#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 4.47 0.02 -0.61 1.10 -1.26 -5.01 121.20 119.92 2kui s ILE 356 Ca 0.00 1.77 -0.07 0.00 -0.51 0.00 0.00 60.65 61.84 2kui s ILE 356 Cb 0.00 -4.14 -0.00 0.00 0.15 0.00 0.00 42.46 38.47 2kui s ILE 356 CO 0.00 -0.01 0.13 -0.89 -2.11 0.00 0.00 174.94 172.06 2kui s THR 357 N 2.19 0.10 -1.29 4.00 2.01 -1.26 -5.06 115.64 116.34 2kui s THR 357 Ca 0.53 -0.86 -0.11 0.00 0.31 0.00 0.00 61.69 61.55 2kui s THR 357 Cb -0.22 -0.66 0.15 0.00 0.01 0.00 0.00 72.50 71.78 2kui s THR 357 CO 0.20 -0.48 1.82 -2.11 -0.69 0.00 0.00 174.62 173.36 2kui n ARG 358 N 1.09 3.45 -3.49 4.92 0.00 -1.26 -4.91 116.66 116.46 2kui n ARG 358 Ca -0.21 -3.46 -0.33 0.00 -0.00 0.00 0.00 57.85 53.85 2kui n ARG 358 Cb 0.57 -3.03 -0.05 0.00 -0.00 0.00 0.00 32.46 29.95 2kui n ARG 358 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2kui s ASP 359 N 1.74 6.62 0.11 2.89 1.01 -1.26 -4.75 116.67 123.04 2kui s ASP 359 Ca 0.42 0.85 0.09 0.00 0.71 0.00 0.00 52.55 54.62 2kui s ASP 359 Cb 0.07 -2.20 -0.04 0.00 1.01 0.00 0.00 42.92 41.77 2kui s ASP 359 CO -0.00 0.02 -0.19 0.68 0.21 0.00 0.00 175.17 175.88 2kui s VAL 360 N -1.67 2.76 -0.15 -1.27 -7.23 0.62 -4.65 120.40 108.81 2kui s VAL 360 Ca 0.42 -1.52 -0.16 0.00 -1.81 0.00 0.00 61.98 58.91 2kui s VAL 360 Cb -0.12 -2.25 -0.04 0.00 0.56 0.00 0.00 36.38 34.52 2kui s VAL 360 CO 0.21 0.11 0.40 -1.58 -0.31 0.00 0.00 175.10 173.93 2kui s GLN 361 N -2.08 4.28 -0.24 4.82 -0.44 -1.26 0.07 119.66 124.80 2kui s GLN 361 Ca 0.17 0.27 -0.15 0.00 -2.50 0.00 0.00 55.36 53.15 2kui s GLN 361 Cb -0.10 -3.45 -0.04 0.00 -1.64 0.00 0.00 33.01 27.77 2kui s GLN 361 CO 0.09 0.14 0.37 0.08 0.50 0.00 0.00 175.29 176.47 2kui s VAL 362 N 0.73 5.19 0.11 1.34 1.01 -0.43 -4.98 120.40 123.37 2kui s VAL 362 Ca 0.21 0.60 -0.31 0.00 0.00 0.00 0.00 61.98 62.48 2kui s VAL 362 Cb -0.14 -3.70 -0.10 0.00 0.00 0.00 0.00 36.38 32.44 2kui s VAL 362 CO 0.07 0.20 1.76 -2.84 0.00 0.00 0.00 175.10 174.30 2kui s PRO 363 N 1.71 4.16 0.00 2.72 0.02 -1.26 -4.31 135.00 138.04 2kui s PRO 363 Ca 0.16 2.51 -0.30 0.00 0.02 0.00 0.00 61.00 63.38 2kui s PRO 363 Cb -0.15 -3.55 -0.05 0.00 0.02 0.00 0.00 34.50 30.76 2kui s PRO 363 CO 0.09 -0.80 1.34 0.16 -0.33 0.00 0.00 177.00 177.46 2kui s ASP 364 N 2.48 6.91 0.00 2.53 -4.77 -1.26 -4.86 116.67 117.69 2kui s ASP 364 Ca 0.78 2.06 0.25 0.00 -3.30 0.00 0.00 52.55 52.33 2kui s ASP 364 Cb -0.44 -2.56 0.34 0.00 -1.09 0.00 0.00 42.92 39.16 2kui s ASP 364 CO 0.35 -0.67 1.34 0.52 0.70 0.00 0.00 175.17 177.41 2kui n VAL 365 N 4.55 0.01 -2.01 2.11 0.31 -1.26 -4.97 118.33 117.07 2kui n VAL 365 Ca 0.12 -0.46 -0.38 0.00 -0.01 0.00 0.00 64.34 63.61 2kui n VAL 365 Cb 0.44 1.32 0.02 0.00 -0.91 0.00 0.00 33.84 34.71 2kui n VAL 365 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2kui s ARG 366 N -1.99 3.40 0.00 5.55 1.04 -1.26 -3.01 118.95 122.68 2kui s ARG 366 Ca 0.30 2.01 0.00 0.00 -1.04 0.00 0.00 55.73 56.99 2kui s ARG 366 Cb 0.20 -2.30 0.00 0.00 -2.04 0.00 0.00 34.95 30.81 2kui s ARG 366 CO 0.31 -0.91 0.00 0.41 -0.04 0.00 0.00 175.30 175.07 2kui n GLY 367 N 0.59 0.41 0.00 3.88 0.00 0.27 -4.98 105.19 105.35 2kui n GLY 367 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2kui n GLY 367 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kui n GLN 368 N -1.47 2.83 -2.58 1.61 6.02 -1.16 -4.86 117.38 117.77 2kui n GLN 368 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.72 2kui n GLN 368 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 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 -0.31 6.20 0.16 1.08 1.04 -1.26 -0.83 113.70 119.78 2kui s SER 369 Ca 0.00 0.93 -0.16 0.00 0.48 0.00 0.00 55.95 57.20 2kui s SER 369 Cb 0.00 -2.21 0.04 0.00 0.10 0.00 0.00 66.02 63.95 2kui s SER 369 CO 0.00 -0.63 1.80 0.77 0.98 0.00 0.00 173.24 176.15 2kui h SER 370 N 0.16 0.37 -0.23 7.02 4.64 -1.90 -0.29 113.55 123.33 2kui h SER 370 Ca -0.47 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.83 2kui h SER 370 Cb 1.21 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 2kui h SER 370 CO 0.62 0.26 0.05 0.00 -0.87 0.00 0.00 176.83 176.89 2kui h ALA 371 N 1.18 0.30 -0.41 5.18 0.00 -1.93 0.47 119.26 124.05 2kui h ALA 371 Ca 0.16 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2kui h ALA 371 Cb 0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2kui h ALA 371 CO -0.08 -0.04 -0.21 0.22 0.00 0.00 0.00 179.25 179.15 2kui h ASP 372 N 0.18 0.81 -0.06 0.00 3.58 -1.92 0.11 116.42 119.13 2kui h ASP 372 Ca 0.07 -0.29 -0.02 0.00 0.42 0.00 0.00 57.03 57.21 2kui h ASP 372 Cb 0.30 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 41.12 2kui h ASP 372 CO 0.00 1.00 -0.05 0.00 -2.88 0.00 0.00 179.24 177.31 2kui h ALA 373 N 1.07 0.09 -0.55 -0.78 0.00 -0.95 -2.51 119.26 115.62 2kui h ALA 373 Ca 0.10 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 2kui h ALA 373 Cb 0.72 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2kui h ALA 373 CO 0.06 -0.12 0.11 0.82 0.00 0.00 0.00 179.25 180.11 2kui h ILE 374 N -0.29 1.25 -0.48 0.00 2.04 -0.79 -2.50 117.51 116.75 2kui h ILE 374 Ca 0.01 -0.92 0.02 0.00 1.00 0.00 0.00 64.86 64.97 2kui h ILE 374 Cb 0.54 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 2kui h ILE 374 CO 0.01 0.34 0.29 0.00 0.00 0.00 0.00 178.15 178.79 2kui h ALA 375 N 1.00 0.61 -0.18 1.87 0.00 -0.79 0.71 119.26 122.49 2kui h ALA 375 Ca 0.17 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2kui h ALA 375 Cb 0.38 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2kui h ALA 375 CO 0.01 -0.02 0.05 1.15 0.00 0.00 0.00 179.25 180.44 2kui h THR 376 N 0.57 1.20 -0.66 0.00 2.02 -1.35 -1.11 112.91 113.59 2kui h THR 376 Ca 0.19 -0.62 -0.06 0.00 0.77 0.00 0.00 66.41 66.69 2kui h THR 376 Cb 0.01 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 2kui h THR 376 CO -0.08 0.19 0.17 -0.07 0.37 0.00 0.00 175.52 176.10 2kui h LEU 377 N 0.10 0.96 -0.62 2.58 4.07 -1.16 -1.65 115.31 119.60 2kui h LEU 377 Ca 0.06 -0.19 -0.04 0.00 0.08 0.00 0.00 57.88 57.79 2kui h LEU 377 Cb 0.25 -0.25 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 2kui h LEU 377 CO -0.00 0.92 0.24 -0.61 -1.08 0.00 0.00 178.44 177.90 2kui h GLN 378 N 0.98 0.94 0.00 1.13 5.75 -0.71 -0.07 115.11 123.13 2kui h GLN 378 Ca 0.21 -0.18 -0.07 0.00 -0.15 0.00 0.00 58.65 58.46 2kui h GLN 378 Cb 0.33 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 2kui h GLN 378 CO -0.00 0.81 -0.32 -0.91 -2.65 0.00 0.00 178.83 175.75 2kui h ASN 379 N 0.88 0.00 1.57 -0.69 2.35 -0.78 -1.70 115.58 117.21 2kui h ASN 379 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 2kui h ASN 379 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.60 2kui h ASN 379 CO -0.01 0.32 0.00 0.03 -1.65 0.00 0.00 177.43 176.12 2kui h ARG 380 N 0.00 0.00 0.00 0.81 2.47 -0.73 -3.47 114.38 113.46 2kui h ARG 380 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2kui h ARG 380 Cb 0.64 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.96 2kui h ARG 380 CO 0.04 0.00 0.00 0.41 0.56 0.00 0.00 179.97 180.98 2kui n GLY 381 N 1.27 0.89 3.77 0.04 0.00 -0.64 -4.79 105.19 105.73 2kui n GLY 381 Ca 0.05 -0.13 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 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 3.63 -0.01 1.61 0.08 -0.13 -4.48 117.98 116.68 2kui s PHE 382 Ca 0.00 1.76 -0.25 0.00 0.12 0.00 0.00 56.93 58.56 2kui s PHE 382 Cb 0.00 -3.05 -0.04 0.00 -0.57 0.00 0.00 43.02 39.35 2kui s PHE 382 CO 0.00 -0.09 0.78 0.15 -0.10 0.00 0.00 175.22 175.96 2kui s LYS 383 N -1.87 4.48 -0.02 0.44 1.02 0.26 -4.36 119.74 119.70 2kui s LYS 383 Ca 0.49 1.05 0.03 0.00 0.02 0.00 0.00 55.97 57.57 2kui s LYS 383 Cb -0.23 -3.42 -0.00 0.00 -0.52 0.00 0.00 37.83 33.66 2kui s LYS 383 CO 0.30 0.13 -0.11 0.96 -0.92 0.00 0.00 175.35 175.70 2kui s ILE 384 N 0.49 0.93 -0.03 2.17 -5.25 -1.26 -0.24 121.20 118.02 2kui s ILE 384 Ca 0.41 -0.48 0.04 0.00 -0.99 0.00 0.00 60.65 59.62 2kui s ILE 384 Cb -0.19 -0.80 -0.03 0.00 2.95 0.00 0.00 42.46 44.39 2kui s ILE 384 CO 0.22 0.27 -0.13 -0.60 -1.79 0.00 0.00 174.94 172.91 2kui s ARG 385 N -0.10 2.46 -0.15 0.37 3.52 0.65 -4.96 118.95 120.73 2kui s ARG 385 Ca 0.01 -0.73 0.01 0.00 -0.13 0.00 0.00 55.73 54.89 2kui s ARG 385 Cb -0.06 -2.38 0.02 0.00 -1.56 0.00 0.00 34.95 30.97 2kui s ARG 385 CO 0.00 0.61 -0.17 0.99 -0.81 0.00 0.00 175.30 175.92 2kui s THR 386 N -0.80 1.80 -0.16 4.11 2.01 -1.26 0.21 115.64 121.55 2kui s THR 386 Ca 0.13 -0.79 -0.02 0.00 0.31 0.00 0.00 61.69 61.32 2kui s THR 386 Cb -0.11 -1.65 -0.02 0.00 0.01 0.00 0.00 72.50 70.74 2kui s THR 386 CO 0.02 0.50 -0.07 -0.22 -0.69 0.00 0.00 174.62 174.15 2kui s LEU 387 N 1.28 2.97 -0.10 4.42 1.98 0.90 -4.95 118.68 125.17 2kui s LEU 387 Ca 0.02 -0.26 -0.17 0.00 -2.89 0.00 0.00 54.13 50.84 2kui s LEU 387 Cb -0.13 -1.71 -0.05 0.00 0.66 0.00 0.00 46.19 44.96 2kui s LEU 387 CO -0.10 0.13 0.42 -1.10 -1.89 0.00 0.00 176.35 173.82 2kui s GLN 388 N 0.60 4.25 -0.06 1.98 1.11 -1.26 -0.57 119.66 125.70 2kui s GLN 388 Ca -0.05 0.37 0.04 0.00 0.01 0.00 0.00 55.36 55.72 2kui s GLN 388 Cb -0.15 -3.39 0.00 0.00 -1.01 0.00 0.00 33.01 28.46 2kui s GLN 388 CO 0.03 0.28 -0.16 0.15 0.01 0.00 0.00 