#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 3.85 0.48 -0.61 1.10 -1.26 -4.98 121.20 119.79 2kui s ILE 356 Ca 0.00 0.86 -0.19 0.00 -0.51 0.00 0.00 60.65 60.81 2kui s ILE 356 Cb 0.00 -4.16 -0.09 0.00 0.15 0.00 0.00 42.46 38.36 2kui s ILE 356 CO 0.00 -0.75 1.01 -0.89 -2.11 0.00 0.00 174.94 172.20 2kui s THR 357 N 5.63 4.08 -0.39 4.00 2.01 -1.26 -4.95 115.64 124.76 2kui s THR 357 Ca 0.63 1.22 0.23 0.00 0.31 0.00 0.00 61.69 64.08 2kui s THR 357 Cb -0.14 -3.53 0.33 0.00 0.01 0.00 0.00 72.50 69.18 2kui s THR 357 CO 0.32 -0.36 1.63 0.03 -0.69 0.00 0.00 174.62 175.56 2kui h ARG 358 N 1.45 0.00 -6.56 4.92 3.08 -1.98 -3.41 114.38 111.88 2kui h ARG 358 Ca -0.49 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.04 2kui h ARG 358 Cb 1.20 0.00 0.03 0.00 0.08 0.00 0.00 29.97 31.28 2kui h ARG 358 CO 0.60 0.02 0.77 -0.51 -1.07 0.00 0.00 179.97 179.78 2kui s ASP 359 N -6.18 6.75 0.24 7.04 1.11 -1.26 -4.75 116.67 119.61 2kui s ASP 359 Ca 0.06 2.41 0.10 0.00 0.18 0.00 0.00 52.55 55.31 2kui s ASP 359 Cb 0.05 -2.59 -0.04 0.00 1.07 0.00 0.00 42.92 41.41 2kui s ASP 359 CO 0.66 -0.71 -0.11 0.68 1.18 0.00 0.00 175.17 176.88 2kui s VAL 360 N 1.13 2.99 -0.22 -1.27 -7.23 0.11 -4.43 120.40 111.47 2kui s VAL 360 Ca 0.66 -1.99 -0.16 0.00 -1.81 0.00 0.00 61.98 58.68 2kui s VAL 360 Cb -0.39 -2.54 -0.04 0.00 0.56 0.00 0.00 36.38 33.97 2kui s VAL 360 CO 0.30 -0.28 0.39 -1.58 -0.31 0.00 0.00 175.10 173.62 2kui s GLN 361 N -3.28 4.14 -0.20 4.82 -0.44 -1.26 0.02 119.66 123.47 2kui s GLN 361 Ca 0.28 0.16 -0.09 0.00 -2.50 0.00 0.00 55.36 53.21 2kui s GLN 361 Cb -0.07 -3.56 -0.05 0.00 -1.64 0.00 0.00 33.01 27.70 2kui s GLN 361 CO 0.16 -0.08 0.11 0.08 0.50 0.00 0.00 175.29 176.06 2kui s VAL 362 N 1.45 5.18 0.13 1.34 1.01 0.58 -5.01 120.40 125.08 2kui s VAL 362 Ca 0.18 0.11 -0.30 0.00 0.00 0.00 0.00 61.98 61.96 2kui s VAL 362 Cb -0.15 -3.36 -0.07 0.00 0.00 0.00 0.00 36.38 32.80 2kui s VAL 362 CO 0.08 0.44 1.20 -2.84 0.00 0.00 0.00 175.10 173.98 2kui s PRO 363 N 0.42 4.47 0.38 2.72 0.02 -1.26 -3.64 135.00 138.10 2kui s PRO 363 Ca 0.06 1.83 -0.02 0.00 0.02 0.00 0.00 61.00 62.89 2kui s PRO 363 Cb -0.12 -3.29 -0.04 0.00 0.02 0.00 0.00 34.50 31.08 2kui s PRO 363 CO -0.01 -0.16 0.62 0.34 -0.33 0.00 0.00 177.00 177.46 2kui s ASP 364 N 0.54 6.32 0.00 2.53 -1.08 -1.26 -4.99 116.67 118.73 2kui s ASP 364 Ca 0.56 0.65 0.07 0.00 -0.52 0.00 0.00 52.55 53.31 2kui s ASP 364 Cb -0.31 -2.12 0.14 0.00 -1.46 0.00 0.00 42.92 39.17 2kui s ASP 364 CO 0.33 -0.36 1.00 1.33 0.52 0.00 0.00 175.17 177.99 2kui n VAL 365 N -1.75 0.63 -1.60 1.11 0.24 -1.26 -5.02 118.33 110.68 2kui n VAL 365 Ca -0.03 -0.82 -0.40 0.00 -2.04 0.00 0.00 64.34 61.05 2kui n VAL 365 Cb 0.55 0.74 0.02 0.00 -1.47 0.00 0.00 33.84 33.68 2kui n VAL 365 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2kui n ARG 366 N 0.23 1.18 0.00 7.34 -4.01 -1.26 -3.28 116.66 116.87 2kui n ARG 366 Ca 0.06 0.43 0.00 0.00 -1.04 0.00 0.00 57.85 57.30 2kui n ARG 366 Cb 0.29 -2.03 0.00 0.00 -3.04 0.00 0.00 32.46 27.69 2kui n ARG 366 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2kui n GLY 367 N 1.26 0.47 0.00 2.89 0.00 0.94 -4.96 105.19 105.79 2kui n GLY 367 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2kui n GLY 367 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kui n GLN 368 N -1.51 0.00 -3.56 1.61 6.02 -1.20 -4.91 117.38 113.82 2kui n GLN 368 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.86 2kui n GLN 368 Cb 0.00 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.22 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 -0.50 -0.41 0.26 1.08 1.04 -1.26 -4.16 113.70 109.75 2kui s SER 369 Ca 0.00 0.01 -0.03 0.00 0.48 0.00 0.00 55.95 56.42 2kui s SER 369 Cb 0.00 0.51 0.34 0.00 0.10 0.00 0.00 66.02 66.97 2kui s SER 369 CO 0.00 -0.80 1.80 0.77 0.98 0.00 0.00 173.24 175.99 2kui h SER 370 N 2.53 0.83 -0.42 7.02 4.64 -1.88 -0.68 113.55 125.57 2kui h SER 370 Ca -0.32 -0.16 -0.01 0.00 -0.47 0.00 0.00 61.79 60.83 2kui h SER 370 Cb 1.24 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 63.10 2kui h SER 370 CO 0.42 0.82 0.25 0.00 -0.87 0.00 0.00 176.83 177.44 2kui h ALA 371 N 1.29 0.54 -0.40 5.18 0.00 -1.96 0.19 119.26 124.09 2kui h ALA 371 Ca 0.18 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 2kui h ALA 371 Cb 0.33 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2kui h ALA 371 CO 0.00 0.05 -0.33 0.22 0.00 0.00 0.00 179.25 179.20 2kui h ASP 372 N 0.56 0.95 0.13 0.00 1.82 -1.92 -0.10 116.42 117.85 2kui h ASP 372 Ca 0.15 -0.40 -0.01 0.00 -0.39 0.00 0.00 57.03 56.38 2kui h ASP 372 Cb 0.02 -0.26 0.00 0.00 0.68 0.00 0.00 39.33 39.77 2kui h ASP 372 CO -0.03 1.18 -0.06 0.00 -1.61 0.00 0.00 179.24 178.72 2kui h ALA 373 N 0.87 -0.17 -0.65 -0.78 0.00 -0.71 0.77 119.26 118.58 2kui h ALA 373 Ca 0.08 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2kui h ALA 373 Cb 0.90 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 2kui h ALA 373 CO 0.08 -0.55 0.07 0.82 0.00 0.00 0.00 179.25 179.67 2kui h ILE 374 N -0.26 1.27 -0.29 0.00 2.04 -0.63 -1.61 117.51 118.01 2kui h ILE 374 Ca -0.02 -1.09 0.01 0.00 1.00 0.00 0.00 64.86 64.76 2kui h ILE 374 Cb 0.21 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 2kui h ILE 374 CO 0.03 0.41 0.17 0.00 0.00 0.00 0.00 178.15 178.75 2kui h ALA 375 N 1.03 0.37 -0.18 1.87 0.00 -0.74 0.79 119.26 122.40 2kui h ALA 375 Ca 0.19 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2kui h ALA 375 Cb 0.49 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2kui h ALA 375 CO 0.02 -0.20 0.03 1.15 0.00 0.00 0.00 179.25 180.25 2kui h THR 376 N 0.35 1.22 -0.74 0.00 2.02 -0.67 -1.92 112.91 113.16 2kui h THR 376 Ca 0.12 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.56 2kui h THR 376 Cb 0.00 1.34 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 2kui h THR 376 CO -0.06 0.21 0.31 -0.07 0.37 0.00 0.00 175.52 176.28 2kui h LEU 377 N 0.09 1.01 -0.79 2.58 4.07 -1.04 -0.70 115.31 120.52 2kui h LEU 377 Ca 0.05 -0.14 -0.07 0.00 0.08 0.00 0.00 57.88 57.80 2kui h LEU 377 Cb 0.29 -0.26 -0.03 0.00 1.08 0.00 0.00 40.66 41.75 2kui h LEU 377 CO 0.00 0.89 0.09 -0.61 -1.08 0.00 0.00 178.44 177.73 2kui h GLN 378 N 1.08 1.00 0.00 1.13 5.75 -0.74 0.19 115.11 123.52 2kui h GLN 378 Ca 0.25 -0.26 -0.06 0.00 -0.15 0.00 0.00 58.65 58.43 2kui h GLN 378 Cb 0.19 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.61 2kui h GLN 378 CO -0.02 0.93 -0.28 -0.91 -2.65 0.00 0.00 178.83 175.90 2kui h ASN 379 N 0.94 0.00 1.27 -0.69 2.35 -0.69 -2.03 115.58 116.74 2kui h ASN 379 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 2kui h ASN 379 Cb 0.43 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.80 2kui h ASN 379 CO 0.01 0.28 -0.15 0.54 -1.65 0.00 0.00 177.43 176.45 2kui n ARG 380 N -3.72 0.24 -0.36 0.81 5.12 -0.33 -4.90 116.66 113.53 2kui n ARG 380 Ca -0.01 0.16 0.00 0.00 -1.93 0.00 0.00 57.85 56.07 2kui n ARG 380 Cb 0.38 -1.74 0.00 0.00 -1.16 0.00 0.00 32.46 29.94 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 1.34 0.79 3.91 -0.13 0.00 -0.55 -4.78 105.19 105.77 2kui n GLY 381 Ca 0.05 -0.25 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 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 3.48 -0.01 1.61 0.40 0.56 -4.08 117.98 117.93 2kui s PHE 382 Ca 0.00 0.58 -0.01 0.00 -0.60 0.00 0.00 56.93 56.90 2kui s PHE 382 Cb 0.00 -2.05 -0.04 0.00 0.51 0.00 0.00 43.02 41.44 2kui s PHE 382 CO 0.00 0.21 0.09 0.15 0.70 0.00 0.00 175.22 176.37 2kui s LYS 383 N -3.53 3.12 0.01 0.44 -0.14 0.44 -3.97 119.74 116.12 2kui s LYS 383 Ca 0.43 -0.45 0.08 0.00 -1.36 0.00 0.00 55.97 54.67 2kui s LYS 383 Cb -0.11 -2.90 -0.03 0.00 -1.68 0.00 0.00 37.83 33.12 2kui s LYS 383 CO 0.30 0.66 -0.24 0.96 -0.76 0.00 0.00 175.35 176.27 2kui s ILE 384 N -1.19 2.29 