 67.65 2kui s SER 527 CO 0.41 -1.08 1.99 1.55 0.41 0.00 0.00 173.24 176.52 2kui h PRO 528 N 2.27 0.00 -6.87 12.44 0.13 -1.82 -3.38 132.00 134.77 2kui h PRO 528 Ca -0.27 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.36 2kui h PRO 528 Cb 1.25 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.40 2kui h PRO 528 CO 0.37 0.17 0.46 1.03 -0.23 0.00 0.00 178.00 179.81 2kui s ARG 529 N -4.04 4.43 0.69 0.86 3.00 -1.26 -4.90 118.95 117.73 2kui s ARG 529 Ca -0.02 1.73 -0.17 0.00 0.00 0.00 0.00 55.73 57.28 2kui s ARG 529 Cb 0.12 -2.94 0.01 0.00 0.00 0.00 0.00 34.95 32.14 2kui s ARG 529 CO 0.61 0.04 1.17 -0.35 0.00 0.00 0.00 175.30 176.77 2kui n PRO 530 N 0.69 0.78 -1.78 3.54 -0.04 -1.26 -2.78 135.00 134.14 2kui n PRO 530 Ca 0.01 0.33 -0.42 0.00 -0.04 0.00 0.00 63.50 63.38 2kui n PRO 530 Cb 0.46 -2.41 -0.03 0.00 -0.04 0.00 0.00 33.50 31.49 2kui n PRO 530 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kui s ALA 531 N -1.63 3.57 0.00 0.55 0.00 -1.24 -2.01 121.76 120.99 2kui s ALA 531 Ca 0.78 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.92 2kui s ALA 531 Cb -0.36 -3.82 0.00 0.00 0.00 0.00 0.00 23.12 18.94 2kui s ALA 531 CO 0.45 -1.56 0.00 0.41 0.00 0.00 0.00 175.76 175.06 2kui n GLY 532 N 4.45 1.97 3.70 0.00 0.00 -0.50 -4.88 105.19 109.93 2kui n GLY 532 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2kui n GLY 532 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kui s GLU 533 N -0.07 4.49 -0.11 1.61 2.12 -0.85 -1.79 118.70 124.09 2kui s GLU 533 Ca 0.00 1.40 -0.30 0.00 0.36 0.00 0.00 54.97 56.43 2kui s GLU 533 Cb 0.00 -3.50 -0.02 0.00 0.26 0.00 0.00 34.13 30.87 2kui s GLU 533 CO 0.00 -0.19 1.20 0.08 -0.54 0.00 0.00 175.26 175.81 2kui s VAL 534 N 1.53 4.33 -0.63 3.70 1.01 0.51 -0.15 120.40 130.70 2kui s VAL 534 Ca 0.50 1.63 0.24 0.00 0.00 0.00 0.00 61.98 64.35 2kui s VAL 534 Cb -0.20 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.14 2kui s VAL 534 CO 0.23 -0.06 1.23 1.07 0.00 0.00 0.00 175.10 177.56 2kui n THR 535 N 4.94 0.30 -2.10 3.92 5.66 -0.63 -3.18 114.28 123.19 2kui n THR 535 Ca 0.12 -0.27 0.00 0.00 -3.05 0.00 0.00 64.05 60.85 2kui n THR 535 Cb 0.46 -0.03 0.00 0.00 -1.55 0.00 0.00 70.33 69.20 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 1.34 -0.00 3.28 1.09 0.00 -1.17 -4.93 105.19 104.80 2kui n GLY 536 Ca 0.03 -1.32 -0.18 0.00 0.00 0.00 0.00 46.02 44.55 2kui n GLY 536 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 537 N -3.20 1.44 -0.03 2.61 -4.23 -1.26 -1.06 115.64 109.91 2kui s THR 537 Ca 0.00 -1.91 -0.26 0.00 -1.18 0.00 0.00 61.69 58.34 2kui s THR 537 Cb 0.00 -1.73 -0.20 0.00 1.34 0.00 0.00 72.50 71.90 2kui s THR 537 CO 0.00 -0.50 1.21 -1.13 -0.54 0.00 0.00 174.62 173.66 2kui h ASN 538 N 3.15 -0.02 -3.38 3.99 -1.24 -1.41 -3.42 115.58 113.24 2kui h ASN 538 Ca -0.39 -0.50 -0.53 0.00 0.71 0.00 0.00 56.30 55.59 2kui h ASN 538 Cb 1.20 0.01 0.07 0.00 0.73 0.00 0.00 38.32 40.33 2kui h ASN 538 CO 0.55 0.50 0.81 -2.16 -1.29 0.00 0.00 177.43 175.85 2kui s PRO 539 N -4.09 4.20 0.39 6.67 0.04 -1.26 -4.94 135.00 136.02 2kui s PRO 539 Ca -0.16 2.43 -0.27 0.00 0.04 0.00 0.00 61.00 63.04 2kui s PRO 539 Cb 0.01 -3.07 -0.10 0.00 0.04 0.00 0.00 34.50 31.38 2kui s PRO 539 CO 0.66 -0.51 1.46 -2.30 0.04 0.00 0.00 