175.29 175.59 2kui s LYS 389 N 0.27 1.88 0.30 2.91 -0.14 0.48 -4.94 119.74 120.51 2kui s LYS 389 Ca 0.23 -0.57 -0.29 0.00 -1.36 0.00 0.00 55.97 53.99 2kui s LYS 389 Cb -0.15 -1.57 -0.10 0.00 -1.68 0.00 0.00 37.83 34.33 2kui s LYS 389 CO 0.09 0.16 1.15 -2.14 -0.76 0.00 0.00 175.35 173.86 2kui s PRO 390 N 0.29 4.54 -0.18 -1.68 0.02 -1.21 -0.58 135.00 136.20 2kui s PRO 390 Ca -0.09 1.90 -0.29 0.00 0.02 0.00 0.00 61.00 62.54 2kui s PRO 390 Cb -0.14 -3.13 -0.02 0.00 0.02 0.00 0.00 34.50 31.24 2kui s PRO 390 CO 0.03 0.09 1.34 0.16 -0.33 0.00 0.00 177.00 178.29 2kui s ASP 391 N -0.80 6.83 -0.42 2.53 1.47 -0.23 -4.87 116.67 121.18 2kui s ASP 391 Ca 0.46 1.67 0.04 0.00 1.18 0.00 0.00 52.55 55.91 2kui s ASP 391 Cb -0.34 -2.54 0.17 0.00 -0.34 0.00 0.00 42.92 39.88 2kui s ASP 391 CO 0.44 -0.87 0.40 -0.44 0.68 0.00 0.00 175.17 175.38 2kui s SER 392 N 2.42 1.04 0.00 2.11 0.01 -1.26 -3.13 113.70 114.89 2kui s SER 392 Ca 0.58 -2.65 0.00 0.00 1.31 0.00 0.00 55.95 55.19 2kui s SER 392 Cb -0.22 0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.04 2kui s SER 392 CO 0.19 -0.17 0.00 0.41 0.41 0.00 0.00 173.24 174.08 2kui n THR 393 N 3.07 0.00 -4.04 1.44 -1.04 -1.26 -5.05 114.28 107.40 2kui n THR 393 Ca 0.25 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.97 2kui n THR 393 Cb 0.48 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.93 2kui n THR 393 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 2kui s ILE 394 N -2.26 4.61 0.33 12.58 -4.36 -1.26 -5.12 121.20 125.72 2kui s ILE 394 Ca 0.00 -0.82 -0.06 0.00 -0.26 0.00 0.00 60.65 59.51 2kui s ILE 394 Cb 0.00 -3.27 0.08 0.00 1.25 0.00 0.00 42.46 40.52 2kui s ILE 394 CO 0.00 0.05 0.36 -0.81 0.24 0.00 0.00 174.94 174.78 2kui n PRO 395 N 0.18 -1.07 -0.70 0.37 -0.04 -1.26 -4.84 135.00 127.65 2kui n PRO 395 Ca -0.08 -0.57 -0.32 0.00 -0.04 0.00 0.00 63.50 62.49 2kui n PRO 395 Cb 0.52 -0.45 0.16 0.00 -0.04 0.00 0.00 33.50 33.69 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 -2.20 -0.90 0.00 0.54 -0.02 -1.26 -4.73 135.00 126.43 2kui n PRO 396 Ca 0.05 -0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 2kui n PRO 396 Cb 0.17 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 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 -2.59 0.00 -4.67 2.55 5.75 -1.25 -4.55 116.55 111.80 2kui n ASP 397 Ca 0.06 0.34 -0.42 0.00 -0.01 0.00 0.00 54.79 54.76 2kui n ASP 397 Cb 0.55 -0.34 -0.03 0.00 -1.03 0.00 0.00 41.12 40.27 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 -2.65 1.97 -0.13 2.11 3.76 -1.26 -3.43 115.29 115.65 2kui s HIS 398 Ca 0.00 0.09 -0.29 0.00 -0.15 0.00 0.00 55.06 54.71 2kui s HIS 398 Cb 0.00 -4.00 -0.04 0.00 1.11 0.00 0.00 32.58 29.65 2kui s HIS 398 CO 0.00 -4.22 1.61 0.14 -0.85 0.00 0.00 174.74 171.42 2kui s VAL 399 N 3.69 3.69 -0.09 -0.90 -7.23 -0.01 -4.85 120.40 114.71 2kui s VAL 399 Ca 0.77 0.81 0.14 0.00 -1.81 0.00 0.00 61.98 61.89 2kui s VAL 399 Cb -0.37 -3.60 -0.23 0.00 0.56 0.00 0.00 36.38 32.75 2kui s VAL 399 CO 0.33 -0.15 0.55 0.00 -0.31 0.00 0.00 175.10 175.51 2kui n ILE 400 N 5.86 1.49 -3.91 -0.62 0.00 -1.26 0.94 119.36 121.85 2kui n ILE 400 Ca 0.18 -0.79 -0.09 0.00 0.00 0.00 0.00 62.75 62.05 2kui n ILE 400 Cb 0.44 -0.86 -0.08 0.00 0.00 0.00 0.00 39.64 39.14 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 -5.15 0.21 0.24 4.50 0.00 -1.26 -4.44 107.32 101.43 2kui s GLY 401 Ca -0.06 -0.77 0.02 0.00 0.00 0.00 0.00 44.72 43.91 2kui s GLY 401 CO 0.83 -0.92 0.29 -1.30 0.00 0.00 0.00 173.10 172.00 2kui n THR 402 N -0.04 0.00 -3.83 0.90 -2.24 -1.26 -4.44 114.28 103.37 2kui n THR 402 Ca -0.14 -1.45 -0.37 0.00 -2.27 0.00 0.00 64.05 59.82 2kui n THR 402 Cb 0.62 0.81 -0.06 0.00 -2.10 0.00 0.00 70.33 69.60 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 -2.58 6.39 0.33 3.42 -1.08 -1.26 -4.96 116.67 116.93 2kui s ASP 403 Ca 0.24 0.46 0.09 0.00 -0.52 0.00 0.00 52.55 52.82 2kui s ASP 403 Cb 0.00 -2.09 0.50 0.00 -1.46 0.00 0.00 42.92 39.88 2kui s ASP 403 CO 0.17 0.36 1.13 -0.65 0.52 0.00 0.00 175.17 176.70 2kui h PRO 404 N 5.27 0.00 -0.77 4.34 0.11 -2.00 -1.79 132.00 137.17 2kui h PRO 404 Ca -0.52 0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.71 2kui h PRO 404 Cb 1.22 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.24 2kui h PRO 404 CO 0.61 0.00 0.36 0.00 -0.21 0.00 0.00 178.00 178.76 2kui h ALA 405 N 0.81 1.10 -0.33 -0.75 0.00 -1.92 0.18 119.26 118.35 2kui h ALA 405 Ca 0.00 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 2kui h ALA 405 Cb 0.89 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2kui h ALA 405 CO 0.00 -0.12 -0.13 0.00 0.00 0.00 0.00 179.25 179.00 2kui h ALA 406 N 1.51 1.17 -0.04 0.00 0.00 -1.66 -1.91 119.26 118.33 2kui h ALA 406 Ca 0.41 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2kui h ALA 406 Cb 0.55 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2kui h ALA 406 CO -0.35 0.53 0.00 0.09 0.00 0.00 0.00 179.25 179.52 2kui n ASN 407 N -4.18 0.74 -4.81 0.00 4.13 0.09 -1.31 115.26 109.91 2kui n ASN 407 Ca 0.01 -1.36 -0.22 0.00 1.68 0.00 0.00 54.58 54.68 2kui n ASN 407 Cb 0.34 -0.02 -0.05 0.00 -1.54 0.00 0.00 39.78 38.51 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 -1.96 2.89 -0.36 3.41 2.01 0.40 -4.87 115.64 117.16 2kui s THR 408 Ca 0.38 -1.51 -0.29 0.00 0.31 0.00 0.00 61.69 60.58 2kui s THR 408 Cb 0.19 -3.03 0.01 0.00 0.01 0.00 0.00 72.50 69.67 2kui s THR 408 CO 0.31 -0.09 1.29 -0.44 -0.69 0.00 0.00 174.62 175.00 2kui s SER 409 N -3.98 6.58 0.39 3.53 0.01 -1.26 -3.82 113.70 115.15 2kui s SER 409 Ca 0.42 0.96 0.06 0.00 1.31 0.00 0.00 55.95 58.70 2kui s SER 409 Cb -0.02 -2.54 -0.07 0.00 0.21 0.00 0.00 66.02 63.59 2kui s SER 409 CO 0.25 -1.20 0.02 0.68 0.41 0.00 0.00 173.24 173.40 2kui s VAL 410 N 4.66 1.75 0.39 3.43 -7.23 0.11 -4.67 120.40 118.85 2kui s VAL 410 Ca 0.56 -2.00 -0.26 0.00 -1.81 0.00 0.00 61.98 58.46 2kui s VAL 410 Cb -0.14 -2.91 -0.11 0.00 0.56 0.00 0.00 36.38 33.78 2kui s VAL 410 CO 0.27 0.00 1.26 -1.20 -0.31 0.00 0.00 175.10 175.12 2kui n SER 411 N -0.91 2.56 -4.60 4.85 7.64 -1.26 -0.27 113.62 121.62 2kui n SER 411 Ca -0.05 1.14 -0.43 0.00 1.01 0.00 0.00 58.87 60.55 2kui n SER 411 Cb 0.67 -1.49 -0.03 0.00 -1.01 0.00 0.00 64.21 62.36 2kui n SER 411 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kui s ALA 412 N -1.16 2.83 0.00 -0.43 0.00 -1.26 -1.65 121.76 120.08 2kui s ALA 412 Ca 0.59 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.89 2kui s ALA 412 Cb -0.53 -4.03 0.00 0.00 0.00 0.00 0.00 23.12 18.55 2kui s ALA 412 CO 0.60 -2.69 0.00 0.41 0.00 0.00 0.00 175.76 174.08 2kui n GLY 413 N 5.49 0.83 0.75 0.00 0.00 -1.26 -5.00 105.19 106.00 2kui n GLY 413 Ca 0.24 -0.42 -0.06 0.00 0.00 0.00 0.00 46.02 45.78 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 0.56 0.01 -4.32 1.61 -0.08 -0.66 -4.29 116.55 109.38 2kui n ASP 414 Ca 0.00 -1.09 -0.38 0.00 -1.51 0.00 0.00 54.79 51.81 2kui n ASP 414 Cb 0.34 -0.20 -0.12 0.00 2.34 0.00 0.00 41.12 43.47 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 -3.57 2.90 -0.06 -0.67 2.02 -1.26 -0.57 118.70 117.49 2kui s GLU 415 Ca 0.15 -0.99 0.04 0.00 0.02 0.00 0.00 54.97 54.19 2kui s GLU 415 Cb -0.00 -3.44 -0.02 0.00 0.10 0.00 0.00 34.13 30.77 2kui s GLU 415 CO 0.10 -0.55 -0.19 0.42 0.02 0.00 0.00 175.26 175.07 2kui s ILE 416 N 1.47 2.64 -0.13 -1.63 -1.09 0.67 -4.99 121.20 118.14 2kui s ILE 416 Ca 0.01 -0.87 -0.01 0.00 -2.23 0.00 0.00 60.65 57.55 2kui s ILE 416 Cb -0.18 -2.01 -0.02 0.00 -1.58 0.00 0.00 42.46 38.66 2kui s ILE 416 CO 0.03 0.57 -0.09 0.28 -1.23 0.00 0.00 174.94 174.51 2kui s THR 417 N -0.42 3.48 -0.08 2.92 -1.32 -1.26 -0.26 115.64 118.70 2kui s THR 417 Ca 0.04 -0.52 0.03 0.00 -1.21 0.00 0.00 61.69 60.04 2kui s THR 417 Cb -0.12 -2.48 -0.02 0.00 -1.51 0.00 0.00 72.50 68.37 2kui s THR 417 CO 0.02 0.52 -0.17 0.54 -2.21 0.00 0.00 174.62 173.32 2kui s VAL 418 N 0.15 2.78 -0.21 5.08 0.11 0.13 -4.50 120.40 123.94 2kui s VAL 418 Ca -0.04 -0.80 -0.10 0.00 -2.93 0.00 0.00 61.98 58.11 2kui s VAL 418 Cb -0.14 -2.10 -0.05 0.00 -1.53 0.00 0.00 36.38 32.56 2kui s VAL 418 CO 0.04 0.56 0.12 0.54 -3.33 0.00 0.00 175.10 173.03 2kui s ASN 419 N -0.20 6.06 -0.03 3.54 2.20 -1.26 -0.07 114.94 125.17 2kui s ASN 419 Ca -0.00 0.17 0.05 0.00 -0.94 0.00 0.00 52.86 52.13 2kui s ASN 419 Cb -0.13 -2.07 -0.01 0.00 -2.00 0.00 0.00 41.25 37.04 2kui s ASN 419 CO 0.03 0.15 -0.17 0.54 -2.94 0.00 0.00 177.10 174.71 2kui s VAL 420 N 0.55 1.40 -0.25 3.54 0.11 0.26 -4.72 120.40 121.29 2kui s VAL 420 Ca 0.07 -0.73 -0.18 0.00 -2.93 0.00 0.00 61.98 58.22 2kui s VAL 420 Cb -0.12 -1.19 -0.03 0.00 -1.53 0.00 0.00 36.38 33.51 2kui s VAL 420 CO 0.00 0.40 0.50 -0.94 -3.33 0.00 0.00 175.10 171.73 2kui s SER 421 N -0.15 6.44 0.18 3.54 1.04 -1.25 -0.38 113.70 123.11 2kui s SER 421 Ca 0.01 0.52 0.10 0.00 0.48 0.00 0.00 55.95 57.06 2kui s SER 421 Cb -0.09 -2.28 -0.04 0.00 0.10 0.00 0.00 66.02 63.71 2kui s SER 421 CO 0.01 -0.26 -0.21 0.28 0.98 0.00 0.00 173.24 174.04 2kui s THR 422 N 2.18 2.10 -0.00 2.02 -1.32 0.25 -3.77 115.64 117.10 2kui s THR 422 Ca 0.21 -2.00 -0.00 0.00 -1.21 0.00 0.00 61.69 58.69 2kui s THR 422 Cb -0.16 -1.99 0.00 0.00 -1.51 0.00 0.00 