0.06 2.17 -0.00 -1.26 -0.82 121.20 122.45 2kui s ILE 384 Ca 0.23 -1.19 0.05 0.00 -0.00 0.00 0.00 60.65 59.73 2kui s ILE 384 Cb -0.12 -1.87 -0.04 0.00 -0.00 0.00 0.00 42.46 40.43 2kui s ILE 384 CO 0.13 0.46 -0.08 -0.60 -0.00 0.00 0.00 174.94 174.86 2kui s ARG 385 N -0.99 2.35 -0.08 0.37 6.06 0.58 -4.84 118.95 122.39 2kui s ARG 385 Ca 0.11 -0.87 -0.01 0.00 -2.50 0.00 0.00 55.73 52.47 2kui s ARG 385 Cb -0.10 -2.41 0.03 0.00 0.06 0.00 0.00 34.95 32.52 2kui s ARG 385 CO 0.01 0.55 -0.04 0.99 -2.50 0.00 0.00 175.30 174.31 2kui s THR 386 N -1.12 0.68 -0.23 4.11 2.01 -1.26 -0.09 115.64 119.73 2kui s THR 386 Ca 0.20 -0.09 -0.04 0.00 0.31 0.00 0.00 61.69 62.06 2kui s THR 386 Cb -0.11 -0.76 -0.01 0.00 0.01 0.00 0.00 72.50 71.64 2kui s THR 386 CO 0.11 0.30 -0.02 -0.22 -0.69 0.00 0.00 174.62 174.11 2kui s LEU 387 N 1.68 3.07 -0.17 4.42 2.96 0.69 -4.94 118.68 126.39 2kui s LEU 387 Ca 0.02 -0.44 -0.07 0.00 -0.22 0.00 0.00 54.13 53.41 2kui s LEU 387 Cb -0.13 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 2kui s LEU 387 CO -0.05 -0.05 0.08 0.00 -1.32 0.00 0.00 176.35 175.01 2kui s GLN 388 N 1.48 3.89 0.08 1.98 0.00 -1.26 -0.48 119.66 125.35 2kui s GLN 388 Ca 0.05 -0.31 0.07 0.00 -0.00 0.00 0.00 55.36 55.18 2kui s GLN 388 Cb -0.15 -3.21 -0.03 0.00 0.00 0.00 0.00 33.01 29.62 2kui s GLN 388 CO -0.02 0.36 -0.20 0.15 0.00 0.00 0.00 175.29 175.59 2kui s LYS 389 N 0.13 1.14 0.73 9.60 -0.14 0.39 -4.96 119.74 126.64 2kui s LYS 389 Ca 0.06 -1.05 -0.12 0.00 -1.36 0.00 0.00 55.97 53.50 2kui s LYS 389 Cb -0.12 -1.32 0.04 0.00 -1.68 0.00 0.00 37.83 34.75 2kui s LYS 389 CO 0.00 0.32 1.10 -2.14 -0.76 0.00 0.00 175.35 173.87 2kui s PRO 390 N -1.64 2.42 -1.16 -1.68 0.02 -1.26 0.04 135.00 131.74 2kui s PRO 390 Ca 0.05 1.27 -0.21 0.00 0.02 0.00 0.00 61.00 62.13 2kui s PRO 390 Cb -0.09 -1.91 -0.01 0.00 0.02 0.00 0.00 34.50 32.51 2kui s PRO 390 CO 0.03 -1.53 1.80 -0.51 -0.33 0.00 0.00 177.00 176.46 2kui s ASP 391 N -3.04 5.89 -0.77 2.53 1.11 0.11 -4.67 116.67 117.82 2kui s ASP 391 Ca 0.64 -1.78 -0.01 0.00 0.18 0.00 0.00 52.55 51.58 2kui s ASP 391 Cb -0.19 -2.58 0.37 0.00 1.07 0.00 0.00 42.92 41.59 2kui s ASP 391 CO 0.50 -2.14 1.88 -1.20 1.18 0.00 0.00 175.17 175.39 2kui n SER 392 N 11.45 7.09 -0.85 0.27 7.64 -1.26 -2.94 113.62 135.02 2kui n SER 392 Ca 0.44 -3.82 -0.11 0.00 1.01 0.00 0.00 58.87 56.39 2kui n SER 392 Cb 0.47 -0.96 -0.05 0.00 -1.01 0.00 0.00 64.21 62.66 2kui n SER 392 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2kui n THR 393 N -0.55 -0.01 -4.31 0.44 -1.04 -1.26 -5.00 114.28 102.54 2kui n THR 393 Ca 0.52 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 62.25 2kui n THR 393 Cb 0.33 -1.30 -0.10 0.00 -1.82 0.00 0.00 70.33 67.44 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 -2.41 2.96 -0.04 12.58 -4.36 -1.26 -5.03 121.20 123.64 2kui s ILE 394 Ca 0.00 -1.62 -0.03 0.00 -0.26 0.00 0.00 60.65 58.74 2kui s ILE 394 Cb 0.00 -2.41 -0.01 0.00 1.25 0.00 0.00 42.46 41.28 2kui s ILE 394 CO 0.00 -0.01 0.14 -2.65 0.24 0.00 0.00 174.94 172.65 2kui n PRO 395 N 0.42 0.00 -0.65 0.37 -0.02 -1.26 -4.87 135.00 128.99 2kui n PRO 395 Ca -0.13 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.04 2kui n PRO 395 Cb 0.54 -0.11 0.18 0.00 -0.02 0.00 0.00 33.50 34.09 2kui n PRO 395 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2kui n PRO 396 N 0.40 -0.85 0.00 0.52 -0.02 -1.26 -3.95 135.00 129.84 2kui n PRO 396 Ca 0.03 -0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 2kui n PRO 396 Cb -0.00 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 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 -4.03 0.00 -4.83 2.55 5.75 -1.26 -4.36 116.55 110.37 2kui n ASP 397 Ca 0.10 0.38 -0.37 0.00 -0.01 0.00 0.00 54.79 54.89 2kui n ASP 397 Cb 0.53 -0.38 -0.06 0.00 -1.03 0.00 0.00 41.12 40.17 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 -2.74 3.57 -0.17 