177.00 176.35 2kui n PRO 540 N 2.18 2.53 -2.13 0.56 -0.02 -1.26 -4.94 135.00 131.91 2kui n PRO 540 Ca 0.07 0.89 -0.41 0.00 -2.02 0.00 0.00 63.50 62.03 2kui n PRO 540 Cb 0.39 -2.63 -0.03 0.00 -0.02 0.00 0.00 33.50 31.21 2kui n PRO 540 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kui s ALA 541 N -1.14 3.57 0.00 3.55 0.00 -1.26 -2.26 121.76 124.22 2kui s ALA 541 Ca 0.55 1.20 0.00 0.00 0.00 0.00 0.00 51.96 53.71 2kui s ALA 541 Cb -0.48 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.13 2kui s ALA 541 CO 0.62 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 176.17 2kui n GLY 542 N 2.30 0.38 3.72 0.00 0.00 0.99 -4.94 105.19 107.64 2kui n GLY 542 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.96 -4.79 115.64 117.09 2kui s THR 543 Ca 0.00 1.92 -0.20 0.00 0.31 0.00 0.00 61.69 63.72 2kui s THR 543 Cb 0.00 -4.25 -0.03 0.00 0.01 0.00 0.00 72.50 68.23 2kui s THR 543 CO 0.00 0.23 0.58 -0.89 -0.69 0.00 0.00 174.62 173.86 2kui s THR 544 N 0.62 5.05 0.10 -0.82 2.01 -1.26 -1.46 115.64 119.87 2kui s THR 544 Ca 0.47 1.08 0.02 0.00 0.31 0.00 0.00 61.69 63.57 2kui s THR 544 Cb -0.21 -3.90 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 2kui s THR 544 CO 0.26 0.12 -0.08 0.68 -0.69 0.00 0.00 174.62 174.91 2kui s VAL 545 N 1.94 0.77 0.33 3.82 -7.23 0.30 -4.90 120.40 115.42 2kui s VAL 545 Ca 0.26 -1.77 -0.29 0.00 -1.81 0.00 0.00 61.98 58.37 2kui s VAL 545 Cb -0.16 -1.49 -0.10 0.00 0.56 0.00 0.00 36.38 35.19 2kui s VAL 545 CO 0.10 -0.73 1.29 -2.84 -0.31 0.00 0.00 175.10 172.60 2kui s PRO 546 N -3.31 4.38 0.60 4.82 0.02 -1.26 -0.34 135.00 139.91 2kui s PRO 546 Ca 0.08 2.18 0.38 0.00 0.02 0.00 0.00 61.00 63.66 2kui s PRO 546 Cb 0.01 -3.08 1.83 0.00 0.02 0.00 0.00 34.50 33.28 2kui s PRO 546 CO -0.03 -0.15 2.15 -0.39 -0.33 0.00 0.00 177.00 178.26 2kui h VAL 547 N 3.05 0.00 0.00 3.83 -1.51 -1.33 -1.30 116.25 118.99 2kui h VAL 547 Ca -0.49 -0.30 0.00 0.00 -1.23 0.00 0.00 66.70 64.69 2kui h VAL 547 Cb 1.22 1.29 0.00 0.00 -2.13 0.00 0.00 31.29 31.68 2kui h VAL 547 CO 0.66 0.00 0.00 -0.67 -1.23 0.00 0.00 177.57 176.33 2kui n ASP 548 N -3.09 0.01 -4.95 4.19 2.03 -1.26 -3.53 116.55 109.95 2kui n ASP 548 Ca -0.01 0.50 -0.20 0.00 0.52 0.00 0.00 54.79 55.60 2kui n ASP 548 Cb 0.21 -0.50 0.04 0.00 -0.72 0.00 0.00 41.12 40.15 2kui n ASP 548 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2kui s SER 549 N -3.02 5.21 -0.19 1.67 1.04 -0.49 -4.90 113.70 113.02 2kui s SER 549 Ca 0.13 -0.37 -0.08 0.00 0.48 0.00 0.00 55.95 56.11 2kui s SER 549 Cb 0.18 -0.43 -0.04 0.00 0.10 0.00 0.00 66.02 65.82 2kui s SER 549 CO 0.50 -1.18 0.08 0.54 0.98 0.00 0.00 173.24 174.16 2kui s VAL 550 N -2.68 4.96 0.02 5.02 0.11 -1.26 -4.12 120.40 122.45 2kui s VAL 550 Ca 0.59 0.03 0.01 0.00 -2.93 0.00 0.00 61.98 59.68 2kui s VAL 550 Cb -0.08 -3.25 -0.04 0.00 -1.53 0.00 0.00 36.38 31.48 2kui s VAL 550 CO 0.38 0.45 0.04 0.27 -3.33 0.00 0.00 175.10 172.91 2kui s ILE 551 N 0.40 4.40 -0.28 7.04 -0.00 -0.57 -4.96 121.20 127.23 2kui s ILE 551 Ca 0.05 -0.58 -0.07 0.00 -0.00 0.00 0.00 60.65 60.04 2kui s ILE 551 Cb -0.12 -3.02 -0.00 0.00 -0.00 0.00 0.00 42.46 39.32 2kui s ILE 551 CO -0.00 0.31 0.08 -0.70 -0.00 0.00 0.00 174.94 174.63 2kui s GLU 552 N -1.80 3.24 -0.09 0.37 2.12 -1.26 -1.43 118.70 