72.50 68.84 2kui s THR 422 CO 0.09 -0.23 0.00 0.61 -2.21 0.00 0.00 174.62 172.89 2kui n GLY 423 N 0.23 -2.98 3.76 6.08 0.00 -1.26 -3.13 105.19 107.89 2kui n GLY 423 Ca -0.12 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.22 2kui n GLY 423 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2kui s PRO 424 N -0.93 2.91 0.83 1.61 0.04 -1.26 -1.07 135.00 137.13 2kui s PRO 424 Ca -0.01 1.55 -0.11 0.00 0.04 0.00 0.00 61.00 62.47 2kui s PRO 424 Cb 0.00 -1.95 0.09 0.00 0.04 0.00 0.00 34.50 32.68 2kui s PRO 424 CO 0.02 -1.19 1.09 -1.83 0.04 0.00 0.00 177.00 175.13 2kui s GLU 425 N -3.74 1.78 0.11 4.56 -1.05 -1.18 -4.83 118.70 114.35 2kui s GLU 425 Ca 0.71 0.76 0.02 0.00 -0.15 0.00 0.00 54.97 56.31 2kui s GLU 425 Cb -0.24 -1.87 -0.04 0.00 -0.44 0.00 0.00 34.13 31.54 2kui s GLU 425 CO 0.36 -1.86 -0.06 -0.65 0.95 0.00 0.00 175.26 174.00 2kui s GLN 426 N -5.04 0.90 -0.04 -4.83 -0.21 -1.26 -4.84 119.66 104.33 2kui s GLN 426 Ca 0.62 -1.38 0.07 0.00 0.02 0.00 0.00 55.36 54.69 2kui s GLN 426 Cb -0.16 -0.26 -0.02 0.00 1.00 0.00 0.00 33.01 33.57 2kui s GLN 426 CO 0.55 -0.02 -0.25 1.03 -2.12 0.00 0.00 175.29 174.48 2kui s ARG 427 N -3.84 2.30 0.03 2.91 1.81 -0.06 -4.88 118.95 117.22 2kui s ARG 427 Ca 0.14 -0.91 -0.21 0.00 -1.72 0.00 0.00 55.73 53.03 2kui s ARG 427 Cb 0.05 -2.10 -0.06 0.00 -0.45 0.00 0.00 34.95 32.39 2kui s ARG 427 CO -0.03 0.49 0.62 -1.83 -0.68 0.00 0.00 175.30 173.87 2kui s GLU 428 N -0.44 4.33 0.01 3.54 -1.05 -1.26 0.18 118.70 124.01 2kui s GLU 428 Ca 0.05 0.80 -0.29 0.00 -0.15 0.00 0.00 54.97 55.37 2kui s GLU 428 Cb -0.11 -3.32 -0.03 0.00 -0.44 0.00 0.00 34.13 30.22 2kui s GLU 428 CO 0.01 0.43 0.95 0.42 0.95 0.00 0.00 175.26 178.02 2kui s ILE 429 N -0.43 4.83 0.34 1.83 1.01 -0.69 -4.92 121.20 123.17 2kui s ILE 429 Ca 0.32 2.00 -0.28 0.00 0.00 0.00 0.00 60.65 62.69 2kui s ILE 429 Cb -0.19 -4.29 -0.09 0.00 0.01 0.00 0.00 42.46 37.89 2kui s ILE 429 CO 0.19 0.19 1.16 -2.16 0.00 0.00 0.00 174.94 174.32 2kui s PRO 430 N 0.84 4.36 -0.43 2.79 0.04 -1.26 -4.04 135.00 137.29 2kui s PRO 430 Ca 0.50 1.87 -0.27 0.00 0.04 0.00 0.00 61.00 63.14 2kui s PRO 430 Cb -0.21 -2.95 0.02 0.00 0.04 0.00 0.00 34.50 31.40 2kui s PRO 430 CO 0.27 -0.06 1.01 0.34 0.04 0.00 0.00 177.00 178.60 2kui s ASP 431 N -0.94 6.62 -0.04 6.66 -1.08 -1.23 -4.88 116.67 121.78 2kui s ASP 431 Ca 0.50 0.41 -0.02 0.00 -0.52 0.00 0.00 52.55 52.92 2kui s ASP 431 Cb -0.32 -2.49 -0.04 0.00 -1.46 0.00 0.00 42.92 38.61 2kui s ASP 431 CO 0.42 -1.06 0.09 -0.69 0.52 0.00 0.00 175.17 174.45 2kui s VAL 432 N 3.91 4.88 0.78 1.11 1.01 -1.26 -5.08 120.40 125.75 2kui s VAL 432 Ca 0.41 -0.23 -0.14 0.00 0.00 0.00 0.00 61.98 62.02 2kui s VAL 432 Cb -0.10 -3.19 0.07 0.00 0.00 0.00 0.00 36.38 33.16 2kui s VAL 432 CO 0.25 0.45 1.22 -0.44 0.00 0.00 0.00 175.10 176.58 2kui s SER 433 N -1.47 3.75 0.45 3.32 0.01 -1.26 -4.93 113.70 113.58 2kui s SER 433 Ca 0.20 2.40 0.23 0.00 1.31 0.00 0.00 55.95 60.10 2kui s SER 433 Cb -0.12 -2.59 1.04 0.00 0.21 0.00 0.00 66.02 64.56 2kui s SER 433 CO 0.10 -2.56 1.89 0.71 0.41 0.00 0.00 173.24 173.79 2kui h THR 434 N -0.67 0.66 0.00 1.44 1.35 -1.98 -1.82 112.91 111.89 2kui h THR 434 Ca -0.47 -1.01 0.00 0.00 -0.55 0.00 0.00 66.41 64.38 2kui h THR 434 Cb 1.30 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 2kui h THR 434 CO 0.47 0.22 -0.60 0.00 -0.25 0.00 0.00 175.52 175.37 2kui n LEU 435 N -3.54 0.57 -2.27 3.87 -0.00 -1.26 -0.78 117.00 113.58 2kui n LEU 435 Ca -0.01 0.04 -0.29 0.00 -0.00 0.00 0.00 56.01 55.75 2kui n LEU 435 Cb 0.38 -0.21 0.14 0.00 -0.00 0.00 0.00 43.42 43.72 2kui n LEU 435 CO 0.33 0.08 1.36 0.41 -0.00 0.00 0.00 177.39 179.57 2kui n THR 436 N -1.69 3.40 -0.30 1.47 -1.04 -0.68 -4.64 114.28 110.80 2kui n THR 436 Ca 0.05 -2.36 0.07 0.00 -2.04 0.00 0.00 64.05 59.76 2kui n THR 436 Cb 0.37 -0.78 0.29 0.00 -1.82 0.00 0.00 70.33 68.39 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 1.44 0.98 -0.54 -1.42 3.20 -1.71 -0.35 116.97 118.59 2kui h TYR 437 Ca 0.63 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 62.48 2kui h TYR 437 Cb 1.96 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 39.89 2kui h TYR 437 CO 1.53 0.44 0.14 0.00 -1.64 0.00 0.00 178.16 178.63 2kui h ALA 438 N 1.55 1.25 -0.17 1.82 0.00 -1.94 -0.41 119.26 121.36 2kui h ALA 438 Ca 0.42 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.99 2kui h ALA 438 Cb 0.42 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2kui h ALA 438 CO -0.19 0.53 -0.53 1.49 0.00 0.00 0.00 179.25 180.55 2kui h GLU 439 N 0.79 0.49 0.05 0.00 4.57 -1.54 -2.71 114.58 116.22 2kui h GLU 439 Ca 0.18 -0.30 -0.00 0.00 -1.18 0.00 0.00 59.36 58.06 2kui h GLU 439 Cb 0.27 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.89 2kui h GLU 439 CO -0.00 0.89 -0.02 0.00 -1.18 0.00 0.00 179.01 178.70 2kui h ALA 440 N 1.05 -0.06 -0.76 2.92 0.00 -0.25 -1.93 119.26 120.22 2kui h ALA 440 Ca 0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2kui h ALA 440 Cb 1.05 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 2kui h ALA 440 CO 0.10 -0.44 0.37 -0.39 0.00 0.00 0.00 179.25 178.88 2kui h VAL 441 N -0.24 1.24 -0.43 0.00 -1.51 -1.09 -1.15 116.25 113.07 2kui h VAL 441 Ca -0.01 -0.66 -0.12 0.00 -1.23 0.00 0.00 66.70 64.68 2kui h VAL 441 Cb 0.22 0.26 -0.01 0.00 -2.13 0.00 0.00 31.29 29.62 2kui h VAL 441 CO 0.01 0.28 -0.22 0.07 -1.23 0.00 0.00 177.57 176.48 2kui h LYS 442 N 1.08 0.86 -0.71 5.19 2.10 -1.44 -2.32 116.57 121.33 2kui h LYS 442 Ca 0.26 -0.36 -0.04 0.00 -2.00 0.00 0.00 60.65 58.52 2kui h LYS 442 Cb 0.10 -0.04 -0.03 0.00 -0.90 0.00 0.00 32.23 31.36 2kui h LYS 442 CO -0.03 1.00 0.30 0.87 -2.00 0.00 0.00 179.45 179.58 2kui h LYS 443 N 0.75 1.05 -0.61 0.07 1.79 -0.71 0.14 116.57 119.05 2kui h LYS 443 Ca 0.10 -0.17 -0.05 0.00 -2.18 0.00 0.00 60.65 58.35 2kui h LYS 443 Cb 0.76 -0.18 -0.03 0.00 -1.58 0.00 0.00 32.23 31.20 2kui h LYS 443 CO 0.06 0.84 0.19 -0.07 -1.08 0.00 0.00 179.45 179.39 2kui h LEU 444 N 1.03 0.85 -0.26 2.94 3.38 -1.05 -1.45 115.31 120.75 2kui h LEU 444 Ca 0.24 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 2kui h LEU 444 Cb 0.18 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2kui h LEU 444 CO -0.02 0.80 -0.27 0.74 0.09 0.00 0.00 178.44 179.77 2kui h THR 445 N 0.89 1.31 0.00 0.22 2.02 -0.69 -0.25 112.91 116.40 2kui h THR 445 Ca 0.20 -1.45 -0.04 0.00 0.77 0.00 0.00 66.41 65.89 2kui h THR 445 Cb 0.25 1.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 2kui h THR 445 CO -0.01 0.46 -0.21 0.00 0.37 0.00 0.00 175.52 176.13 2kui h ALA 446 N 0.68 1.39 0.00 6.16 0.00 -0.46 -1.71 119.26 125.32 2kui h ALA 446 Ca 0.04 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2kui h ALA 446 Cb 0.84 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.60 2kui h ALA 446 CO 0.07 0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.58 2kui n ALA 447 N -2.38 2.28 0.00 0.00 0.00 -0.58 -4.98 120.51 114.85 2kui n ALA 447 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2kui n ALA 447 Cb 0.30 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.28 2kui n ALA 447 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 448 N 1.32 1.85 0.04 0.00 0.00 -0.64 -4.89 105.19 102.87 2kui n GLY 448 Ca 0.06 -0.51 -0.01 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.04 -3.03 1.61 -1.74 -1.25 -4.75 117.46 108.27 2kui n PHE 449 Ca 0.00 0.11 -0.23 0.00 -0.56 0.00 0.00 57.45 56.78 2kui n PHE 449 Cb 0.00 -0.43 0.04 0.00 1.52 0.00 0.00 39.48 40.60 2kui n PHE 449 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2kui n GLY 450 N -1.02 -0.52 3.33 4.97 0.00 -0.12 -4.85 105.19 106.97 2kui n GLY 450 Ca 0.00 0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 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 -5.71 2.79 -0.01 1.61 1.81 -1.26 -4.78 118.95 113.40 2kui s ARG 451 Ca 0.31 -1.08 -0.06 0.00 -1.72 0.00 0.00 55.73 53.18 2kui s ARG 451 Cb -0.14 -3.56 0.00 0.00 -0.45 0.00 0.00 34.95 30.81 2kui s ARG 451 CO 0.38 -0.64 0.12 -0.59 -0.68 0.00 0.00 175.30 173.89 2kui s PHE 452 N 1.48 -0.00 0.05 -0.53 -0.12 -1.26 -0.90 117.98 116.70 2kui s PHE 452 Ca 0.01 0.00 0.04 0.00 -0.05 0.00 0.00 56.93 56.93 2kui s PHE 452 Cb -0.19 -0.03 -0.03 0.00 -0.63 0.00 0.00 43.02 42.15 2kui s PHE 452 CO 0.04 -0.21 -0.13 0.15 -0.05 0.00 0.00 175.22 175.03 2kui s LYS 453 N -0.90 0.79 -0.16 1.99 -0.14 0.42 -4.92 119.74 116.81 2kui s LYS 453 Ca -0.10 -0.83 -0.01 0.00 -1.36 0.00 0.00 55.97 53.66 2kui s LYS 453 Cb -0.06 -0.76 -0.01 0.00 -1.68 0.00 0.00 37.83 35.33 2kui s LYS 453 CO 0.01 0.17 -0.10 -1.14 -0.76 0.00 0.00 175.35 173.53 2kui s GLN 454 N -1.47 3.36 -0.03 1.68 0.74 -1.26 -0.22 119.66 122.46 2kui s GLN 454 Ca -0.02 -0.67 0.05 0.00 0.05 0.00 0.00 55.36 54.77 2kui s GLN 454 Cb -0.09 -2.76 -0.01 0.00 1.10 0.00 0.00 33.01 31.25 2kui s GLN 454 CO 0.02 0.05 -0.17 0.00 -0.55 0.00 0.00 175.29 174.63 2kui s ALA 455 N 0.79 1.50 0.02 1.58 0.00 0.10 -4.93 121.76 120.83 2kui s ALA 455 Ca -0.04 -0.72 0.06 0.00 0.00 0.00 0.00 51.96 51.26 2kui s ALA 455 Cb -0.15 -0.45 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 2kui s ALA 455 CO 0.01 0.31 -0.14 0.54 0.00 0.00 0.00 175.76 176.48 2kui s ASN 456 