2.11 3.76 -1.26 -3.62 115.29 116.94 2kui s HIS 398 Ca 0.00 0.56 -0.29 0.00 -0.15 0.00 0.00 55.06 55.18 2kui s HIS 398 Cb 0.00 -2.07 -0.02 0.00 1.11 0.00 0.00 32.58 31.60 2kui s HIS 398 CO 0.00 0.59 1.43 0.14 -0.85 0.00 0.00 174.74 176.05 2kui s VAL 399 N -0.63 3.98 -0.14 -0.90 -7.23 -1.26 -4.75 120.40 109.48 2kui s VAL 399 Ca 0.15 1.16 0.12 0.00 -1.81 0.00 0.00 61.98 61.60 2kui s VAL 399 Cb -0.13 -3.84 -0.17 0.00 0.56 0.00 0.00 36.38 32.81 2kui s VAL 399 CO 0.04 -0.20 0.04 0.00 -0.31 0.00 0.00 175.10 174.66 2kui n ILE 400 N 5.74 0.95 -3.86 -0.62 0.00 -1.26 -0.04 119.36 120.26 2kui n ILE 400 Ca 0.16 -0.57 -0.09 0.00 0.00 0.00 0.00 62.75 62.24 2kui n ILE 400 Cb 0.45 -0.66 -0.08 0.00 0.00 0.00 0.00 39.64 39.35 2kui n ILE 400 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2kui s GLY 401 N -4.75 0.08 0.20 4.50 0.00 -1.26 -4.39 107.32 101.69 2kui s GLY 401 Ca -0.08 -0.50 0.01 0.00 0.00 0.00 0.00 44.72 44.16 2kui s GLY 401 CO 0.56 -0.68 0.24 -1.30 0.00 0.00 0.00 173.10 171.92 2kui n THR 402 N 0.25 0.00 -3.62 0.90 -2.24 -1.26 -4.43 114.28 103.87 2kui n THR 402 Ca -0.17 -1.22 -0.37 0.00 -2.27 0.00 0.00 64.05 60.03 2kui n THR 402 Cb 0.61 0.68 -0.09 0.00 -2.10 0.00 0.00 70.33 69.43 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 -2.32 6.19 0.00 3.42 -1.08 -1.18 -4.95 116.67 116.75 2kui s ASP 403 Ca 0.20 0.21 0.00 0.00 -0.52 0.00 0.00 52.55 52.44 2kui s ASP 403 Cb 0.00 -2.13 0.00 0.00 -1.46 0.00 0.00 42.92 39.33 2kui s ASP 403 CO 0.14 0.06 0.18 -2.65 0.52 0.00 0.00 175.17 173.42 2kui n PRO 404 N 4.18 0.00 -0.05 4.34 -0.02 -1.26 -2.99 135.00 139.20 2kui n PRO 404 Ca -0.14 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.44 2kui n PRO 404 Cb 0.52 -1.19 0.49 0.00 -0.02 0.00 0.00 33.50 33.30 2kui n PRO 404 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kui h ALA 405 N 1.33 1.95 -0.36 3.55 0.00 -1.92 0.70 119.26 124.51 2kui h ALA 405 Ca 0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 2kui h ALA 405 Cb 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2kui h ALA 405 CO 0.00 -0.06 -0.19 0.00 0.00 0.00 0.00 179.25 179.01 2kui h ALA 406 N 1.72 1.01 -0.02 0.00 0.00 -1.85 -2.28 119.26 117.83 2kui h ALA 406 Ca 0.24 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2kui h ALA 406 Cb 0.40 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2kui h ALA 406 CO -0.06 0.59 0.00 0.09 0.00 0.00 0.00 179.25 179.87 2kui n ASN 407 N -4.14 0.89 -4.95 0.00 5.03 0.05 -0.30 115.26 111.83 2kui n ASN 407 Ca 0.00 -1.34 -0.24 0.00 0.87 0.00 0.00 54.58 53.88 2kui n ASN 407 Cb 0.39 -0.01 -0.02 0.00 -1.02 0.00 0.00 39.78 39.12 2kui n ASN 407 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2kui s THR 408 N -1.98 5.20 -0.35 3.41 2.01 -0.12 -4.80 115.64 119.01 2kui s THR 408 Ca 0.40 -0.64 -0.29 0.00 0.31 0.00 0.00 61.69 61.47 2kui s THR 408 Cb 0.20 -3.82 0.00 0.00 0.01 0.00 0.00 72.50 68.89 2kui s THR 408 CO 0.33 -0.36 1.42 -0.94 -0.69 0.00 0.00 174.62 174.39 2kui s SER 409 N -3.76 6.42 0.16 3.53 1.04 -1.26 -4.15 113.70 115.68 2kui s SER 409 Ca 0.37 1.05 0.06 0.00 0.48 0.00 0.00 55.95 57.91 2kui s SER 409 Cb -0.10 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.44 2kui s SER 409 CO 0.31 -1.32 -0.12 0.68 0.98 0.00 0.00 173.24 173.77 2kui s VAL 410 N 5.16 1.39 0.40 5.02 -7.23 0.10 -4.60 120.40 120.64 2kui s VAL 410 Ca 0.62 -2.06 -0.27 0.00 -1.81 0.00 0.00 61.98 58.46 2kui s VAL 410 Cb -0.16 -1.86 -0.10 0.00 0.56 0.00 0.00 36.38 34.82 2kui s VAL 410 CO 0.29 -0.64 1.46 -0.94 -0.31 0.00 0.00 175.10 174.96 2kui s SER 411 N -3.10 6.23 -0.26 4.85 1.04 -1.26 0.08 113.70 121.28 2kui s SER 411 Ca 0.17 2.99 -0.28 0.00 0.48 0.00 0.00 55.95 59.31 2kui s SER 411 Cb 0.00 -2.66 -0.03 0.00 0.10 0.00 0.00 66.02 63.43 2kui s SER 411 CO 0.03 -0.94 1.94 0.00 0.98 0.00 0.00 173.24 175.25 2kui s ALA 412 N -1.15 2.90 0.00 5.32 0.00 -1.26 -2.68 121.76 124.89 2kui