119.86 2kui s GLU 552 Ca 0.23 -0.76 -0.15 0.00 0.36 0.00 0.00 54.97 54.65 2kui s GLU 552 Cb -0.12 -3.37 -0.05 0.00 0.26 0.00 0.00 34.13 30.86 2kui s GLU 552 CO 0.14 -0.38 0.38 -0.51 -0.54 0.00 0.00 175.26 174.35 2kui s LEU 553 N 1.53 4.34 -0.22 2.70 1.43 0.12 -1.01 118.68 127.58 2kui s LEU 553 Ca 0.04 0.76 -0.03 0.00 -1.03 0.00 0.00 54.13 53.87 2kui s LEU 553 Cb -0.17 -2.53 0.00 0.00 0.03 0.00 0.00 46.19 43.53 2kui s LEU 553 CO 0.03 0.17 -0.07 0.00 0.23 0.00 0.00 176.35 176.71 2kui s GLN 554 N -0.13 3.19 -0.12 1.70 -2.07 -0.23 -0.92 119.66 121.09 2kui s GLN 554 Ca 0.22 -0.74 -0.06 0.00 -1.82 0.00 0.00 55.36 52.96 2kui s GLN 554 Cb -0.15 -2.94 -0.04 0.00 -1.09 0.00 0.00 33.01 28.79 2kui s GLN 554 CO 0.09 -0.25 0.11 0.08 -1.32 0.00 0.00 175.29 174.01 2kui s VAL 555 N 1.42 5.29 0.12 3.63 1.01 0.70 -1.61 120.40 130.96 2kui s VAL 555 Ca 0.04 0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.85 2kui s VAL 555 Cb -0.15 -3.29 -0.06 0.00 0.00 0.00 0.00 36.38 32.88 2kui s VAL 555 CO -0.05 0.61 0.99 -0.44 0.00 0.00 0.00 175.10 176.22 2kui s SER 556 N -0.97 7.44 -0.22 3.32 0.01 0.79 -2.22 113.70 121.85 2kui s SER 556 Ca 0.14 1.85 -0.09 0.00 1.31 0.00 0.00 55.95 59.16 2kui s SER 556 Cb -0.12 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.48 2kui s SER 556 CO 0.04 -0.11 0.12 -0.75 0.41 0.00 0.00 173.24 172.95 2kui s LYS 557 N -0.02 4.00 0.03 12.44 2.47 -0.21 -1.40 119.74 137.06 2kui s LYS 557 Ca 0.48 -0.31 -0.20 0.00 -1.56 0.00 0.00 55.97 54.38 2kui s LYS 557 Cb -0.25 -3.42 -0.16 0.00 -1.46 0.00 0.00 37.83 32.55 2kui s LYS 557 CO 0.31 0.10 1.28 0.78 0.16 0.00 0.00 175.35 177.98 2kui h GLY 558 N 7.32 0.45 -1.75 5.54 0.00 -1.69 0.24 103.07 113.19 2kui h GLY 558 Ca -0.38 -0.55 -0.36 0.00 0.00 0.00 0.00 47.33 46.04 2kui h GLY 558 CO 0.67 0.49 -0.40 -2.01 0.00 0.00 0.00 176.54 175.28 2kui n ASN 559 N -4.43 -5.21 -4.26 0.19 5.15 -1.26 -4.51 115.26 100.92 2kui n ASN 559 Ca -0.07 0.21 -0.17 0.00 -0.60 0.00 0.00 54.58 53.95 2kui n ASN 559 Cb 0.46 -4.29 -0.11 0.00 -0.53 0.00 0.00 39.78 35.31 2kui n ASN 559 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2kui s GLN 560 N -4.24 1.09 0.02 1.20 -0.21 -1.26 -2.74 119.66 113.52 2kui s GLN 560 Ca 0.00 -1.36 0.05 0.00 0.02 0.00 0.00 55.36 54.07 2kui s GLN 560 Cb 0.00 -0.88 -0.02 0.00 1.00 0.00 0.00 33.01 33.11 2kui s GLN 560 CO 0.00 0.15 -0.14 -0.59 -2.12 0.00 0.00 175.29 172.60 2kui s PHE 561 N -2.59 1.20 0.07 0.91 -0.71 -0.10 -4.85 117.98 111.91 2kui s PHE 561 Ca 0.13 -0.32 -0.31 0.00 -1.04 0.00 0.00 56.93 55.40 2kui s PHE 561 Cb -0.02 -0.73 -0.08 0.00 -1.21 0.00 0.00 43.02 40.98 2kui s PHE 561 CO 0.03 0.02 1.58 0.08 -1.34 0.00 0.00 175.22 175.58 2kui s VAL 562 N -0.70 3.14 -0.12 -2.49 1.01 -1.26 -0.08 120.40 119.90 2kui s VAL 562 Ca 0.02 0.63 -0.18 0.00 0.00 0.00 0.00 61.98 62.46 2kui s VAL 562 Cb -0.07 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 2kui s VAL 562 CO 0.01 0.01 0.47 -0.32 0.00 0.00 0.00 175.10 175.26 2kui s MET 563 N 2.31 4.34 0.97 2.72 1.75 0.19 -4.89 119.30 126.69 2kui s MET 563 Ca 0.71 0.43 -0.12 0.00 -1.25 0.00 0.00 55.69 55.45 2kui s MET 563 Cb -0.38 -3.44 0.17 0.00 2.84 0.00 0.00 34.83 34.02 2kui s MET 563 CO 0.31 0.16 1.11 -2.14 -0.65 0.00 0.00 175.02 173.81 2kui s PRO 564 