N -0.15 4.10 -0.03 0.00 2.20 -1.26 0.14 114.94 119.94 2kui s ASN 456 Ca 0.01 -0.32 -0.13 0.00 -0.94 0.00 0.00 52.86 51.48 2kui s ASN 456 Cb -0.10 -0.78 0.02 0.00 -2.00 0.00 0.00 41.25 38.39 2kui s ASN 456 CO 0.01 0.27 0.28 -0.44 -2.94 0.00 0.00 177.10 174.28 2kui s SER 457 N -1.41 -0.18 0.08 3.54 0.01 -0.87 -4.93 113.70 109.95 2kui s SER 457 Ca 0.15 0.12 -0.31 0.00 1.31 0.00 0.00 55.95 57.22 2kui s SER 457 Cb -0.11 0.34 -0.09 0.00 0.21 0.00 0.00 66.02 66.38 2kui s SER 457 CO 0.06 -0.39 1.66 -2.16 0.41 0.00 0.00 173.24 172.82 2kui s PRO 458 N -1.13 4.19 0.40 12.44 0.04 -1.24 -0.71 135.00 148.99 2kui s PRO 458 Ca -0.12 2.36 0.05 0.00 0.04 0.00 0.00 61.00 63.33 2kui s PRO 458 Cb -0.05 -3.56 -0.02 0.00 0.04 0.00 0.00 34.50 30.91 2kui s PRO 458 CO 0.03 -0.73 0.19 -1.12 0.04 0.00 0.00 177.00 175.41 2kui s SER 459 N 2.33 2.52 0.33 6.66 0.01 0.55 -4.83 113.70 121.26 2kui s SER 459 Ca 0.74 -1.75 -0.29 0.00 1.31 0.00 0.00 55.95 55.96 2kui s SER 459 Cb -0.41 0.59 -0.12 0.00 0.21 0.00 0.00 66.02 66.30 2kui s SER 459 CO 0.33 -1.02 1.52 1.07 0.41 0.00 0.00 173.24 175.55 2kui n THR 460 N -0.85 1.48 -0.15 1.44 5.66 -1.26 -4.65 114.28 115.94 2kui n THR 460 Ca -0.02 -0.37 0.28 0.00 -3.05 0.00 0.00 64.05 60.89 2kui n THR 460 Cb 0.64 -1.91 0.72 0.00 -1.55 0.00 0.00 70.33 68.23 2kui n THR 460 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2kui h PRO 461 N 3.86 0.00 0.00 1.09 0.13 -1.91 0.80 132.00 135.97 2kui h PRO 461 Ca -0.48 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 2kui h PRO 461 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 2kui h PRO 461 CO 0.72 0.00 -0.23 1.05 -0.23 0.00 0.00 178.00 179.30 2kui h GLU 462 N 0.00 0.00 -0.02 0.86 4.11 -1.94 -2.93 114.58 114.66 2kui h GLU 462 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.83 2kui h GLU 462 Cb 1.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.90 2kui h GLU 462 CO -0.00 0.23 -0.31 1.28 0.07 0.00 0.00 179.01 180.28 2kui n LEU 463 N -3.34 2.22 -4.71 3.06 4.77 0.24 -4.95 117.00 114.29 2kui n LEU 463 Ca 0.01 -0.84 -0.42 0.00 -0.03 0.00 0.00 56.01 54.73 2kui n LEU 463 Cb 0.47 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.53 2kui n LEU 463 CO 0.34 0.40 1.40 -0.69 -1.33 0.00 0.00 177.39 177.51 2kui s VAL 464 N -2.19 2.12 0.00 4.08 1.01 -1.01 -1.58 120.40 122.84 2kui s VAL 464 Ca 0.20 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.19 2kui s VAL 464 Cb 0.17 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.55 2kui s VAL 464 CO 0.45 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.16 2kui n GLY 465 N 4.04 0.64 3.69 4.51 0.00 0.23 -4.98 105.19 113.32 2kui n GLY 465 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 2kui n GLY 465 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kui s LYS 466 N -0.98 2.21 0.41 1.61 3.01 -0.61 -4.91 119.74 120.48 2kui s LYS 466 Ca 0.00 -1.69 -0.24 0.00 -1.01 0.00 0.00 55.97 53.03 2kui s LYS 466 Cb 0.00 -2.03 -0.09 0.00 -1.01 0.00 0.00 37.83 34.70 2kui s LYS 466 CO 0.00 0.08 1.07 0.08 0.51 0.00 0.00 175.35 177.09 2kui s VAL 467 N -2.50 3.63 -0.20 3.17 1.01 0.04 -0.49 120.40 125.05 2kui s VAL 467 Ca 0.37 1.23 0.09 0.00 0.00 0.00 0.00 61.98 63.66 2kui s VAL 467 Cb -0.00 -3.63 -0.22 0.00 0.00 0.00 0.00 36.38 32.53 2kui s VAL 467 CO 0.21 -0.01 0.03 -0.38 0.00 0.00 0.00 175.10 174.95 2kui n ILE 468 N -0.17 1.49 -0.18 2.22 2.08 0.86 -4.76 119.36 120.90 2kui n ILE 468 Ca 0.06 -0.71 0.00 0.00 0.56 0.00 0.00 62.75 62.65 2kui n ILE 468 Cb 0.49 -1.03 0.00 0.00 -0.75 0.00 0.00 39.64 38.35 2kui n ILE 468 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2kui n GLY 469 N 1.97 -2.02 3.45 7.39 0.00 -1.14 -5.04 105.19 109.80 2kui n GLY 469 Ca -0.37 -1.17 -0.32 0.00 0.00 0.00 0.00 46.02 44.17 2kui n GLY 469 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 470 N -2.05 2.86 -0.01 2.61 -4.23 -1.26 -1.45 115.64 112.10 2kui s THR 470 Ca 0.00 -0.93 -0.24 0.00 -1.18 0.00 0.00 61.69 59.34 2kui s THR 470 Cb 0.00 -2.14 -0.17 0.00 1.34 0.00 0.00 72.50 71.54 2kui s THR 470 CO 0.00 0.50 1.13 -1.13 -0.54 0.00 0.00 174.62 174.58 2kui h ASN 471 N 5.06 -0.24 -3.78 3.99 -0.73 -1.22 -3.42 115.58 115.25 2kui h ASN 471 Ca -0.46 -0.27 -0.50 0.00 1.87 0.00 0.00 56.30 56.93 2kui h ASN 471 Cb 1.15 0.06 0.00 0.00 0.27 0.00 0.00 38.32 39.80 2kui h ASN 471 CO 0.49 0.20 0.43 -2.84 -0.37 0.00 0.00 177.43 175.33 2kui s PRO 472 N -4.23 4.73 0.12 6.67 0.02 -1.26 -4.96 135.00 136.08 2kui s PRO 472 Ca -0.14 1.68 -0.31 0.00 0.02 0.00 0.00 61.00 62.25 2kui s PRO 472 Cb 0.02 -3.23 -0.10 0.00 0.02 0.00 0.00 34.50 31.21 2kui s PRO 472 CO 0.54 0.33 1.69 -1.25 -0.33 0.00 0.00 177.00 177.99 2kui s PRO 473 N -1.31 4.18 -0.07 5.54 0.04 -1.26 -4.85 135.00 137.26 2kui s PRO 473 Ca 0.43 2.44 0.05 0.00 0.04 0.00 0.00 61.00 63.96 2kui s PRO 473 Cb -0.30 -3.44 0.26 0.00 0.04 0.00 0.00 34.50 31.07 2kui s PRO 473 CO 0.37 -0.74 0.93 0.00 0.04 0.00 0.00 177.00 177.61 2kui n ALA 474 N 5.08 2.91 0.32 8.56 0.00 -1.26 -2.56 120.51 133.55 2kui n ALA 474 Ca 0.16 -0.61 0.05 0.00 0.00 0.00 0.00 53.44 53.04 2kui n ALA 474 Cb 0.39 -1.04 -0.07 0.00 0.00 0.00 0.00 19.45 18.73 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 0.20 1.23 -4.97 0.00 5.03 -1.26 -3.57 115.26 111.93 2kui n ASN 475 Ca 0.09 -0.48 -0.21 0.00 0.87 0.00 0.00 54.58 54.85 2kui n ASN 475 Cb 0.53 1.18 0.03 0.00 -1.02 0.00 0.00 39.78 40.50 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 -2.28 2.64 -0.48 3.52 -1.52 -1.06 -4.56 119.66 115.93 2kui s GLN 476 Ca 0.01 -0.72 -0.27 0.00 -1.95 0.00 0.00 55.36 52.43 2kui s GLN 476 Cb 0.08 -2.50 0.03 0.00 -0.22 0.00 0.00 33.01 30.40 2kui s GLN 476 CO 0.44 -0.63 1.03 0.99 -0.25 0.00 0.00 175.29 176.87 2kui s THR 477 N -2.73 4.33 0.00 -0.19 2.01 -1.26 -1.71 115.64 116.09 2kui s THR 477 Ca 0.56 0.92 0.00 0.00 0.31 0.00 0.00 61.69 63.47 2kui s THR 477 Cb -0.10 -4.53 -0.04 0.00 0.01 0.00 0.00 72.50 67.84 2kui s THR 477 CO 0.38 -0.96 0.07 -0.44 -0.69 0.00 0.00 174.62 172.98 2kui s SER 478 N 2.43 5.59 0.71 3.53 0.01 0.13 -4.85 113.70 121.24 2kui s SER 478 Ca 0.41 0.11 -0.07 0.00 1.31 0.00 0.00 55.95 57.71 2kui s SER 478 Cb -0.09 -1.58 0.06 0.00 0.21 0.00 0.00 66.02 64.62 2kui s SER 478 CO 0.28 0.26 1.03 0.00 0.41 0.00 0.00 173.24 175.22 2kui s ALA 479 N -1.20 3.10 -0.90 1.44 0.00 -1.26 -0.88 121.76 122.07 2kui s ALA 479 Ca 0.23 -0.86 0.19 0.00 0.00 0.00 0.00 51.96 51.53 2kui s ALA 479 Cb -0.12 -2.66 0.81 0.00 0.00 0.00 0.00 23.12 21.16 2kui s ALA 479 CO 0.14 -1.30 1.61 -0.89 0.00 0.00 0.00 175.76 175.32 2kui n ILE 480 N -2.94 0.76 0.48 0.00 2.08 -1.26 -1.71 119.36 116.76 2kui n ILE 480 Ca 0.08 0.17 0.11 0.00 0.56 0.00 0.00 62.75 63.67 2kui n ILE 480 Cb 0.60 -0.91 0.25 0.00 -0.75 0.00 0.00 39.64 38.83 2kui n ILE 480 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 2kui n THR 481 N -1.67 0.46 -2.76 1.39 -2.24 -1.26 -4.07 114.28 104.12 2kui n THR 481 Ca 0.04 -0.67 -0.42 0.00 -2.27 0.00 0.00 64.05 60.73 2kui n THR 481 Cb 0.23 0.84 -0.03 0.00 -2.10 0.00 0.00 70.33 69.26 2kui n THR 481 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2kui s ASN 482 N -1.48 7.29 -0.19 3.42 -0.87 -0.70 -5.04 114.94 117.38 2kui s ASN 482 Ca 0.38 1.57 -0.05 0.00 -1.57 0.00 0.00 52.86 53.19 2kui s ASN 482 Cb 0.22 -2.54 -0.02 0.00 -0.02 0.00 0.00 41.25 38.88 2kui s ASN 482 CO 0.30 -0.25 -0.01 0.54 -2.57 0.00 0.00 177.10 175.11 2kui s VAL 483 N 1.07 3.94 -0.25 1.60 0.11 -1.26 -4.30 120.40 121.31 2kui s VAL 483 Ca 0.49 -0.32 -0.07 0.00 -2.93 0.00 0.00 61.98 59.15 2kui s VAL 483 Cb -0.20 -2.77 -0.03 0.00 -1.53 0.00 0.00 36.38 31.85 2kui s VAL 483 CO 0.25 0.44 0.07 0.68 -3.33 0.00 0.00 175.10 173.22 2kui s VAL 484 N 0.84 4.33 -0.24 2.04 -7.23 -0.08 -4.87 120.40 115.19 2kui s VAL 484 Ca 0.00 -0.16 -0.17 0.00 -1.81 0.00 0.00 61.98 59.83 2kui s VAL 484 Cb -0.14 -3.02 -0.03 0.00 0.56 0.00 0.00 36.38 33.74 2kui s VAL 484 CO 0.02 0.34 0.48 -0.51 -0.31 0.00 0.00 175.10 175.13 2kui s ILE 485 N 1.56 5.11 -0.14 -0.62 -1.16 -1.26 -0.44 121.20 124.25 2kui s ILE 485 Ca 0.06 0.84 -0.00 0.00 -0.51 0.00 0.00 60.65 61.04 2kui s ILE 485 Cb -0.15 -3.80 -0.01 0.00 0.61 0.00 0.00 42.46 39.10 2kui s ILE 485 CO 0.04 0.13 -0.13 -0.63 -2.81 0.00 0.00 174.94 171.54 2kui s ILE 486 N 2.02 3.00 -0.22 2.00 1.01 0.69 -0.57 121.20 129.14 2kui s ILE 486 Ca 0.21 -0.67 -0.09 0.00 0.00 0.00 0.00 60.65 60.09 2kui s ILE 486 Cb -0.15 -2.27 -0.04 0.00 0.01 0.00 0.00 42.46 40.00 2kui s ILE 486 CO 0.09 0.52 0.12 -0.51 0.00 0.00 0.00 174.94 175.15 2kui s ILE 487 N 0.48 5.07 0.11 2.92 2.07 -0.53 0.01 121.20 131.33 2kui s ILE 487 Ca -0.09 0.07 0.05 0.00 -1.41 0.00 0.00 60.65 59.27 2kui s ILE 487 Cb -0.16 -3.33 -0.04 0.00 0.13 0.00 0.00 42.46 39.06 2kui s ILE 487 CO 0.04 0.39 0.02 0.68 -1.91 0.00 0.00 174.94 174.17 2kui s VAL 488 N 0.83 4.08 -0.06 4.00 -7.23 0.12 -0.10 120.40 122.03 2kui s VAL 488 Ca 0.06 -1.05 -0.26 0.00 -1.81 0.00 0.00 61.98 58.92 2kui s VAL 488 Cb -0.13 -2.98 -0.03 0.00 0.56 0.00 0.00 36.38 33.80 2kui s VAL 488 CO 0.02 0.05 0.81 -0.83 -0.31 0.00 0.00 175.10 174.85 2kui s GLY 489 N -2.52 2.62 0.18 2.32 0.00 0.36 -2.05 107.32 108.22 2kui s GLY 489 Ca 0.27 0.24 0.05 0.00 0.00 0.00 0.00 44.72 