s ALA 412 Ca 0.55 0.52 0.00 0.00 0.00 0.00 0.00 51.96 53.03 2kui s ALA 412 Cb -0.45 -4.01 0.00 0.00 0.00 0.00 0.00 23.12 18.66 2kui s ALA 412 CO 0.61 -2.56 0.00 0.41 0.00 0.00 0.00 175.76 174.22 2kui n GLY 413 N 5.42 1.01 3.72 0.00 0.00 -1.26 -4.97 105.19 109.11 2kui n GLY 413 Ca 0.25 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 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 1.27 -4.42 1.61 -0.08 -1.09 -4.41 116.55 109.42 2kui n ASP 414 Ca 0.00 -2.08 -0.39 0.00 -1.51 0.00 0.00 54.79 50.81 2kui n ASP 414 Cb 0.00 -0.63 -0.12 0.00 2.34 0.00 0.00 41.12 42.72 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 -5.01 3.25 -0.17 -0.67 2.02 -1.25 -0.42 118.70 116.44 2kui s GLU 415 Ca 0.64 -0.77 -0.05 0.00 0.02 0.00 0.00 54.97 54.80 2kui s GLU 415 Cb -0.04 -3.57 -0.03 0.00 0.10 0.00 0.00 34.13 30.60 2kui s GLU 415 CO 0.42 -0.45 -0.00 0.42 0.02 0.00 0.00 175.26 175.67 2kui s ILE 416 N 1.60 4.16 -0.05 -1.63 -1.09 -0.00 -4.84 121.20 119.35 2kui s ILE 416 Ca 0.04 -0.26 -0.25 0.00 -2.23 0.00 0.00 60.65 57.96 2kui s ILE 416 Cb -0.17 -2.85 -0.04 0.00 -1.58 0.00 0.00 42.46 37.82 2kui s ILE 416 CO 0.06 0.47 0.76 -0.89 -1.23 0.00 0.00 174.94 174.11 2kui s THR 417 N 0.50 4.99 -0.08 2.92 2.01 -1.26 -0.31 115.64 124.41 2kui s THR 417 Ca -0.01 1.57 0.02 0.00 0.31 0.00 0.00 61.69 63.59 2kui s THR 417 Cb -0.14 -4.10 -0.02 0.00 0.01 0.00 0.00 72.50 68.25 2kui s THR 417 CO 0.02 0.24 -0.15 0.54 -0.69 0.00 0.00 174.62 174.58 2kui s VAL 418 N 0.78 2.96 -0.19 3.82 0.11 0.87 -3.13 120.40 125.63 2kui s VAL 418 Ca 0.40 -0.73 -0.12 0.00 -2.93 0.00 0.00 61.98 58.60 2kui s VAL 418 Cb -0.19 -2.19 -0.05 0.00 -1.53 0.00 0.00 36.38 32.43 2kui s VAL 418 CO 0.20 0.56 0.24 0.20 -3.33 0.00 0.00 175.10 172.97 2kui s ASN 419 N -0.24 6.32 -0.08 3.54 0.01 -1.26 -0.22 114.94 123.01 2kui s ASN 419 Ca 0.01 0.37 0.04 0.00 -0.71 0.00 0.00 52.86 52.56 2kui s ASN 419 Cb -0.13 -2.15 0.00 0.00 0.41 0.00 0.00 41.25 39.38 2kui s ASN 419 CO 0.03 0.10 -0.19 -0.69 -1.51 0.00 0.00 177.10 174.83 2kui s VAL 420 N 0.63 1.67 -0.25 1.60 1.01 0.36 -4.67 120.40 120.75 2kui s VAL 420 Ca 0.13 -0.80 -0.11 0.00 0.00 0.00 0.00 61.98 61.20 2kui s VAL 420 Cb -0.13 -1.45 -0.05 0.00 0.00 0.00 0.00 36.38 34.75 2kui s VAL 420 CO 0.03 0.47 0.19 -0.94 0.00 0.00 0.00 175.10 174.85 2kui s SER 421 N 0.37 6.12 -0.27 3.32 1.04 -1.25 -0.46 113.70 122.56 2kui s SER 421 Ca -0.14 0.11 0.03 0.00 0.48 0.00 0.00 55.95 56.43 2kui s SER 421 Cb -0.16 -2.12 0.06 0.00 0.10 0.00 0.00 66.02 63.90 2kui s SER 421 CO 0.06 0.02 -0.08 0.28 0.98 0.00 0.00 173.24 174.50 2kui s THR 422 N 1.28 2.23 0.00 2.02 -1.32 0.11 -4.14 115.64 115.81 2kui s THR 422 Ca 0.08 -1.72 0.00 0.00 -1.21 0.00 0.00 61.69 58.84 2kui s THR 422 Cb -0.14 -2.36 0.00 0.00 -1.51 0.00 0.00 72.50 68.49 2kui s THR 422 CO 0.06 -0.11 0.00 0.61 -2.21 0.00 0.00 174.62 172.97 2kui n GLY 423 N 4.42 -3.15 3.70 6.08 0.00 -1.26 -3.83 105.19 111.15 2kui n GLY 423 Ca -0.12 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.75 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 -3.06 1.43 0.66 1.61 0.02 -1.26 0.04 135.00 134.43 2kui s PRO 424 Ca 0.00 1.56 -0.14 0.00 0.02 0.00 0.00 61.00 62.44 2kui s PRO 424 Cb 0.00 -1.77 -0.00 0.00 0.02 0.00 0.00 34.50 32.75 2kui s PRO 424 CO 0.00 -2.33 1.09 -1.21 -0.33 0.00 0.00 177.00 174.21 2kui s GLU 425 N -4.50 2.90 0.09 5.54 2.02 -1.15 -4.78 118.70 118.82 2kui s GLU 425 Ca 0.68 1.27 0.07 0.00 0.02 0.00 0.00 54.97 57.01 2kui s GLU 425 Cb -0.24 -1.97 -0.03 0.00 0.10 0.00 0.00 34.13 31.99 2kui s GLU 425 CO 0.55 -1.15 -0.18 -0.65 0.02 0.00 0.00 175.26 173.84 2kui s GLN 426 N -4.27 1.00 0.08 1.61 -0.21 -1.26 -4.13 119.66 112.48 2kui s GLN 426 Ca 0.64 -1.08 0.09 0.00 0.02 0.00 0.00 55.36 55.03 2kui s GLN 426 Cb -0.18 -1.16 -0.03 0.00 1.00 0.00 0.00 33.01 32.64 2kui s GLN 426 CO 0.43 0.26 -0.25 1.03 -2.12 0.00 0.00 175.29 174.65 2kui s