N 0.61 0.65 0.38 4.11 0.02 -1.26 -1.24 135.00 138.27 2kui s PRO 564 Ca 0.25 0.41 -0.27 0.00 0.02 0.00 0.00 61.00 61.42 2kui s PRO 564 Cb -0.15 -1.77 -0.09 0.00 0.02 0.00 0.00 34.50 32.51 2kui s PRO 564 CO 0.10 -2.55 1.25 0.34 -0.33 0.00 0.00 177.00 175.81 2kui s ASP 565 N -3.68 6.55 -0.04 2.53 2.15 -1.26 -4.78 116.67 118.13 2kui s ASP 565 Ca 0.65 2.55 0.06 0.00 0.43 0.00 0.00 52.55 56.24 2kui s ASP 565 Cb -0.17 -2.63 0.10 0.00 -0.30 0.00 0.00 42.92 39.91 2kui s ASP 565 CO 0.56 -0.67 0.97 0.00 -0.17 0.00 0.00 175.17 175.86 2kui n LEU 566 N 0.36 1.10 -4.72 -1.34 -0.00 -1.26 -5.06 117.00 106.08 2kui n LEU 566 Ca 0.03 -1.71 -0.42 0.00 -0.00 0.00 0.00 56.01 53.91 2kui n LEU 566 Cb 0.44 -0.15 -0.03 0.00 -0.00 0.00 0.00 43.42 43.68 2kui n LEU 566 CO 0.55 0.41 1.22 -0.44 -0.00 0.00 0.00 177.39 179.12 2kui s SER 567 N -1.48 6.59 0.00 1.45 0.01 -1.26 -3.08 113.70 115.93 2kui s SER 567 Ca 0.11 2.63 0.00 0.00 1.31 0.00 0.00 55.95 59.99 2kui s SER 567 Cb 0.10 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2kui s SER 567 CO 0.01 -0.81 0.00 0.61 0.41 0.00 0.00 173.24 173.46 2kui n GLY 568 N 3.58 1.43 3.63 3.44 0.00 -1.26 -5.09 105.19 110.92 2kui n GLY 568 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.42 2.65 -0.11 1.61 1.00 -1.18 -4.99 119.30 117.87 2kui s MET 569 Ca 0.00 -0.68 -0.06 0.00 0.00 0.00 0.00 55.69 54.96 2kui s MET 569 Cb 0.00 -2.58 -0.04 0.00 0.00 0.00 0.00 34.83 32.22 2kui s MET 569 CO 0.00 0.61 0.11 -0.06 0.00 0.00 0.00 175.02 175.68 2kui s PHE 570 N -1.04 3.51 0.54 -0.03 0.40 -1.26 -1.65 117.98 118.45 2kui s PHE 570 Ca 0.18 0.46 0.22 0.00 -0.60 0.00 0.00 56.93 57.20 2kui s PHE 570 Cb -0.11 -1.91 1.43 0.00 0.51 0.00 0.00 43.02 42.94 2kui s PHE 570 CO 0.09 0.69 2.11 2.35 0.70 0.00 0.00 175.22 181.15 2kui h TRP 571 N 5.00 0.00 0.00 0.36 7.01 -1.43 0.41 115.95 127.29 2kui h TRP 571 Ca -0.54 0.00 -0.04 0.00 2.11 0.00 0.00 58.89 60.42 2kui h TRP 571 Cb 1.22 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 28.28 2kui h TRP 571 CO 0.73 0.00 -0.18 -0.39 -2.79 0.00 0.00 178.44 175.82 2kui h VAL 572 N 0.00 0.39 0.00 2.65 -1.51 -1.94 -2.83 116.25 113.01 2kui h VAL 572 Ca 0.08 -1.10 -0.35 0.00 -1.23 0.00 0.00 66.70 64.10 2kui h VAL 572 Cb 0.37 1.82 -0.06 0.00 -2.13 0.00 0.00 31.29 31.28 2kui h VAL 572 CO -0.00 0.17 -2.33 -0.67 -1.23 0.00 0.00 177.57 173.51 2kui n ASP 573 N -3.26 1.33 0.03 4.19 -0.08 -0.24 -4.60 116.55 113.92 2kui n ASP 573 Ca 0.01 -0.07 -0.11 0.00 -1.51 0.00 0.00 54.79 53.11 2kui n ASP 573 Cb 0.45 0.23 -0.05 0.00 2.34 0.00 0.00 41.12 44.09 2kui n ASP 573 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2kui h ALA 574 N 0.42 -0.04 0.27 -1.67 0.00 -0.21 -2.67 119.26 115.36 2kui h ALA 574 Ca -0.52 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.41 2kui h ALA 574 Cb 1.98 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.87 2kui h ALA 574 CO -0.03 -0.55 -0.34 0.93 0.00 0.00 0.00 179.25 179.26 2kui h GLU 575 N -0.10 -0.64 -0.75 0.00 5.08 -1.75 -0.93 114.58 115.49 2kui h GLU 575 Ca 0.04 0.04 0.16 0.00 -1.00 0.00 0.00 59.36 58.60 2kui h GLU 575 Cb 0.16 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.50 2kui h GLU 575 CO -0.09 -0.42 0.51 -1.00 -1.00 0.00 0.00 179.01 177.00 2kui h PRO 576 N -0.66 0.33 -0.18 2.33 