45.29 2kui s GLY 489 CO 0.19 1.42 -0.10 -0.56 0.00 0.00 0.00 173.10 174.05 2kui s SER 490 N 0.92 2.07 0.00 1.64 0.01 0.12 -0.60 113.70 117.86 2kui s SER 490 Ca 0.42 -1.04 0.00 0.00 1.31 0.00 0.00 55.95 56.64 2kui s SER 490 Cb -0.19 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 65.99 2kui s SER 490 CO 0.20 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 174.16 2kui n GLY 491 N -0.29 1.53 3.91 3.44 0.00 -1.26 -0.33 105.19 112.19 2kui n GLY 491 Ca -0.09 -1.41 -0.28 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.87 3.59 -0.93 1.61 0.04 -1.26 -4.98 135.00 131.20 2kui s PRO 492 Ca 0.00 -0.10 -0.02 0.00 0.04 0.00 0.00 61.00 60.92 2kui s PRO 492 Cb 0.00 -2.67 0.25 0.00 0.04 0.00 0.00 34.50 32.11 2kui s PRO 492 CO 0.00 0.22 0.95 0.00 0.04 0.00 0.00 177.00 178.21 2kui n ALA 493 N -1.06 4.14 -2.41 8.56 0.00 -1.26 -4.58 120.51 123.90 2kui n ALA 493 Ca -0.03 -4.67 -0.30 0.00 0.00 0.00 0.00 53.44 48.44 2kui n ALA 493 Cb 0.54 -1.81 -0.14 0.00 0.00 0.00 0.00 19.45 18.04 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 -1.76 2.51 0.18 0.00 -4.23 -1.26 -0.65 115.64 110.42 2kui s THR 494 Ca 0.30 -1.28 -0.12 0.00 -1.18 0.00 0.00 61.69 59.41 2kui s THR 494 Cb -0.03 -2.03 0.00 0.00 1.34 0.00 0.00 72.50 71.79 2kui s THR 494 CO -0.07 0.34 0.36 -0.54 -0.54 0.00 0.00 174.62 174.18 2kui s LYS 495 N -1.37 1.23 0.09 3.99 -0.14 0.05 -4.92 119.74 118.67 2kui s LYS 495 Ca 0.13 -1.07 -0.30 0.00 -1.36 0.00 0.00 55.97 53.37 2kui s LYS 495 Cb -0.10 0.43 -0.05 0.00 -1.68 0.00 0.00 37.83 36.42 2kui s LYS 495 CO 0.04 -0.48 0.97 -0.51 -0.76 0.00 0.00 175.35 174.61 2kui s ASP 496 N -2.94 7.46 0.09 2.83 1.11 -1.26 -0.79 116.67 123.17 2kui s ASP 496 Ca 0.15 1.78 -0.30 0.00 0.18 0.00 0.00 52.55 54.36 2kui s ASP 496 Cb 0.02 -2.59 -0.05 0.00 1.07 0.00 0.00 42.92 41.37 2kui s ASP 496 CO -0.01 -0.11 1.01 0.27 1.18 0.00 0.00 175.17 177.51 2kui s ILE 497 N 0.19 4.47 0.96 0.77 -4.36 0.11 -4.86 121.20 118.48 2kui s ILE 497 Ca 0.48 1.95 -0.16 0.00 -0.26 0.00 0.00 60.65 62.66 2kui s ILE 497 Cb -0.23 -4.25 0.22 0.00 1.25 0.00 0.00 42.46 39.46 2kui s ILE 497 CO 0.30 0.25 1.25 -0.81 0.24 0.00 0.00 174.94 176.16 2kui n PRO 498 N 3.12 -1.45 -4.44 0.37 -0.04 -1.26 -0.60 135.00 130.70 2kui n PRO 498 Ca 0.04 -1.93 -0.34 0.00 -0.04 0.00 0.00 63.50 61.23 2kui n PRO 498 Cb 0.49 -1.34 -0.10 0.00 -0.04 0.00 0.00 33.50 32.51 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 -5.49 4.96 -0.26 3.54 -4.77 -1.26 -4.65 116.67 108.73 2kui s ASP 499 Ca 0.71 0.03 -0.03 0.00 -3.30 0.00 0.00 52.55 49.96 2kui s ASP 499 Cb -0.02 -1.30 0.11 0.00 -1.09 0.00 0.00 42.92 40.61 2kui s ASP 499 CO 0.51 0.34 0.21 0.54 0.70 0.00 0.00 175.17 177.47 2kui s VAL 500 N -0.92 -0.26 -0.22 2.11 0.11 -1.26 -5.09 120.40 114.88 2kui s VAL 500 Ca 0.15 -0.44 -0.04 0.00 -2.93 0.00 0.00 61.98 58.72 2kui s VAL 500 Cb -0.11 -0.87 0.08 0.00 -1.53 0.00 0.00 36.38 33.96 2kui s VAL 500 CO 0.04 -0.46 0.15 0.00 -3.33 0.00 0.00 175.10 171.50 2kui s ALA 501 N 2.26 0.25 0.00 1.54 0.00 -1.26 -3.13 121.76 121.41 2kui s ALA 501 Ca 0.08 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.66 2kui s ALA 501 Cb -0.15 -1.25 0.00 0.00 0.00 0.00 0.00 23.12 21.72 2kui s ALA 501 CO -0.26 -1.34 0.00 0.41 0.00 0.00 0.00 175.76 174.56 2kui n GLY 502 N 5.28 1.76 3.97 0.00 0.00 -0.11 -5.01 105.19 111.08 2kui n GLY 502 Ca -0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.72 2kui n GLY 502 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kui s GLN 503 N 0.00 1.99 0.35 1.61 -0.21 -1.26 -4.77 119.66 117.37 2kui s GLN 503 Ca 0.00 -0.74 -0.03 0.00 0.02 0.00 0.00 55.36 54.61 2kui s GLN 503 Cb 0.00 -2.30 -0.04 0.00 1.00 0.00 0.00 33.01 31.67 2kui s GLN 503 CO 0.00 -1.25 0.61 -0.08 -2.12 0.00 0.00 175.29 172.45 2kui s THR 504 N -3.11 5.02 0.27 -0.19 -1.32 -1.26 -0.16 115.64 114.89 2kui s THR 504 Ca 0.63 -0.09 0.01 0.00 -1.21 0.00 0.00 61.69 61.03 2kui s THR 504 Cb -0.08 -3.81 0.26 0.00 -1.51 0.00 0.00 72.50 67.36 2kui s THR 504 CO 0.43 -0.53 1.80 1.62 -2.21 0.00 0.00 174.62 175.73 2kui h VAL 505 N 0.89 0.82 -0.68 5.08 3.04 -1.13 0.11 116.25 124.37 2kui h VAL 505 Ca -0.48 -0.27 -0.03 0.00 -1.01 0.00 0.00 66.70 64.90 2kui h VAL 505 Cb 1.20 -0.06 -0.03 0.00 -2.01 0.00 0.00 31.29 30.40 2kui h VAL 505 CO 0.63 0.15 0.31 -0.78 -1.01 0.00 0.00 177.57 176.87 2kui h ASP 506 N 0.80 0.90 -0.04 3.17 3.58 -1.94 -1.22 116.42 121.68 2kui h ASP 506 Ca 0.49 -0.14 -0.18 0.00 0.42 0.00 0.00 57.03 57.62 2kui h ASP 506 Cb 0.60 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 41.42 2kui h ASP 506 CO -0.32 0.79 -0.60 0.58 -2.88 0.00 0.00 179.24 176.81 2kui h VAL 507 N 0.95 1.31 -0.08 2.25 2.07 -1.71 -2.67 116.25 118.37 2kui h VAL 507 Ca 0.23 -1.85 -0.00 0.00 0.82 0.00 0.00 66.70 65.90 2kui h VAL 507 Cb 0.14 1.81 -0.00 0.00 -1.52 0.00 0.00 31.29 31.71 2kui h VAL 507 CO -0.03 0.58 0.04 0.00 0.02 0.00 0.00 177.57 178.19 2kui h ALA 508 N 0.85 0.10 -0.31 1.67 0.00 -0.68 -0.89 119.26 120.01 2kui h ALA 508 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2kui h ALA 508 Cb 1.17 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 2kui h ALA 508 CO 0.12 -0.36 0.20 1.96 0.00 0.00 0.00 179.25 181.16 2kui h GLN 509 N 0.04 0.41 -0.00 0.00 4.20 -1.23 -2.78 115.11 115.75 2kui h GLN 509 Ca 0.03 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 2kui h GLN 509 Cb 0.07 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 2kui h GLN 509 CO -0.00 0.28 0.00 -0.22 -0.67 0.00 0.00 178.83 178.22 2kui h LYS 510 N 0.41 0.00 -0.63 1.46 1.63 -1.31 -1.36 116.57 116.77 2kui h LYS 510 Ca 0.11 -0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.87 2kui h LYS 510 Cb -0.03 -0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.57 2kui h LYS 510 CO -0.02 0.27 0.23 -2.95 -3.45 0.00 0.00 179.45 173.53 2kui h ASN 511 N -0.27 0.86 -0.56 4.20 7.08 -1.16 0.34 115.58 126.07 2kui h ASN 511 Ca 0.00 -0.13 -0.03 0.00 -3.08 0.00 0.00 56.30 53.07 2kui h ASN 511 Cb 0.27 -0.22 -0.03 0.00 -2.08 0.00 0.00 38.32 36.26 2kui h ASN 511 CO 0.00 0.79 0.25 -0.07 -2.08 0.00 0.00 177.43 176.32 2kui h LEU 512 N 0.92 0.75 -0.97 6.14 -0.00 -1.39 -1.82 115.31 118.92 2kui h LEU 512 Ca 0.21 -0.15 -0.04 0.00 -0.00 0.00 0.00 57.88 57.90 2kui h LEU 512 Cb 0.21 -0.19 -0.03 0.00 -0.00 0.00 0.00 40.66 40.65 2kui h LEU 512 CO -0.01 0.69 0.26 0.78 -0.00 0.00 0.00 178.44 180.16 2kui h ASN 513 N 0.76 0.92 -0.26 -0.43 -0.26 -0.20 -0.73 115.58 115.37 2kui h ASN 513 Ca 0.19 -0.13 -0.04 0.00 -0.56 0.00 0.00 56.30 55.76 2kui h ASN 513 Cb 0.15 -0.24 -0.02 0.00 -1.06 0.00 0.00 38.32 37.16 2kui h ASN 513 CO -0.02 0.83 0.06 0.58 -1.06 0.00 0.00 177.43 177.82 2kui h VAL 514 N 0.98 1.17 -0.07 2.81 2.07 -0.63 -1.68 116.25 120.90 2kui h VAL 514 Ca 0.23 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2kui h VAL 514 Cb 0.20 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 2kui h VAL 514 CO -0.02 0.22 0.00 -1.22 0.02 0.00 0.00 177.57 176.58 2kui n TYR 515 N -4.33 0.08 0.00 1.57 4.01 -0.59 -4.87 117.16 113.03 2kui n TYR 515 Ca 0.02 -0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 2kui n TYR 515 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.23 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 1.00 2.79 3.55 2.72 0.00 -0.63 -4.99 105.19 109.63 2kui n GLY 516 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.48 2.15 -0.47 1.61 0.08 -0.38 -4.59 117.98 113.89 2kui s PHE 517 Ca 0.00 0.08 0.23 0.00 0.12 0.00 0.00 56.93 57.37 2kui s PHE 517 Cb 0.00 -4.49 0.20 0.00 -0.57 0.00 0.00 43.02 38.15 2kui s PHE 517 CO 0.00 -2.10 1.21 1.15 -0.10 0.00 0.00 175.22 175.38 2kui h THR 518 N 6.35 0.00 -3.37 0.64 2.02 -1.67 -2.94 112.91 113.94 2kui h THR 518 Ca -0.21 -0.71 -0.66 0.00 0.77 0.00 0.00 66.41 65.60 2kui h THR 518 Cb 1.07 1.27 -0.27 0.00 -1.74 0.00 0.00 68.15 68.47 2kui h THR 518 CO 1.28 0.00 -0.73 -0.54 0.37 0.00 0.00 175.52 175.90 2kui s LYS 519 N -3.25 3.39 0.10 6.66 1.02 -1.26 -4.96 119.74 121.44 2kui s LYS 519 Ca 0.04 -0.63 0.06 0.00 0.02 0.00 0.00 55.97 55.45 2kui s LYS 519 Cb 0.12 -2.94 -0.03 0.00 -0.52 0.00 0.00 37.83 34.45 2kui s LYS 519 CO 0.75 -0.11 -0.14 -0.59 -0.92 0.00 0.00 175.35 174.34 2kui s PHE 520 N 1.23 1.34 0.03 3.18 -0.12 -1.26 -1.06 117.98 121.32 2kui s PHE 520 Ca 0.03 -0.51 -0.02 0.00 -0.05 0.00 0.00 56.93 56.37 2kui s PHE 520 Cb -0.14 -0.72 -0.02 0.00 -0.63 0.00 0.00 43.02 41.50 2kui s PHE 520 CO -0.02 0.11 0.02 -1.12 -0.05 0.00 0.00 175.22 174.16 2kui s SER 521 N -2.12 0.24 0.14 1.98 0.01 -0.47 -4.89 113.70 108.59 2kui s SER 521 Ca 0.04 -0.55 0.10 0.00 1.31 0.00 0.00 55.95 56.84 2kui s SER 521 Cb -0.07 0.16 -0.04 0.00 0.21 0.00 0.00 66.02 66.27 2kui s SER 521 CO 0.03 -0.40 -0.19 0.00 0.41 0.00 0.00 173.24 173.08 2kui s GLN 522 N -2.10 1.71 -0.11 12.44 -2.07 -1.26 -0.25 119.66 128.03 2kui s GLN 522 Ca -0.10 -1.27 -0.01 0.00 -1.82 0.00 0.00 55.36 52.17 2kui s GLN 522 Cb -0.05 -2.05 0.03 0.00 -1.09 0.00 0.00 33.01 29.86 2kui s GLN 522 CO -0.03 0.46 -0.03 0.00 -1.32 0.00 0.00 175.29 174.37 2kui s ALA 523 N -1.26 1.01 -0.08 2.60 0.00 0.50 -4.90 121.76 119.63 2kui s ALA 523 Ca 0.18 -0.38 -0.24 0.00 0.00 0.00 0.00 51.96 51.52 2kui s ALA 523 Cb -0.10 -0.88 -0.03 0.00 0.00 0.00 0.00 23.12 22.11 2kui s ALA 523 CO 0.10 -0.54 0.74 -1.54 0.00 0.00 0.00 175.76 174.52 2kui s SER 524 N 1.84 7.00 0.20 0.00 1.04 -1.26 -0.08 113.70 122.43 2kui s SER 524 Ca 0.04 1.21 0.07 0.00 0.48 0.00 0.00 55.95 57.75 2kui s SER 524 Cb -0.13 -2.43 -0.05 0.00 0.10 0.00 0.00 66.02 63.52 2kui s SER 524 CO -0.07 -0.17 -0.14 0.68 0.98 0.00 0.00 173.24 174.52 2kui s VAL 525 N 1.04 1.65 0.21 5.02 -7.23 0.00 -4.91 120.40 116.19 2kui s VAL 525 Ca 0.38 -2.19 -0.30 0.00 -1.81 0.00 0.00 61.98 58.06 2kui s VAL 525 Cb -0.18 -2.02 -0.08 0.00 0.56 0.00 0.00 36.38 34.66 2kui s VAL 525 CO 0.18 -0.62 1.18 1.51 -0.31 0.00 0.00 175.10 177.04 2kui s ASP 526 N -3.30 7.10 0.14 4.85 -4.77 -1.26 -0.34 116.67 119.10 2kui s ASP 526 Ca 0.22 2.26 -0.15 0.00 -3.30 0.00 0.00 52.55 51.58 2kui s ASP 526 Cb -0.00 -2.61 0.02 0.00 -1.09 0.00 0.00 42.92 39.24 2kui s ASP 526 CO 0.06 -0.34 0.39 -0.44 0.70 0.00 0.00 175.17 175.54 2kui s SER 527 N -0.08 -0.16 0.00 2.11 0.01 0.11 -4.76 113.70 110.93 2kui s SER 527 Ca 0.51 -0.47 0.29 0.00 1.31 0.00 0.00 55.95 57.59 2kui s SER 527 Cb -0.33 0.48 1.38 0.00 0.21 0.00 0.00 66.02 67.76 2kui s SER 527 CO 0.38 -0.90 1.94 -2.65 0.41 0.00 0.00 173.24 172.42 2kui n PRO 528 N -0.23 0.96 -3.05 12.44 -0.02 -1.26 -4.00 135.00 139.83 2kui n PRO 528 Ca -0.13 -0.32 -0.35 0.00 -2.02 0.00 0.00 63.50 60.68 2kui n PRO 528 Cb 0.63 -1.49 -0.06 0.00 -0.02 0.00 0.00 33.50 32.56 2kui n PRO 528 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2kui s ARG 529 N -2.25 4.25 0.83 -0.52 1.81 -1.26 -4.97 118.95 116.84 2kui s ARG 529 Ca 0.36 0.91 -0.11 0.00 -1.72 0.00 0.00 55.73 55.16 2kui s ARG 529 Cb 0.21 -2.76 0.09 0.00 -0.45 0.00 0.00 34.95 32.04 2kui s ARG 529 CO 0.42 0.32 1.09 -2.14 -0.68 0.00 0.00 175.30 174.31 2kui s PRO 530 N -2.21 1.78 0.09 3.54 0.02 -1.26 -2.85 135.00 134.11 2kui s PRO 530 Ca 0.47 0.99 -0.33 0.00 0.02 0.00 0.00 61.00 62.15 2kui s PRO 530 Cb -0.15 -1.86 -0.12 0.00 0.02 0.00 0.00 34.50 32.39 2kui s PRO 530 CO 0.20 -1.93 1.75 0.00 -0.33 0.00 0.00 177.00 176.70 2kui n ALA 531 N -3.69 1.64 0.00 -1.55 0.00 -1.26 -2.37 120.51 113.28 2kui n ALA 531 Ca 0.08 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.88 2kui n ALA 531 Cb 0.54 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.51 2kui n ALA 531 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 532 N 3.97 2.13 3.78 0.00 0.00 -1.21 -5.02 105.19 108.84 2kui n GLY 532 Ca 0.19 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 -0.17 4.45 -0.25 1.61 2.56 -1.00 -0.58 118.70 125.33 2kui s GLU 533 Ca 0.00 1.41 -0.15 0.00 0.00 0.00 0.00 54.97 56.22 2kui s GLU 533 Cb 0.00 -2.73 -0.04 0.00 2.00 0.00 0.00 34.13 33.37 2kui s GLU 533 CO 0.00 0.14 0.39 0.08 -0.56 0.00 0.00 175.26 175.31 2kui s VAL 534 N -1.62 5.17 0.10 3.70 1.01 0.77 0.11 120.40 129.64 2kui s VAL 534 Ca 0.52 0.64 -0.14 0.00 0.00 0.00 0.00 61.98 63.01 2kui s VAL 534 Cb -0.20 -3.72 -0.14 0.00 0.00 0.00 0.00 36.38 32.32 2kui s VAL 534 CO 0.26 0.18 1.33 0.74 0.00 0.00 0.00 175.10 177.60 2kui h THR 535 N 5.29 1.29 0.00 3.92 2.02 -0.75 -0.27 112.91 124.41 2kui h THR 535 Ca -0.33 -1.84 0.00 0.00 0.77 0.00 0.00 66.41 65.01 2kui h THR 535 Cb 1.16 1.89 0.00 0.00 -1.74 0.00 0.00 68.15 69.46 2kui h THR 535 CO 0.67 0.58 0.00 0.61 0.37 0.00 0.00 175.52 177.76 2kui n GLY 536 N 0.57 -0.51 3.43 2.16 0.00 -0.99 -4.56 105.19 105.30 2kui n GLY 536 Ca -0.06 -0.97 -0.28 0.00 0.00 0.00 0.00 46.02 44.70 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 -3.27 2.47 -0.06 2.61 -4.23 -1.26 -0.07 115.64 111.83 2kui s THR 537 Ca 0.00 -1.80 -0.21 0.00 -1.18 0.00 0.00 61.69 58.50 2kui s THR 537 Cb 0.00 -2.15 -0.16 0.00 1.34 0.00 0.00 72.50 71.54 2kui s THR 537 CO 0.00 0.00 0.85 -1.13 -0.54 0.00 0.00 174.62 173.80 2kui h ASN 538 N 3.53 -0.17 -3.90 3.99 -1.24 -1.44 -3.43 115.58 112.92 2kui h ASN 538 Ca -0.49 -0.36 -0.50 0.00 0.71 0.00 0.00 56.30 55.66 2kui h ASN 538 Cb 1.19 0.04 0.02 0.00 0.73 0.00 0.00 38.32 40.30 2kui h ASN 538 CO 0.45 0.39 0.45 -2.16 -1.29 0.00 0.00 177.43 175.27 2kui s PRO 539 N -3.34 4.34 0.58 6.67 0.04 -1.26 -5.01 135.00 137.01 2kui s PRO 539 Ca -0.12 1.69 -0.19 0.00 0.04 0.00 0.00 61.00 62.41 2kui s PRO 539 Cb 0.00 -2.83 -0.04 0.00 0.04 0.00 0.00 34.50 31.67 2kui s PRO 539 CO 0.47 -0.03 1.19 -1.25 0.04 0.00 0.00 177.00 177.42 2kui s PRO 540 N -2.04 3.08 0.44 0.56 0.04 -1.26 -4.97 135.00 130.87 2kui s PRO 540 Ca 0.52 1.79 -0.24 0.00 0.04 0.00 0.00 61.00 63.11 2kui s PRO 540 Cb -0.28 -1.97 -0.08 0.00 0.04 0.00 0.00 34.50 32.22 2kui s PRO 540 CO 0.35 -1.11 1.28 0.00 0.04 0.00 0.00 177.00 177.56 2kui s ALA 541 N -1.62 3.10 0.00 8.56 0.00 -1.26 -2.46 121.76 128.08 2kui s ALA 541 Ca 0.76 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.89 2kui s ALA 541 Cb -0.29 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2kui s ALA 541 CO 0.32 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.61 2kui n GLY 542 N 0.62 0.95 3.67 0.00 0.00 0.24 -4.98 105.19 105.68 2kui n GLY 542 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.23 3.50 -0.19 2.61 2.01 -1.03 -4.63 115.64 115.67 2kui s THR 543 Ca 0.00 0.67 -0.24 0.00 0.31 0.00 0.00 61.69 62.43 2kui s THR 543 Cb 0.00 -3.43 -0.01 0.00 0.01 0.00 0.00 72.50 69.06 2kui s THR 543 CO 0.00 -0.05 0.80 -0.89 -0.69 0.00 0.00 174.62 173.79 2kui s THR 544 N 3.78 4.89 0.06 -0.82 2.01 -1.26 -0.71 115.64 123.59 2kui s THR 544 Ca 0.74 1.54 0.00 0.00 0.31 0.00 0.00 61.69 64.28 2kui s THR 544 Cb -0.34 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.03 2kui s THR 544 CO 0.30 0.01 -0.04 0.68 -0.69 0.00 0.00 174.62 174.88 2kui s VAL 545 N 2.30 0.36 0.58 3.82 -7.23 0.03 -4.90 120.40 115.35 2kui s VAL 545 Ca 0.36 -1.70 -0.20 0.00 -1.81 0.00 0.00 61.98 58.63 2kui s VAL 545 Cb -0.16 -1.37 -0.04 0.00 0.56 0.00 0.00 36.38 35.37 2kui s VAL 545 CO 0.11 -0.87 1.23 -2.84 -0.31 0.00 0.00 175.10 172.41 2kui s PRO 546 N -3.48 3.05 0.63 4.82 0.02 -1.26 -0.77 135.00 138.01 2kui s PRO 546 Ca 0.05 1.89 0.41 0.00 0.02 0.00 0.00 61.00 63.37 2kui s PRO 546 Cb 0.04 -2.01 2.10 0.00 0.02 0.00 0.00 34.50 34.65 2kui s PRO 546 CO -0.07 -1.16 2.26 -0.39 -0.33 0.00 0.00 177.00 177.30 2kui h VAL 547 N 1.04 0.02 0.00 3.83 -1.51 -1.16 -0.19 116.25 118.28 2kui h VAL 547 Ca -0.50 -0.16 0.00 0.00 -1.23 0.00 0.00 66.70 64.80 2kui h VAL 547 Cb 1.30 1.16 0.00 0.00 -2.13 0.00 0.00 31.29 31.61 2kui h VAL 547 CO 0.56 0.00 0.00 -0.78 -1.23 0.00 0.00 177.57 176.12 2kui h ASP 548 N 0.00 0.00 -4.14 4.19 1.82 -1.81 -2.39 116.42 114.09 2kui h ASP 548 Ca -0.00 0.00 -0.50 0.00 -0.39 0.00 0.00 57.03 56.14 2kui h ASP 548 Cb 0.16 0.00 0.04 0.00 0.68 0.00 0.00 39.33 40.21 2kui h ASP 548 CO 0.00 0.00 0.33 -0.44 -1.61 0.00 0.00 179.24 177.52 2kui s SER 549 N -4.89 6.33 -0.11 2.28 0.01 -0.08 -4.73 113.70 112.51 2kui s SER 549 Ca 0.08 1.34 -0.21 0.00 1.31 0.00 0.00 55.95 58.47 2kui s SER 549 Cb 0.10 -2.43 -0.04 0.00 0.21 0.00 0.00 66.02 63.87 2kui s SER 549 CO 0.57 -0.73 0.60 -0.69 0.41 0.00 0.00 173.24 173.40 2kui s VAL 550 N -2.94 5.10 -0.18 3.43 1.01 -1.25 -4.06 120.40 121.50 2kui s VAL 550 Ca 0.54 1.21 -0.09 0.00 0.00 0.00 0.00 61.98 63.64 2kui s VAL 550 Cb -0.11 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.29 2kui s VAL 550 CO 0.47 0.25 0.13 0.27 0.00 0.00 0.00 175.10 176.22 2kui s ILE 551 N 0.95 5.43 -0.31 2.22 -0.00 -0.22 -4.94 121.20 124.32 2kui s ILE 551 Ca 0.32 0.19 -0.10 0.00 -0.00 0.00 0.00 60.65 61.05 2kui s ILE 551 Cb -0.16 -3.45 -0.01 0.00 -0.00 0.00 0.00 42.46 38.84 2kui s ILE 551 CO 0.14 0.49 0.17 -0.70 -0.00 0.00 0.00 174.94 175.04 2kui s GLU 552 N -0.02 3.41 -0.15 0.37 2.12 -1.26 -1.36 118.70 121.80 2kui s GLU 552 Ca 0.10 -0.68 -0.11 0.00 0.36 0.00 0.00 54.97 54.65 2kui s GLU 552 Cb -0.11 -3.61 -0.05 0.00 0.26 0.00 0.00 34.13 30.62 2kui s GLU 552 CO -0.00 -0.40 0.20 -0.51 -0.54 0.00 0.00 175.26 174.01 2kui s LEU 553 N 1.64 4.30 -0.26 2.70 2.01 0.65 -1.05 118.68 128.68 2kui s LEU 553 Ca 0.05 0.44 -0.13 0.00 0.01 0.00 0.00 54.13 54.51 2kui s LEU 553 Cb -0.17 -2.21 -0.04 0.00 0.01 0.00 0.00 46.19 43.78 2kui s LEU 553 CO 0.07 0.24 0.28 -1.10 1.01 0.00 0.00 176.35 176.85 2kui s GLN 554 N -0.14 4.03 -0.12 1.70 -0.21 0.90 -0.37 119.66 125.45 2kui s GLN 554 Ca 0.14 -0.10 -0.05 0.00 0.02 0.00 0.00 55.36 55.36 2kui s GLN 554 Cb -0.12 -3.62 -0.04 0.00 1.00 0.00 0.00 33.01 30.23 2kui s GLN 554 CO 0.03 -0.15 0.07 0.08 -2.12 0.00 0.00 175.29 173.20 2kui s VAL 555 N 1.66 4.86 0.10 1.09 1.01 0.88 -0.11 120.40 129.90 2kui s VAL 555 Ca 0.12 -0.03 -0.31 0.00 0.00 0.00 0.00 61.98 61.76 2kui s VAL 555 Cb -0.15 -3.11 -0.08 0.00 0.00 0.00 0.00 36.38 33.04 2kui s VAL 555 CO 0.09 0.58 1.38 -0.44 0.00 0.00 0.00 175.10 176.70 2kui s SER 556 N -0.63 6.84 -0.20 3.32 0.01 0.12 -0.82 113.70 122.34 2kui s SER 556 Ca 0.11 2.28 -0.04 0.00 1.31 0.00 0.00 55.95 59.62 2kui s SER 556 Cb -0.12 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.51 2kui s SER 556 CO 0.02 -0.65 -0.03 -0.75 0.41 0.00 0.00 173.24 172.24 2kui s LYS 557 N 1.24 3.49 0.11 12.44 2.20 0.54 -3.36 119.74 136.40 2kui s LYS 557 Ca 0.64 -0.58 0.06 0.00 -0.36 0.00 0.00 55.97 55.73 2kui s LYS 557 Cb -0.36 -3.01 -0.22 0.00 -1.51 0.00 