ARG 427 N -1.86 1.49 0.19 2.91 1.81 0.46 -4.82 118.95 119.13 2kui s ARG 427 Ca 0.03 -1.16 -0.28 0.00 -1.72 0.00 0.00 55.73 52.60 2kui s ARG 427 Cb -0.10 -1.77 -0.08 0.00 -0.45 0.00 0.00 34.95 32.55 2kui s ARG 427 CO 0.03 0.44 0.86 -1.83 -0.68 0.00 0.00 175.30 174.12 2kui s GLU 428 N -1.60 4.70 -0.08 3.54 -1.05 -1.26 0.14 118.70 123.09 2kui s GLU 428 Ca 0.11 1.32 -0.30 0.00 -0.15 0.00 0.00 54.97 55.95 2kui s GLU 428 Cb -0.10 -3.29 -0.02 0.00 -0.44 0.00 0.00 34.13 30.29 2kui s GLU 428 CO 0.04 0.50 1.05 0.42 0.95 0.00 0.00 175.26 178.22 2kui s ILE 429 N -0.99 4.66 0.34 1.83 1.01 -0.10 -4.91 121.20 123.03 2kui s ILE 429 Ca 0.39 1.94 -0.28 0.00 0.00 0.00 0.00 60.65 62.70 2kui s ILE 429 Cb -0.24 -4.25 -0.09 0.00 0.01 0.00 0.00 42.46 37.89 2kui s ILE 429 CO 0.29 0.02 1.19 -2.84 0.00 0.00 0.00 174.94 173.60 2kui s PRO 430 N 1.97 4.33 -0.41 2.79 0.02 -1.26 -4.16 135.00 138.27 2kui s PRO 430 Ca 0.50 1.95 -0.29 0.00 0.02 0.00 0.00 61.00 63.19 2kui s PRO 430 Cb -0.20 -2.96 0.02 0.00 0.02 0.00 0.00 34.50 31.38 2kui s PRO 430 CO 0.20 -0.11 1.09 0.34 -0.33 0.00 0.00 177.00 178.18 2kui s ASP 431 N -0.84 6.73 0.07 2.53 2.15 -1.26 -4.96 116.67 121.09 2kui s ASP 431 Ca 0.50 0.65 0.08 0.00 0.43 0.00 0.00 52.55 54.21 2kui s ASP 431 Cb -0.34 -2.53 -0.04 0.00 -0.30 0.00 0.00 42.92 39.71 2kui s ASP 431 CO 0.44 -1.09 -0.17 -0.69 -0.17 0.00 0.00 175.17 173.49 2kui s VAL 432 N 4.07 2.88 0.33 1.11 1.01 -1.26 -5.09 120.40 123.45 2kui s VAL 432 Ca 0.46 -1.29 -0.29 0.00 0.00 0.00 0.00 61.98 60.86 2kui s VAL 432 Cb -0.09 -2.26 -0.12 0.00 0.00 0.00 0.00 36.38 33.91 2kui s VAL 432 CO 0.25 0.24 1.45 -1.54 0.00 0.00 0.00 175.10 175.50 2kui n SER 433 N 1.22 3.40 -0.02 3.32 3.41 -1.26 -4.89 113.62 118.81 2kui n SER 433 Ca -0.16 1.19 -0.01 0.00 -0.26 0.00 0.00 58.87 59.63 2kui n SER 433 Cb 0.52 -1.55 0.26 0.00 -0.26 0.00 0.00 64.21 63.18 2kui n SER 433 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2kui h THR 434 N 2.95 1.21 0.00 6.66 1.35 -1.99 -0.65 112.91 122.44 2kui h THR 434 Ca -0.48 -0.88 0.00 0.00 -0.55 0.00 0.00 66.41 64.50 2kui h THR 434 Cb 1.25 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.66 2kui h THR 434 CO 0.69 0.30 0.00 0.17 -0.25 0.00 0.00 175.52 176.43 2kui h LEU 435 N 0.53 0.00 -4.95 3.87 -0.00 -1.88 0.35 115.31 113.23 2kui h LEU 435 Ca 0.11 0.00 -0.73 0.00 -0.00 0.00 0.00 57.88 57.26 2kui h LEU 435 Cb 0.39 0.00 -0.31 0.00 -0.00 0.00 0.00 40.66 40.74 2kui h LEU 435 CO 0.02 0.00 0.62 0.41 -0.00 0.00 0.00 178.44 179.48 2kui n THR 436 N -2.60 3.41 -0.33 0.15 -1.04 -0.25 -4.77 114.28 108.86 2kui n THR 436 Ca 0.03 -4.55 0.12 0.00 -2.04 0.00 0.00 64.05 57.62 2kui n THR 436 Cb 0.37 -1.26 0.34 0.00 -1.82 0.00 0.00 70.33 67.95 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 2.95 0.98 -0.95 -1.42 3.20 -1.69 -0.83 116.97 119.21 2kui h TYR 437 Ca 0.50 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.42 2kui h TYR 437 Cb 0.25 -0.30 -0.05 0.00 1.54 0.00 0.00 36.73 38.17 2kui h TYR 437 CO 1.10 0.29 0.63 0.00 -1.64 0.00 0.00 178.16 178.53 2kui h ALA 438 N 1.61 1.23 -0.21 1.82 0.00 -1.93 -0.26 119.26 121.51 2kui h ALA 438 Ca 0.52 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.24 2kui h ALA 438 Cb 0.81 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2kui h ALA 438 CO -0.30 0.56 -0.45 1.49 0.00 0.00 0.00 179.25 180.55 2kui h GLU 439 N 1.25 0.53 -0.61 0.00 4.57 -1.57 -2.64 114.58 116.12 2kui h GLU 439 Ca 0.36 -0.29 -0.00 0.00 -1.18 0.00 0.00 59.36 58.25 2kui h GLU 439 Cb -0.09 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 2kui h GLU 439 CO -0.09 0.88 0.36 0.00 -1.18 0.00 0.00 179.01 178.97 2kui h ALA 440 N 1.08 0.77 -0.28 2.92 0.00 -0.44 -0.77 119.26 122.55 2kui h ALA 440 Ca 0.03 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2kui h ALA 440 Cb 0.96 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2kui h ALA 440 CO 0.09 0.26 