0.13 -1.80 0.23 132.00 132.37 2kui h PRO 576 Ca -0.00 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 2kui h PRO 576 Cb 0.63 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.67 2kui h PRO 576 CO -0.11 0.22 0.06 0.00 -0.23 0.00 0.00 178.00 177.95 2kui h ARG 577 N 0.34 0.28 -0.60 0.86 2.47 -0.99 -0.74 114.38 116.00 2kui h ARG 577 Ca 0.37 -0.06 -0.10 0.00 -1.26 0.00 0.00 59.98 58.94 2kui h ARG 577 Cb 0.94 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 29.20 2kui h ARG 577 CO -0.11 0.38 0.00 -0.07 0.56 0.00 0.00 179.97 180.74 2kui h LEU 578 N 0.13 1.03 -0.92 3.04 4.07 0.14 -1.27 115.31 121.54 2kui h LEU 578 Ca 0.06 -0.29 -0.07 0.00 0.08 0.00 0.00 57.88 57.66 2kui h LEU 578 Cb 0.21 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 41.65 2kui h LEU 578 CO -0.00 1.08 0.02 0.03 -1.08 0.00 0.00 178.44 178.49 2kui h ARG 579 N 0.97 0.81 -0.04 1.13 2.47 -0.51 -0.14 114.38 119.07 2kui h ARG 579 Ca 0.17 -0.21 -0.10 0.00 -1.26 0.00 0.00 59.98 58.58 2kui h ARG 579 Cb 0.55 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.76 2kui h ARG 579 CO 0.03 0.80 -0.43 0.00 0.56 0.00 0.00 179.97 180.93 2kui h ALA 580 N 1.26 1.21 -0.00 0.04 0.00 -0.61 -2.10 119.26 119.06 2kui h ALA 580 Ca 0.15 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2kui h ALA 580 Cb 0.43 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2kui h ALA 580 CO 0.02 0.57 -0.07 1.28 0.00 0.00 0.00 179.25 181.05 2kui n LEU 581 N -4.02 0.11 -1.05 0.00 4.77 -0.53 -4.90 117.00 111.39 2kui n LEU 581 Ca -0.02 0.33 -0.10 0.00 -0.03 0.00 0.00 56.01 56.19 2kui n LEU 581 Cb 0.47 -0.37 -0.01 0.00 -2.33 0.00 0.00 43.42 41.18 2kui n LEU 581 CO 0.40 0.02 -0.12 0.61 -1.33 0.00 0.00 177.39 176.98 2kui n GLY 582 N 1.41 0.13 3.71 -0.72 0.00 -0.70 -4.95 105.19 104.07 2kui n GLY 582 Ca 0.10 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.47 2.66 -0.52 1.61 -0.00 -0.15 -4.96 118.94 115.11 2kui s TRP 583 Ca 0.00 0.31 0.04 0.00 -0.00 0.00 0.00 56.10 56.44 2kui s TRP 583 Cb 0.00 -4.07 0.15 0.00 -0.00 0.00 0.00 33.47 29.55 2kui s TRP 583 CO 0.00 -4.17 0.35 0.99 -0.00 0.00 0.00 176.95 174.11 2kui s THR 584 N 1.83 1.73 0.00 5.86 2.01 -1.26 -4.82 115.64 120.99 2kui s THR 584 Ca 0.75 -3.19 0.00 0.00 0.31 0.00 0.00 61.69 59.56 2kui s THR 584 Cb -0.46 -2.17 0.00 0.00 0.01 0.00 0.00 72.50 69.88 2kui s THR 584 CO 0.33 -1.00 0.00 0.61 -0.69 0.00 0.00 174.62 173.87 2kui n GLY 585 N 2.84 5.47 2.85 4.40 0.00 -1.22 -4.60 105.19 114.93 2kui n GLY 585 Ca 0.17 -1.19 -0.21 0.00 0.00 0.00 0.00 46.02 44.79 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 3.44 0.75 -0.17 1.61 -2.45 -1.26 -4.99 119.30 116.23 2kui s MET 586 Ca 0.00 -0.03 -0.01 0.00 -1.25 0.00 0.00 55.69 54.41 2kui s MET 586 Cb 0.00 -0.89 0.00 0.00 1.25 0.00 0.00 34.83 35.19 2kui s MET 586 CO 0.00 -0.17 -0.13 -1.17 1.05 0.00 0.00 175.02 174.60 2kui s LEU 587 N 1.32 2.53 -0.39 4.11 1.98 -1.26 -4.02 118.68 122.94 2kui s LEU 587 Ca -0.05 -0.48 -0.08 0.00 -2.89 0.00 0.00 54.13 50.63 2kui s LEU 587 Cb -0.13 -1.59 0.06 0.00 0.66 0.00 0.00 46.19 45.19 2kui s LEU 587 CO -0.02 0.05 0.20 -0.62 -1.89 0.00 0.00 176.35 174.07 2kui s ASP 588 N 1.05 5.52 -0.42 3.68 2.15 -1.26 -5.03 116.67 122.36 2kui s ASP 588 Ca -0.01 -1.39 -0.17 0.00 0.43 0.00 0.00 