0.00 37.83 32.74 2kui s LYS 557 CO 0.30 -0.07 1.26 0.78 -0.36 0.00 0.00 175.35 177.26 2kui h GLY 558 N 7.70 0.02 0.00 5.54 0.00 -1.66 0.32 103.07 115.00 2kui h GLY 558 Ca -0.37 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 46.90 2kui h GLY 558 CO 0.60 0.05 0.00 0.70 0.00 0.00 0.00 176.54 177.89 2kui n ASN 559 N -3.36 0.00 -4.52 0.19 3.02 -1.26 -4.75 115.26 104.59 2kui n ASN 559 Ca -0.01 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.22 2kui n ASN 559 Cb 0.95 -0.73 -0.12 0.00 -0.61 0.00 0.00 39.78 39.27 2kui n ASN 559 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2kui s GLN 560 N -0.24 2.47 -0.04 3.52 -0.21 -1.26 -2.28 119.66 121.62 2kui s GLN 560 Ca 0.00 -0.73 0.05 0.00 0.02 0.00 0.00 55.36 54.69 2kui s GLN 560 Cb 0.00 -2.40 -0.01 0.00 1.00 0.00 0.00 33.01 31.60 2kui s GLN 560 CO 0.00 0.61 -0.18 -0.59 -2.12 0.00 0.00 175.29 173.01 2kui s PHE 561 N -0.84 1.76 -0.18 0.91 -0.71 -0.46 -4.78 117.98 113.68 2kui s PHE 561 Ca 0.14 -0.46 -0.29 0.00 -1.04 0.00 0.00 56.93 55.27 2kui s PHE 561 Cb -0.11 -1.17 -0.03 0.00 -1.21 0.00 0.00 43.02 40.50 2kui s PHE 561 CO 0.03 -0.13 1.64 0.08 -1.34 0.00 0.00 175.22 175.49 2kui s VAL 562 N -0.10 3.66 -0.15 -2.49 1.01 -1.26 -0.03 120.40 121.04 2kui s VAL 562 Ca -0.01 0.76 -0.12 0.00 0.00 0.00 0.00 61.98 62.61 2kui s VAL 562 Cb -0.11 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 2kui s VAL 562 CO 0.02 -0.23 0.25 -0.32 0.00 0.00 0.00 175.10 174.82 2kui s MET 563 N 4.56 4.12 1.05 2.72 1.75 -1.02 -4.94 119.30 127.55 2kui s MET 563 Ca 0.72 0.04 -0.12 0.00 -1.25 0.00 0.00 55.69 55.07 2kui s MET 563 Cb -0.27 -3.38 0.22 0.00 2.84 0.00 0.00 34.83 34.24 2kui s MET 563 CO 0.29 0.35 1.07 -1.25 -0.65 0.00 0.00 175.02 174.83 2kui s PRO 564 N 0.15 0.03 -0.35 4.11 0.04 -1.26 0.10 135.00 137.82 2kui s PRO 564 Ca 0.15 0.65 -0.21 0.00 0.04 0.00 0.00 61.00 61.63 2kui s PRO 564 Cb -0.13 -1.68 0.00 0.00 0.04 0.00 0.00 34.50 32.74 2kui s PRO 564 CO 0.03 -3.04 0.69 0.16 0.04 0.00 0.00 177.00 174.89 2kui s ASP 565 N -3.14 6.49 0.00 6.66 -4.77 -1.26 -4.52 116.67 116.13 2kui s ASP 565 Ca 0.66 0.27 0.02 0.00 -3.30 0.00 0.00 52.55 50.20 2kui s ASP 565 Cb -0.21 -2.35 0.05 0.00 -1.09 0.00 0.00 42.92 39.32 2kui s ASP 565 CO 0.60 -0.63 0.91 0.18 0.70 0.00 0.00 175.17 176.93 2kui n LEU 566 N 6.16 1.89 -4.84 2.11 4.32 -1.26 -5.04 117.00 120.34 2kui n LEU 566 Ca 0.00 -1.71 -0.32 0.00 -0.02 0.00 0.00 56.01 53.96 2kui n LEU 566 Cb 0.48 -0.03 -0.04 0.00 -1.62 0.00 0.00 43.42 42.21 2kui n LEU 566 CO 0.50 0.47 0.66 -0.55 -1.22 0.00 0.00 177.39 177.25 2kui s SER 567 N -0.76 6.67 0.00 -1.43 0.15 -1.26 -4.48 113.70 112.59 2kui s SER 567 Ca 0.04 1.57 0.00 0.00 0.70 0.00 0.00 55.95 58.26 2kui s SER 567 Cb 0.02 -2.50 0.00 0.00 -1.71 0.00 0.00 66.02 61.83 2kui s SER 567 CO 0.03 -0.54 0.00 0.61 1.20 0.00 0.00 173.24 174.54 2kui n GLY 568 N -1.40 0.75 2.25 9.45 0.00 -1.26 -5.11 105.19 109.87 2kui n GLY 568 Ca 0.06 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 2kui n GLY 568 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2kui n MET 569 N -0.08 0.30 -3.69 1.61 2.81 -1.26 -5.02 117.12 111.78 2kui n MET 569 Ca 0.00 -2.29 -0.26 0.00 -1.81 0.00 0.00 57.70 53.34 2kui n MET 569 Cb 0.06 1.91 -0.03 0.00 -0.71 0.00 0.00 33.22 34.45 2kui n MET 569 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 2kui s PHE 570 N -3.00 3.48 0.53 2.03 0.40 -1.26 -2.41 117.98 117.75 2kui s PHE 570 Ca 0.27 0.27 0.19 0.00 -0.60 0.00 0.00 56.93 57.07 2kui s PHE 570 Cb 0.01 -1.81 1.36 0.00 0.51 0.00 0.00 43.02 43.09 2kui s PHE 570 CO 0.19 0.35 2.13 2.35 0.70 0.00 0.00 175.22 180.94 2kui h TRP 571 N 1.65 0.00 0.00 0.36 2.91 -0.49 0.10 115.95 120.48 2kui h TRP 571 Ca -0.49 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.52 2kui h TRP 571 Cb 1.20 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 29.85 2kui h TRP 571 CO 0.53 0.00 -0.05 -0.39 -1.03 0.00 0.00 178.44 177.50 2kui h VAL 572 N 0.00 0.43 0.00 2.65 -1.51 -1.94 0.12 116.25 116.00 2kui h VAL 572 Ca 0.04 -0.25 -0.21 0.00 -1.23 0.00 0.00 66.70 65.06 2kui h VAL 572 Cb 0.18 1.17 -0.04 0.00 -2.13 0.00 0.00 31.29 30.48 2kui h VAL 572 CO -0.00 0.05 -2.16 0.47 -1.23 0.00 0.00 177.57 174.70 2kui n ASP 573 N -3.60 0.28 0.07 4.19 9.92 -0.03 -4.46 116.55 122.93 2kui n ASP 573 Ca -0.02 0.00 -0.07 0.00 -0.53 0.00 0.00 54.79 54.17 2kui n ASP 573 Cb 0.16 1.37 0.08 0.00 -0.64 0.00 0.00 41.12 42.09 2kui n ASP 573 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2kui h ALA 574 N 1.33 0.74 -0.04 2.24 0.00 0.17 -2.65 119.26 121.05 2kui h ALA 574 Ca -0.31 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.02 2kui h ALA 574 Cb 1.67 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.38 2kui h ALA 574 CO 0.02 0.77 0.02 1.49 0.00 0.00 0.00 179.25 181.55 2kui h GLU 575 N 0.19 0.05 -0.73 0.00 4.81 -1.03 0.67 114.58 118.55 2kui h GLU 575 Ca -0.02 -0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.31 2kui h GLU 575 Cb 1.21 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.53 2kui h GLU 575 CO 0.11 0.06 0.48 -1.35 -0.73 0.00 0.00 179.01 177.58 2kui h PRO 576 N 0.03 0.61 -0.35 0.92 0.11 -1.78 -1.17 132.00 130.36 2kui h PRO 576 Ca 0.01 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.10 2kui h PRO 576 Cb 0.02 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 30.97 2kui h PRO 576 CO -0.00 0.40 0.21 0.00 -0.21 0.00 0.00 178.00 178.40 2kui h ARG 577 N 0.63 0.41 -0.41 1.05 2.47 -0.99 0.21 114.38 117.75 2kui h ARG 577 Ca 0.34 -0.02 0.03 0.00 -1.26 0.00 0.00 59.98 59.07 2kui h ARG 577 Cb 0.48 -0.09 -0.04 0.00 -1.65 0.00 0.00 29.97 28.67 2kui h ARG 577 CO -0.12 0.27 0.20 1.25 0.56 0.00 0.00 179.97 182.14 2kui h LEU 578 N 0.43 0.29 -0.38 3.04 6.46 -0.09 0.29 115.31 125.35 2kui h LEU 578 Ca 0.14 0.02 -0.05 0.00 -0.12 0.00 0.00 57.88 57.87 2kui h LEU 578 Cb -0.01 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 39.88 2kui h LEU 578 CO -0.06 0.21 0.05 0.03 -0.62 0.00 0.00 178.44 178.06 2kui h ARG 579 N 0.41 0.64 0.00 1.25 3.08 -0.95 -1.50 114.38 117.31 2kui h ARG 579 Ca 0.18 -0.18 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 2kui h ARG 579 Cb 0.09 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 2kui h ARG 579 CO -0.13 0.70 -0.40 0.00 -1.07 0.00 0.00 179.97 179.07 2kui h ALA 580 N 0.91 1.16 -0.00 0.04 0.00 -0.47 -1.73 119.26 119.18 2kui h ALA 580 Ca 0.11 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2kui h ALA 580 Cb 0.38 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2kui h ALA 580 CO 0.01 0.50 -0.18 1.28 0.00 0.00 0.00 179.25 180.87 2kui n LEU 581 N -3.81 0.30 -3.31 0.00 4.77 0.05 -4.93 117.00 110.07 2kui n LEU 581 Ca -0.01 0.19 -0.20 0.00 -0.03 0.00 0.00 56.01 55.95 2kui n LEU 581 Cb 0.47 -0.32 0.08 0.00 -2.33 0.00 0.00 43.42 41.32 2kui n LEU 581 CO 0.38 0.06 0.20 0.61 -1.33 0.00 0.00 177.39 177.31 2kui n GLY 582 N 1.42 -0.39 3.74 -0.72 0.00 -0.65 -4.93 105.19 103.66 2kui n GLY 582 Ca 0.09 0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.30 3.35 -0.27 1.61 -0.00 -0.61 -5.01 118.94 114.70 2kui s TRP 583 Ca 0.41 1.35 -0.01 0.00 -0.00 0.00 0.00 56.10 57.85 2kui s TRP 583 Cb -0.18 -3.50 0.13 0.00 -0.00 0.00 0.00 33.47 29.91 2kui s TRP 583 CO 0.67 -1.48 0.29 0.99 -0.00 0.00 0.00 176.95 177.43 2kui s THR 584 N -0.06 -0.42 0.00 5.86 2.01 -1.26 -4.93 115.64 116.84 2kui s THR 584 Ca 0.54 -0.37 0.00 0.00 0.31 0.00 0.00 61.69 62.17 2kui s THR 584 Cb -0.34 -0.91 0.00 0.00 0.01 0.00 0.00 72.50 71.25 2kui s THR 584 CO 0.38 -0.38 0.00 0.61 -0.69 0.00 0.00 174.62 174.54 2kui n GLY 585 N 5.32 2.35 2.78 4.40 0.00 -1.26 -4.85 105.19 113.93 2kui n GLY 585 Ca -0.03 0.20 -0.19 0.00 0.00 0.00 0.00 46.02 46.00 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 3.41 0.33 -0.31 1.61 -2.45 -1.26 -5.03 119.30 115.60 2kui s MET 586 Ca 0.00 0.13 -0.14 0.00 -1.25 0.00 0.00 55.69 54.43 2kui s MET 586 Cb 0.00 -0.62 -0.03 0.00 1.25 0.00 0.00 34.83 35.43 2kui s MET 586 CO 0.00 -0.21 0.33 -1.17 1.05 0.00 0.00 175.02 175.03 2kui s LEU 587 N 1.45 4.24 -0.50 4.11 2.96 -1.26 -2.15 118.68 127.53 2kui s LEU 587 Ca -0.04 -0.04 -0.15 0.00 -0.22 0.00 0.00 54.13 53.69 2kui s LEU 587 Cb -0.13 -2.32 0.11 0.00 0.50 0.00 0.00 46.19 44.34 2kui s LEU 587 CO -0.03 -0.24 0.43 -1.81 -1.32 0.00 0.00 176.35 173.39 2kui s ASP 588 N 1.71 6.08 -0.14 3.68 1.01 0.06 -5.01 116.67 124.06 2kui s ASP 588 Ca 0.12 -1.64 -0.22 0.00 0.71 0.00 0.00 52.55 51.52 2kui s ASP 588 Cb -0.16 -2.16 -0.03 0.00 1.01 0.00 0.00 42.92 41.57 2kui s ASP 588 CO 0.11 -0.75 0.66 -0.75 0.21 0.00 0.00 175.17 174.65 2kui s LYS 589 N 1.57 4.31 0.00 8.23 2.36 -1.26 -1.00 119.74 133.96 2kui s LYS 589 Ca 0.04 0.73 0.00 0.00 -2.55 0.00 0.00 55.97 54.19 2kui s LYS 589 Cb -0.27 -3.52 0.00 0.00 -1.05 0.00 0.00 37.83 32.99 2kui s LYS 589 CO 0.04 -0.10 0.00 0.41 1.55 0.00 0.00 175.35 177.24 2kui n GLY 590 N 3.46 -0.59 3.74 5.54 0.00 0.63 -4.95 105.19 113.01 2kui n GLY 590 Ca -0.01 -1.36 -0.40 0.00 0.00 0.00 0.00 46.02 44.24 2kui n GLY 590 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kui n ALA 591 N -3.00 1.69 -2.66 4.61 0.00 -1.26 -4.91 120.51 114.97 2kui n ALA 591 Ca 0.00 0.22 -0.38 0.00 0.00 0.00 0.00 53.44 