52.55 51.41 2kui s ASP 588 Cb -0.15 -1.94 0.02 0.00 -0.30 0.00 0.00 42.92 40.55 2kui s ASP 588 CO -0.03 -0.46 0.44 -0.75 -0.17 0.00 0.00 175.17 174.20 2kui s LYS 589 N 1.41 3.11 0.00 4.34 2.36 -1.26 -4.85 119.74 124.85 2kui s LYS 589 Ca 0.02 -0.74 0.00 0.00 -2.55 0.00 0.00 55.97 52.70 2kui s LYS 589 Cb -0.22 -3.96 0.00 0.00 -1.05 0.00 0.00 37.83 32.60 2kui s LYS 589 CO 0.02 -0.85 0.00 0.41 1.55 0.00 0.00 175.35 176.48 2kui n GLY 590 N 5.10 -0.18 3.71 5.54 0.00 -1.26 -5.01 105.19 113.10 2kui n GLY 590 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 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 -4.25 3.55 0.50 4.61 0.00 -1.26 -5.08 121.76 119.82 2kui s ALA 591 Ca 0.00 -0.72 -0.10 0.00 0.00 0.00 0.00 51.96 51.14 2kui s ALA 591 Cb 0.00 -1.94 -0.05 0.00 0.00 0.00 0.00 23.12 21.13 2kui s ALA 591 CO 0.00 0.31 0.88 -0.51 0.00 0.00 0.00 175.76 176.43 2kui s ASP 592 N -0.05 6.40 -0.15 0.00 1.01 -1.26 -4.87 116.67 117.75 2kui s ASP 592 Ca 0.08 1.23 0.01 0.00 0.71 0.00 0.00 52.55 54.57 2kui s ASP 592 Cb -0.12 -2.37 0.00 0.00 1.01 0.00 0.00 42.92 41.44 2kui s ASP 592 CO 0.01 -0.60 -0.18 -0.69 0.21 0.00 0.00 175.17 173.92 2kui s VAL 593 N -2.71 2.45 -0.56 -1.27 1.01 -1.22 -5.04 120.40 113.07 2kui s VAL 593 Ca 0.52 -0.84 -0.27 0.00 0.00 0.00 0.00 61.98 61.39 2kui s VAL 593 Cb -0.10 -2.02 0.03 0.00 0.00 0.00 0.00 36.38 34.29 2kui s VAL 593 CO 0.40 0.53 1.12 -0.62 0.00 0.00 0.00 175.10 176.53 2kui s ASP 594 N 0.82 6.45 0.00 3.32 2.15 -1.26 -2.58 116.67 125.57 2kui s ASP 594 Ca -0.06 0.05 0.00 0.00 0.43 0.00 0.00 52.55 52.97 2kui s ASP 594 Cb -0.15 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 39.94 2kui s ASP 594 CO -0.01 -1.38 0.06 0.00 -0.17 0.00 0.00 175.17 173.67 2kui n ALA 595 N 8.11 0.79 0.00 3.66 0.00 -1.26 -5.04 120.51 126.77 2kui n ALA 595 Ca 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.45 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 0.25 -2.53 0.27 0.00 0.00 -1.26 -4.12 105.19 97.79 2kui n GLY 596 Ca 0.00 -1.61 0.02 0.00 0.00 0.00 0.00 46.02 44.42 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 0.46 1.08 -0.02 0.00 -1.95 -1.27 103.07 101.37 2kui h GLY 597 Ca 0.00 -0.24 0.09 0.00 0.00 0.00 0.00 47.33 47.18 2kui h GLY 597 CO 0.00 0.23 0.39 1.76 0.00 0.00 0.00 176.54 178.92 2kui h SER 598 N 0.42 0.37 0.00 0.19 0.02 -1.98 -1.59 113.55 110.98 2kui h SER 598 Ca 0.10 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2kui h SER 598 Cb 0.23 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.70 2kui h SER 598 CO 0.00 0.23 -1.05 0.00 -1.14 0.00 0.00 176.83 174.87 2kui n GLN 599 N -4.47 1.74 0.00 3.45 1.13 -1.13 -5.10 117.38 113.01 2kui n GLN 599 Ca 0.09 -0.05 0.00 0.00 -1.94 0.00 0.00 57.00 55.10 2kui n GLN 599 Cb 0.35 -1.19 0.00 0.00 0.11 0.00 0.00 30.24 29.52 2kui n GLN 599 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 2kui n HIS 600 N -1.59 -0.02 0.18 1.08 -0.00 -0.50 -3.32 115.22 111.05 2kui n HIS 600 Ca 0.00 0.00 -0.07 0.00 0.46 0.00 0.00 57.72 58.11 2kui n HIS 600 Cb 0.26 0.00 0.08 0.00 -0.12 0.00 0.00 29.99 30.21 2kui n HIS 600 CO 0.00 0.00 0.00 0.27 0.46 0.00 0.00 176.34 177.07 2kui n ASN 601 N -3.98 3.20 -4.96 0.26 0.23 -1.26 -2.43 115.26 106.32 2kui n ASN 601 Ca 0.00 -2.57 -0.19 0.00 -0.53 0.00 0.00 54.58 51.30 2kui n ASN 601 Cb 0.00 -0.62 -0.01 0.00 -2.08 0.00 0.00 39.78 37.07 2kui n ASN 601 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2kui s ARG 602 N -1.32 2.81 0.25 -3.83 1.04 -1.21 -1.03 118.95 115.68 2kui s ARG 602 Ca 0.21 -1.26 -0.31 0.00 -1.04 0.00 0.00 55.73 53.33 2kui s ARG 602 Cb 0.18 -2.66 -0.13 0.00 -2.04 0.00 0.00 34.95 30.30 2kui s ARG 602 CO 0.04 -0.15 1.49 1.55 -0.04 0.00 0.00 175.30 178.20 2kui n VAL 603 N -1.69 0.90 -0.10 4.99 3.14 -0.66 -3.76 118.33 121.15 2kui n VAL 603 Ca 0.04 -0.23 -0.11 0.00 -2.96 0.00 0.00 64.34 61.09 2kui n VAL 603 Cb 0.59 -1.67 -0.14 0.00 -1.06 0.00 0.00 33.84 31.57 2kui n VAL 603 CO 0.00 0.00 0.00 0.55 -6.46 0.00 0.00 176.83 170.92 2kui n VAL 604 N 2.13 1.30 -3.69 1.55 3.14 0.29 -4.77 118.33 118.27 2kui n VAL 604 Ca 0.11 -0.72 -0.14 0.00 -2.96 0.00 0.00 64.34 60.63 2kui n VAL 604 Cb 0.33 -0.72 -0.09 0.00 -1.06 0.00 0.00 33.84 32.31 2kui n VAL 604 CO 0.00 0.00 0.00 -0.72 -6.46 0.00 0.00 176.83 169.65 2kui s TYR 605 N -2.46 -0.58 -0.26 1.45 1.13 -1.26 -5.05 117.35 110.33 2kui s TYR 605 Ca -0.15 1.39 -0.12 0.00 -1.41 0.00 0.00 57.07 56.78 2kui s TYR 605 Cb 0.06 0.20 -0.05 0.00 -1.10 0.00 0.00 41.96 41.08 2kui s TYR 605 CO 0.71 -0.29 0.25 1.14 -2.51 0.00 0.00 175.55 174.85 2kui s GLN 606 N 0.21 4.03 0.10 -3.49 -2.07 -1.26 -4.01 119.66 113.17 2kui s GLN 606 Ca -0.01 -0.15 -0.30 0.00 -1.82 0.00 0.00 55.36 53.09 2kui s GLN 606 Cb -0.04 -3.61 -0.11 0.00 -1.09 0.00 0.00 33.01 28.17 2kui s GLN 606 CO 0.01 -0.12 1.61 -0.97 -1.32 0.00 0.00 175.29 174.51 2kui h ASN 607 N 7.95 -0.95 -3.29 12.60 -0.73 -1.65 -3.39 115.58 126.11 2kui h ASN 607 Ca -0.35 0.10 -0.58 0.00 1.87 0.00 0.00 56.30 57.34 2kui h ASN 607 Cb 1.17 0.34 -0.07 0.00 0.27 0.00 0.00 38.32 40.04 2kui h ASN 607 CO 0.62 -0.45 0.43 -2.16 -0.37 0.00 0.00 177.43 175.50 2kui s PRO 608 N -6.00 4.28 0.47 6.67 0.05 -1.26 -5.02 135.00 134.20 2kui s PRO 608 Ca -0.16 1.04 -0.24 0.00 0.05 0.00 0.00 61.00 61.69 2kui s PRO 608 Cb 0.07 -3.59 -0.07 0.00 0.05 0.00 0.00 34.50 30.96 2kui s PRO 608 CO 0.64 -0.37 1.31 -2.14 0.05 0.00 0.00 177.00 176.49 2kui s PRO 609 N 2.30 3.58 0.22 0.56 0.02 -1.26 -4.94 135.00 135.49 2kui s PRO 609 Ca 0.38 2.14 -0.31 0.00 0.02 0.00 0.00 61.00 63.24 2kui s PRO 609 Cb -0.16 -2.49 -0.11 0.00 0.02 0.00 0.00 34.50 31.76 2kui s PRO 609 CO 0.11 -0.80 1.58 0.00 -0.33 0.00 0.00 177.00 177.56 2kui s ALA 610 N -1.33 3.77 0.00 -1.55 0.00 -1.26 -1.89 121.76 119.50 2kui s ALA 610 Ca 0.64 1.46 0.00 0.00 0.00 0.00 0.00 51.96 54.06 2kui s ALA 610 Cb -0.38 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.11 2kui s ALA 610 CO 0.46 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.78 2kui n GLY 611 N 3.08 0.54 3.92 0.00 0.00 -0.37 -4.96 105.19 107.39 2kui n GLY 611 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.00 5.18 0.07 2.61 2.01 -0.79 -4.83 115.64 117.89 2kui s THR 612 Ca 0.00 -0.74 -0.30 0.00 0.31 0.00 0.00 61.69 60.96 2kui s THR 612 Cb 0.00 -3.66 -0.05 0.00 0.01 0.00 0.00 72.50 68.80 2kui s THR 612 CO 0.00 -0.08 0.96 -0.83 -0.69 0.00 0.00 174.62 173.98 2kui s GLY 613 N -3.18 2.96 -0.01 4.40 0.00 -1.26 -0.63 107.32 109.60 2kui s GLY 613 Ca 0.34 0.55 0.05 0.00 0.00 0.00 0.00 44.72 45.66 2kui s GLY 613 CO 0.28 1.54 -0.15 -1.34 0.00 0.00 0.00 173.10 173.43 2kui s VAL 614 N 0.38 3.03 1.18 1.40 -7.23 0.88 -4.83 120.40 115.21 2kui s VAL 614 Ca 0.49 -0.90 -0.15 0.00 -1.81 0.00 0.00 61.98 59.61 2kui s VAL 614 Cb -0.22 -2.24 0.25 0.00 0.56 0.00 0.00 36.38 34.73 2kui s VAL 614 CO 0.29 0.47 0.73 0.59 -0.31 0.00 0.00 175.10 176.87 2kui n ASN 615 N 1.92 -2.01 0.30 4.85 3.02 -1.26 -0.93 115.26 121.15 2kui n ASN 615 Ca -0.16 -0.18 0.16 0.00 -0.03 0.00 0.00 54.58 54.36 2kui n ASN 615 Cb 0.52 -1.17 0.92 0.00 -0.61 0.00 0.00 39.78 39.45 2kui n ASN 615 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 2kui h ARG 616 N -2.57 0.00 0.04 3.52 0.11 -1.90 -0.91 114.38 112.68 2kui h ARG 616 Ca -0.60 0.00 -0.24 0.00 0.10 0.00 0.00 59.98 59.23 2kui h ARG 616 Cb 1.34 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.43 2kui h ARG 616 CO 0.46 0.02 -1.03 0.38 0.10 0.00 0.00 179.97 179.90 2kui h ASP 617 N 0.00 0.50 0.00 0.08 3.04 -1.90 -3.47 116.42 114.68 2kui h ASP 617 Ca -0.00 -0.44 0.00 0.00 -3.24 0.00 0.00 57.03 53.35 2kui h ASP 617 Cb 0.05 -0.16 0.00 0.00 -1.04 0.00 0.00 39.33 38.18 2kui h ASP 617 CO 0.00 1.26 0.00 0.61 -2.04 0.00 0.00 179.24 179.08 2kui n GLY 618 N 1.12 0.42 3.66 7.15 0.00 -0.35 -3.42 105.19 113.77 2kui n GLY 618 Ca -0.07 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.53 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 3.48 -0.05 -0.61 -1.16 -1.26 -4.81 121.20 114.79 2kui s ILE 619 Ca 0.00 0.57 0.03 0.00 -0.51 0.00 0.00 60.65 60.74 2kui s ILE 619 Cb 0.00 -3.38 0.01 0.00 0.61 0.00 0.00 42.46 39.70 2kui s ILE 619 CO 0.00 -0.06 -0.13 -0.51 -2.81 0.00 0.00 174.94 171.43 2kui s ILE 620 N 4.22 1.14 -0.10 2.00 -1.16 -1.26 -4.94 121.20 121.10 2kui s ILE 620 Ca 0.76 -0.52 -0.00 0.00 -0.51 0.00 0.00 60.65 60.38 2kui s ILE 620 Cb -0.35 -1.02 -0.03 0.00 0.61 0.00 0.00 42.46 41.68 2kui s ILE 620 CO 0.32 0.35 -0.08 -0.89 -2.81 0.00 0.00 174.94 171.83 2kui s THR 621 N 0.37 3.57 0.05 4.00 2.01 -1.26 -4.60 115.64 119.78 2kui s THR 621 Ca -0.09 -0.50 0.01 0.00 0.31 0.00 0.00 61.69 61.42 2kui s THR 621 Cb -0.13 -2.50 -0.03 0.00 0.01 0.00 0.00 72.50 69.86 2kui s THR 621 CO 0.02 0.55 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.69 2kui s LEU 622 N -0.22 2.35 -0.03 4.42 1.43 -1.26 -1.45 118.68 123.93 2kui s LEU 622 Ca 0.03 -0.72 0.04 0.00 -1.03 0.00 0.00 54.13 52.44 2kui s LEU 622 Cb -0.13 -0.02 -0.01 0.00 0.03 0.00 0.00 46.19 46.07 2kui s LEU 622 CO 0.03 -0.36 -0.15 -0.13 0.23 0.00 0.00 176.35 175.97 2kui s ARG 623 N -2.49 1.38 0.14 1.70 1.81 -1.26 -4.88 118.95 115.36 2kui s ARG 623 Ca -0.03 -0.52 -0.03 0.00 -1.72 0.00 0.00 55.73 53.43 2kui s ARG 623 Cb -0.03 -1.27 -0.03 0.00 -0.45 0.00 0.00 34.95 33.17 2kui s ARG 623 CO -0.03 0.25 0.11 -0.59 -0.68 0.00 0.00 175.30 174.37 2kui s PHE 624 N -0.09 0.76 0.00 -0.53 -0.12 -1.26 -0.55 117.98 116.19 2kui s PHE 624 Ca 0.00 -1.12 0.00 0.00 -0.05 0.00 0.00 56.93 55.76 2kui s PHE 624 Cb -0.09 -0.38 0.00 0.00 -0.63 0.00 0.00 43.02 41.93 2kui s PHE 624 CO 0.01 -0.57 0.00 0.41 -0.05 0.00 0.00 175.22 175.01 2kui n GLY 625 N -0.13 1.12 0.00 1.99 0.00 -1.02 -3.37 105.19 103.78 2kui n GLY 625 Ca -0.06 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.18 2kui n GLY 625 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26