53.28 2kui n ALA 591 Cb 0.00 -2.34 -0.08 0.00 0.00 0.00 0.00 19.45 17.03 2kui n ALA 591 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2kui s ASP 592 N -0.60 6.43 -0.18 0.00 1.01 -1.26 -4.55 116.67 117.52 2kui s ASP 592 Ca 0.64 0.51 0.01 0.00 0.71 0.00 0.00 52.55 54.42 2kui s ASP 592 Cb -0.46 -2.24 0.03 0.00 1.01 0.00 0.00 42.92 41.27 2kui s ASP 592 CO 0.56 -0.10 -0.14 -0.69 0.21 0.00 0.00 175.17 175.01 2kui s VAL 593 N 1.41 1.75 -0.56 -1.27 1.01 -0.40 -4.96 120.40 117.37 2kui s VAL 593 Ca 0.19 -0.88 -0.28 0.00 0.00 0.00 0.00 61.98 61.01 2kui s VAL 593 Cb -0.15 -1.69 0.03 0.00 0.00 0.00 0.00 36.38 34.57 2kui s VAL 593 CO 0.08 0.36 1.18 -0.62 0.00 0.00 0.00 175.10 176.10 2kui s ASP 594 N 1.39 6.47 0.00 3.32 2.15 -1.26 -2.33 116.67 126.41 2kui s ASP 594 Ca 0.02 0.15 0.00 0.00 0.43 0.00 0.00 52.55 53.15 2kui s ASP 594 Cb -0.14 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.93 2kui s ASP 594 CO -0.10 -1.44 0.53 0.00 -0.17 0.00 0.00 175.17 173.99 2kui n ALA 595 N 8.34 1.74 -0.00 3.66 0.00 -1.26 -5.05 120.51 127.93 2kui n ALA 595 Ca 0.09 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2kui n ALA 595 Cb 0.49 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.82 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 0.00 0.31 0.36 0.00 0.00 -1.26 -4.83 105.19 99.76 2kui n GLY 596 Ca 0.00 -0.86 -0.03 0.00 0.00 0.00 0.00 46.02 45.13 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 1.34 1.18 -0.02 0.00 -1.93 -1.90 103.07 101.74 2kui h GLY 597 Ca 0.00 -0.56 0.08 0.00 0.00 0.00 0.00 47.33 46.85 2kui h GLY 597 CO 0.00 0.54 0.35 1.76 0.00 0.00 0.00 176.54 179.20 2kui h SER 598 N 1.27 0.33 0.00 0.19 0.02 -2.00 -0.23 113.55 113.14 2kui h SER 598 Ca 0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 2kui h SER 598 Cb -0.05 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.42 2kui h SER 598 CO -0.06 0.21 -0.65 0.00 -1.14 0.00 0.00 176.83 175.18 2kui n GLN 599 N -4.47 2.72 -0.41 3.45 1.13 -1.16 -4.40 117.38 114.23 2kui n GLN 599 Ca 0.08 -0.01 0.08 0.00 -1.94 0.00 0.00 57.00 55.21 2kui n GLN 599 Cb 0.33 -1.10 0.26 0.00 0.11 0.00 0.00 30.24 29.83 2kui n GLN 599 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2kui n HIS 600 N -1.33 0.97 1.31 1.08 8.25 -0.73 -4.23 115.22 120.54 2kui n HIS 600 Ca 0.02 -0.66 0.01 0.00 -0.26 0.00 0.00 57.72 56.82 2kui n HIS 600 Cb 0.20 -0.20 0.03 0.00 1.12 0.00 0.00 29.99 31.14 2kui n HIS 600 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2kui n ASN 601 N 0.36 0.86 -4.92 0.41 2.85 -0.17 0.58 115.26 115.24 2kui n ASN 601 Ca 0.20 -2.04 -0.29 0.00 -0.11 0.00 0.00 54.58 52.33 2kui n ASN 601 Cb 0.74 -0.29 -0.04 0.00 1.24 0.00 0.00 39.78 41.43 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 -1.50 3.53 0.29 1.20 3.52 -1.26 0.31 118.95 125.04 2kui s ARG 602 Ca 0.04 -0.30 -0.29 0.00 -0.13 0.00 0.00 55.73 55.05 2kui s ARG 602 Cb 0.03 -2.89 -0.10 0.00 -1.56 0.00 0.00 34.95 30.42 2kui s ARG 602 CO 0.02 0.48 1.40 0.54 -0.81 0.00 0.00 175.30 176.93 2kui s VAL 603 N -1.71 2.60 -0.22 7.11 0.11 -1.01 -4.22 120.40 123.06 2kui s VAL 603 Ca 0.38 0.55 -0.13 0.00 -2.93 0.00 0.00 61.98 59.85 2kui s VAL 603 Cb -0.12 -3.35 -0.09 0.00 -1.53 0.00 0.00 36.38 31.29 2kui s VAL 603 CO 0.27 0.11 -0.32 0.52 -3.33 0.00 0.00 175.10 172.35 2kui n VAL 604 N 1.63 1.39 -3.77 2.04 0.31 0.18 -4.94 118.33 115.18 2kui n VAL 604 Ca 0.04 -0.19 -0.10 0.00 -0.01 0.00 0.00 64.34 64.08 2kui n VAL 604 Cb 0.41 -1.96 -0.04 0.00 -0.91 0.00 0.00 33.84 31.33 2kui n VAL 604 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 2kui s TYR 605 N -2.56 -0.04 0.04 3.52 1.13 -1.26 -5.01 117.35 113.18 2kui s TYR 605 Ca -0.32 -0.31 -0.06 0.00 -1.41 0.00 0.00 57.07 54.98 2kui s TYR 605 Cb 0.10 0.30 -0.01 0.00 -1.10 0.00 0.00 41.96 41.26 2kui s TYR 605 CO 0.42 -0.86 0.10 1.14 -2.51 0.00 0.00 175.55 173.84 2kui s GLN 606 N -3.88 0.60 -0.12 -3.49 -2.07 -1.26 -3.47 119.66 105.97 2kui s GLN 606 Ca 0.10 -0.76 -0.13 0.00 -1.82 0.00 0.00 55.36 52.74 2kui s GLN 606 Cb 0.00 0.24 -0.12 0.00 -1.09 0.00 0.00 33.01 32.04 2kui s GLN 606 CO -0.03 -0.15 0.33 -0.91 -1.32 0.00 0.00 175.29 173.20 2kui h ASN 607 N 3.61 0.00 -3.42 12.60 2.35 -1.94 -3.42 115.58 125.36 2kui h ASN 607 Ca -0.33 -0.44 -0.61 0.00 -0.55 0.00 0.00 56.30 54.38 2kui h ASN 607 Cb 1.18 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 39.44 2kui h ASN 607 CO 0.51 0.75 0.57 -2.16 -1.65 0.00 0.00 177.43 175.44 2kui s PRO 608 N -1.88 3.42 0.42 0.81 0.05 -1.26 -5.03 135.00 131.53 2kui s PRO 608 Ca -0.09 -0.07 -0.24 0.00 0.05 0.00 0.00 61.00 60.64 2kui s PRO 608 Cb -0.01 -3.99 -0.08 0.00 0.05 0.00 0.00 34.50 30.47 2kui s PRO 608 CO 0.32 -1.36 1.16 -2.14 0.05 0.00 0.00 177.00 175.04 2kui s PRO 609 N 3.84 3.96 0.27 0.56 0.02 -1.26 -5.00 135.00 137.40 2kui s PRO 609 Ca 0.33 1.81 -0.29 0.00 0.02 0.00 0.00 61.00 62.86 2kui s PRO 609 Cb -0.11 -2.58 -0.10 0.00 0.02 0.00 0.00 34.50 31.73 2kui s PRO 609 CO 0.23 -0.39 1.29 0.00 -0.33 0.00 0.00 177.00 177.80 2kui s ALA 610 N -1.47 3.51 0.00 -1.55 0.00 -1.26 -2.19 121.76 118.80 2kui s ALA 610 Ca 0.59 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.72 2kui s ALA 610 Cb -0.30 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2kui s ALA 610 CO 0.37 -0.55 0.00 0.41 0.00 0.00 0.00 175.76 175.99 2kui n GLY 611 N 1.53 1.05 3.82 0.00 0.00 0.11 -4.84 105.19 106.87 2kui n GLY 611 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.30 3.85 -0.20 2.61 2.01 -0.93 -4.81 115.64 115.87 2kui s THR 612 Ca 0.00 -1.43 -0.29 0.00 0.31 0.00 0.00 61.69 60.27 2kui s THR 612 Cb 0.00 -3.24 -0.02 0.00 0.01 0.00 0.00 72.50 69.25 2kui s THR 612 CO 0.00 -0.25 1.45 -0.83 -0.69 0.00 0.00 174.62 174.30 2kui s GLY 613 N -3.91 1.43 0.07 4.40 0.00 -1.26 -2.43 107.32 105.61 2kui s GLY 613 Ca 0.37 0.46 -0.16 0.00 0.00 0.00 0.00 44.72 45.39 2kui s GLY 613 CO 0.25 2.77 0.50 -1.34 0.00 0.00 0.00 173.10 175.28 2kui s VAL 614 N 4.35 4.90 0.51 1.40 -7.23 0.96 -4.65 120.40 120.63 2kui s VAL 614 Ca 0.64 0.93 -0.23 0.00 -1.81 0.00 0.00 61.98 61.51 2kui s VAL 614 Cb -0.23 -3.77 -0.07 0.00 0.56 0.00 0.00 36.38 32.87 2kui s VAL 614 CO 0.24 0.46 1.27 -0.46 -0.31 0.00 0.00 175.10 176.30 2kui n ASN 615 N 1.45 2.36 0.23 4.85 6.94 -1.26 -1.35 115.26 128.49 2kui n ASN 615 Ca -0.10 1.00 0.17 0.00 -0.02 0.00 0.00 54.58 55.63 2kui n ASN 615 Cb 0.52 -1.52 0.86 0.00 -2.36 0.00 0.00 39.78 37.27 2kui n ASN 615 CO 0.00 0.00 0.00 0.08 -1.03 0.00 0.00 177.26 176.31 2kui h ARG 616 N 1.53 0.00 -0.48 -3.83 0.11 -1.84 -0.86 114.38 109.00 2kui h ARG 616 Ca -0.49 0.00 0.01 0.00 0.10 0.00 0.00 59.98 59.59 2kui h ARG 616 Cb 1.31 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.36 2kui h ARG 616 CO 0.57 0.00 0.32 -0.44 0.10 0.00 0.00 179.97 180.52 2kui h ASP 617 N 0.00 0.54 -0.01 0.08 3.32 -1.90 -3.46 116.42 114.99 2kui h ASP 617 Ca 0.06 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2kui h ASP 617 Cb 0.36 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 2kui h ASP 617 CO -0.00 0.39 -0.00 0.61 -1.72 0.00 0.00 179.24 178.52 2kui n GLY 618 N -1.23 0.47 3.69 2.75 0.00 -0.33 -4.50 105.19 106.05 2kui n GLY 618 Ca 0.02 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 2kui n GLY 618 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2kui s ILE 619 N -1.97 3.63 -0.07 -0.61 -1.16 -1.26 -4.57 121.20 115.19 2kui s ILE 619 Ca 0.00 1.06 0.03 0.00 -0.51 0.00 0.00 60.65 61.23 2kui s ILE 619 Cb 0.00 -3.68 0.01 0.00 0.61 0.00 0.00 42.46 39.40 2kui s ILE 619 CO 0.00 0.02 -0.15 -0.51 -2.81 0.00 0.00 174.94 171.49 2kui s ILE 620 N 2.10 1.37 -0.20 2.00 1.10 -0.91 -4.78 121.20 121.87 2kui s ILE 620 Ca 0.64 -0.61 -0.07 0.00 -0.51 0.00 0.00 60.65 60.09 2kui s ILE 620 Cb -0.33 -1.23 -0.04 0.00 0.15 0.00 0.00 42.46 41.02 2kui s ILE 620 CO 0.27 0.41 0.06 -0.89 -2.11 0.00 0.00 174.94 172.68 2kui s THR 621 N 0.59 4.61 0.03 4.00 2.01 -1.26 -0.76 115.64 124.86 2kui s THR 621 Ca -0.16 -0.09 0.01 0.00 0.31 0.00 0.00 61.69 61.76 2kui s THR 621 Cb -0.16 -3.09 -0.02 0.00 0.01 0.00 0.00 72.50 69.23 2kui s THR 621 CO 0.05 0.43 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.59 2kui s LEU 622 N 0.72 2.27 -0.03 4.42 1.43 -0.17 -3.30 118.68 124.02 2kui s LEU 622 Ca 0.03 -0.56 0.04 0.00 -1.03 0.00 0.00 54.13 52.61 2kui s LEU 622 Cb -0.13 -0.02 -0.00 0.00 0.03 0.00 0.00 46.19 46.06 2kui s LEU 622 CO 0.02 -0.27 -0.15 -0.60 0.23 0.00 0.00 176.35 175.58 2kui s ARG 623 N -1.71 1.40 0.14 1.70 3.52 -1.23 -0.27 118.95 122.51 2kui s ARG 623 Ca -0.11 -0.51 -0.03 0.00 -0.13 0.00 0.00 55.73 54.94 2kui s ARG 623 Cb -0.09 -1.28 -0.03 0.00 -1.56 0.00 0.00 34.95 31.99 2kui s ARG 623 CO -0.01 0.24 0.12 -0.59 -0.81 0.00 0.00 175.30 174.25 2kui s PHE 624 N -0.06 0.76 0.00 5.12 -0.12 -1.26 -0.65 117.98 121.78 2kui s PHE 624 Ca -0.00 -1.13 0.00 0.00 -0.05 0.00 0.00 56.93 55.75 2kui s PHE 624 Cb -0.09 -0.38 0.00 0.00 -0.63 0.00 0.00 43.02 41.92 2kui s PHE 624 CO 0.01 -0.58 0.00 0.41 -0.05 0.00 0.00 175.22 175.01 2kui n GLY 625 N -0.13 -1.82 0.95 1.99 0.00 0.20 -4.46 105.19 101.90 2kui n GLY 625 Ca -0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.09 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14