0.13 0.28 0.00 0.00 0.00 179.25 180.00 2kui h VAL 441 N 0.82 0.98 -0.25 0.00 2.07 -0.84 -0.91 116.25 118.12 2kui h VAL 441 Ca 0.22 -0.09 -0.10 0.00 0.82 0.00 0.00 66.70 67.55 2kui h VAL 441 Cb -0.01 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 2kui h VAL 441 CO -0.04 0.05 -0.26 0.07 0.02 0.00 0.00 177.57 177.41 2kui h LYS 442 N 0.27 0.47 -0.63 1.57 2.10 -1.13 -1.78 116.57 117.46 2kui h LYS 442 Ca 0.12 -0.18 -0.03 0.00 -2.00 0.00 0.00 60.65 58.56 2kui h LYS 442 Cb 0.05 -0.03 -0.03 0.00 -0.90 0.00 0.00 32.23 31.32 2kui h LYS 442 CO -0.09 0.70 0.29 0.87 -2.00 0.00 0.00 179.45 179.22 2kui h LYS 443 N 0.42 0.91 -0.39 0.07 1.79 -0.57 0.13 116.57 118.92 2kui h LYS 443 Ca 0.06 -0.14 -0.05 0.00 -2.18 0.00 0.00 60.65 58.34 2kui h LYS 443 Cb 0.68 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 31.15 2kui h LYS 443 CO 0.05 0.74 0.04 -0.07 -1.08 0.00 0.00 179.45 179.13 2kui h LEU 444 N 0.86 0.56 -0.18 2.94 4.07 -0.89 -0.54 115.31 122.12 2kui h LEU 444 Ca 0.21 -0.10 -0.05 0.00 0.08 0.00 0.00 57.88 58.02 2kui h LEU 444 Cb 0.13 -0.15 -0.00 0.00 1.08 0.00 0.00 40.66 41.72 2kui h LEU 444 CO -0.03 0.60 -0.08 0.74 -1.08 0.00 0.00 178.44 178.60 2kui h THR 445 N 0.58 1.31 0.00 0.22 2.02 -0.51 0.14 112.91 116.66 2kui h THR 445 Ca 0.13 -1.12 0.00 0.00 0.77 0.00 0.00 66.41 66.19 2kui h THR 445 Cb 0.31 1.65 0.00 0.00 -1.74 0.00 0.00 68.15 68.37 2kui h THR 445 CO 0.01 0.34 0.00 0.00 0.37 0.00 0.00 175.52 176.23 2kui h ALA 446 N 0.70 1.00 -0.07 6.16 0.00 -0.52 -2.70 119.26 123.84 2kui h ALA 446 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2kui h ALA 446 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2kui h ALA 446 CO 0.03 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.28 2kui n ALA 447 N -1.94 2.56 0.00 0.00 0.00 -0.23 -4.96 120.51 115.94 2kui n ALA 447 Ca 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2kui n ALA 447 Cb 0.30 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.56 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 0.87 2.07 0.20 0.00 0.00 -1.02 -4.70 105.19 102.61 2kui n GLY 448 Ca 0.13 -0.68 -0.05 0.00 0.00 0.00 0.00 46.02 45.41 2kui n GLY 448 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2kui n PHE 449 N 0.00 -0.21 -2.38 1.61 1.16 -1.26 -4.85 117.46 111.54 2kui n PHE 449 Ca 0.00 0.59 -0.20 0.00 -1.87 0.00 0.00 57.45 55.97 2kui n PHE 449 Cb 0.00 -0.54 -0.01 0.00 -1.61 0.00 0.00 39.48 37.32 2kui n PHE 449 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2kui n GLY 450 N -1.12 -0.42 3.37 4.97 0.00 0.02 -4.92 105.19 107.09 2kui n GLY 450 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 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 -5.01 2.90 0.07 1.61 1.81 -1.26 -4.76 118.95 114.32 2kui s ARG 451 Ca 0.00 -1.02 0.03 0.00 -1.72 0.00 0.00 55.73 53.02 2kui s ARG 451 Cb 0.00 -3.66 -0.03 0.00 -0.45 0.00 0.00 34.95 30.80 2kui s ARG 451 CO 0.00 -0.64 -0.09 -0.59 -0.68 0.00 0.00 175.30 173.30 2kui s PHE 452 N 1.55 0.92 -0.14 -0.53 -0.12 -1.25 -0.76 117.98 117.64 2kui s PHE 452 Ca 0.02 -0.61 -0.06 0.00 -0.05 0.00 0.00 56.93 56.23 2kui s PHE 452 Cb -0.19 -0.52 0.07 0.00 -0.63 0.00 0.00 43.02 41.75 2kui s PHE 452 CO 0.06 -0.04 0.31 0.21 -0.05 0.00 0.00 175.22 175.70 2kui s LYS 453 N -2.37 0.22 -0.05 1.99 2.47 -0.52 -4.90 119.74 116.57 2kui s LYS 453 Ca -0.00 0.77 -0.26 0.00 -1.56 0.00 0.00 55.97 54.92 2kui s LYS 453 Cb -0.05 0.02 -0.03 0.00 -1.46 0.00 0.00 37.83 36.31 2kui s LYS 453 CO -0.00 -0.24 0.82 -1.14 0.16 0.00 0.00 175.35 174.95 2kui s GLN 454 N 2.14 4.47 0.05 4.03 0.74 -1.26 0.12 119.66 129.95 2kui s GLN 454 Ca -0.02 1.10 0.09 0.00 0.05 0.00 0.00 55.36 56.58 2kui s GLN 454 Cb -0.11 -3.46 -0.03 0.00 1.10 0.00 0.00 33.01 30.50 2kui s GLN 454 CO -0.10 -0.02 -0.26 0.00 -0.55 0.00 0.00 175.29 174.36 2kui s ALA 455 N 1.01 2.25 -0.04 1.58 0.00 0.12 -4.92 121.76 121.76 2kui s ALA 455 Ca 0.43 -1.28 0.06 0.00 0.00 0.00 0.00 51.96 51.17 2kui s ALA 455 Cb -0.19 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.45 2kui s ALA 455 CO 0.21 0.53 -0.22 -0.80 0.00 0.00 0.00 175.76 175.48 2kui s ASN 456 N -1.28 2.71 -0.13 0.00 0.01 -1.26 -0.26 114.94 114.73 2kui s ASN 456 Ca 0.12 -0.44 -0.11 0.00 -0.71 0.00 0.00 52.86 51.72 2kui s ASN 456 Cb -0.10 -0.60 0.04 0.00 0.41 0.00 0.00 41.25 40.99 2kui s ASN 456 CO 0.02 0.23 0.34 -0.44 -1.51 0.00 0.00 177.10 175.75 2kui s SER 457 N -0.23 -0.36 0.14 -1.22 0.01 -0.79 -4.94 113.70 106.30 2kui s SER 457 Ca 0.00 0.69 -0.31 0.00 1.31 0.00 0.00 55.95 57.65 2kui s SER 457 Cb -0.12 0.68 -0.09 0.00 0.21 0.00 0.00 66.02 66.70 2kui s SER 457 CO 0.02 -0.13 1.52 -2.84 0.41 0.00 0.00 173.24 172.22 2kui s PRO 458 N 0.38 4.24 0.35 12.44 0.02 -1.24 -0.18 135.00 151.01 2kui s PRO 458 Ca -0.02 2.27 -0.06 0.00 0.02 0.00 0.00 61.00 63.22 2kui s PRO 458 Cb -0.04 -3.23 0.02 0.00 0.02 0.00 0.00 34.50 31.27 2kui s PRO 458 CO -0.01 -0.57 0.56 0.43 -0.33 0.00 0.00 177.00 177.07 2kui n SER 459 N 4.16 -1.58 -4.51 2.53 7.64 -0.32 -4.85 113.62 116.69 2kui n SER 459 Ca 0.13 -2.73 -0.49 0.00 1.01 0.00 0.00 58.87 56.80 2kui n SER 459 Cb 0.40 2.82 -0.04 0.00 -1.01 0.00 0.00 64.21 66.38 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 -0.54 1.34 -0.12 0.44 5.66 -1.26 -4.68 114.28 115.12 2kui n THR 460 Ca -0.02 -0.34 0.26 0.00 -3.05 0.00 0.00 64.05 60.90 2kui n THR 460 Cb 0.56 -0.50 0.72 0.00 -1.55 0.00 0.00 70.33 69.56 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 2.30 0.00 -0.02 1.09 0.13 -1.93 0.59 132.00 134.15 2kui h PRO 461 Ca -0.39 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.63 2kui h PRO 461 Cb 1.38 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.50 2kui h PRO 461 CO 0.63 0.00 -0.51 1.05 -0.23 0.00 0.00 178.00 178.94 2kui h GLU 462 N 0.00 0.06 -0.00 0.86 4.11 -1.99 -2.94 114.58 114.68 2kui h GLU 462 Ca 0.37 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.76 2kui h GLU 462 Cb 1.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.79 2kui h GLU 462 CO -0.00 0.57 -0.69 1.28 0.07 0.00 0.00 179.01 180.23 2kui n LEU 463 N -3.93 0.98 -4.71 3.06 7.99 0.14 -4.81 117.00 115.71 2kui n LEU 463 Ca -0.02 -0.35 -0.42 0.00 -0.01 0.00 0.00 56.01 55.22 2kui n LEU 463 Cb 0.53 -0.09 -0.03 0.00 -0.11 0.00 0.00 43.42 43.72 2kui n LEU 463 CO 0.41 0.22 1.41 -0.69 -1.51 0.00 0.00 177.39 177.24 2kui s VAL 464 N -2.88 2.31 0.00 4.08 1.01 -0.83 -1.09 120.40 123.00 2kui s VAL 464 Ca 0.12 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.16 2kui s VAL 464 Cb 0.17 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.51 2kui s VAL 464 CO 0.74 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.45 2kui n GLY 465 N 4.09 2.32 3.81 4.51 0.00 0.14 -4.94 105.19 115.13 2kui n GLY 465 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.55 2.53 0.30 1.61 1.02 -0.25 -4.85 119.74 119.55 2kui s LYS 466 Ca 0.00 -1.47 -0.29 0.00 0.02 0.00 0.00 55.97 54.23 2kui s LYS 466 Cb 0.00 -2.32 -0.09 0.00 -0.52 0.00 0.00 37.83 34.90 2kui s LYS 466 CO 0.00 0.02 1.12 0.08 -0.92 0.00 0.00 175.35 175.65 2kui s VAL 467 N -2.40 3.42 -0.19 3.17 1.01 0.12 -0.14 120.40 125.38 2kui s VAL 467 Ca 0.41 1.38 0.08 0.00 0.00 0.00 0.00 61.98 63.85 2kui s VAL 467 Cb -0.03 -3.86 -0.22 0.00 0.00 0.00 0.00 36.38 32.27 2kui s VAL 467 CO 0.25 0.29 0.07 -0.38 0.00 0.00 0.00 175.10 175.34 2kui n ILE 468 N 0.96 1.51 -0.32 2.22 5.41 0.83 -4.76 119.36 125.22 2kui n ILE 468 Ca -0.00 -0.71 0.00 0.00 1.00 0.00 0.00 62.75 63.04 2kui n ILE 468 Cb 0.45 -1.09 0.00 0.00 -0.71 0.00 0.00 39.64 38.29 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 1.96 -1.72 3.48 7.39 0.00 -1.15 -5.04 105.19 110.11 2kui n GLY 469 Ca -0.36 -1.11 -0.31 0.00 0.00 0.00 0.00 46.02 44.24 2kui n GLY 469 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 470 N -2.09 2.94 0.07 2.61 -4.23 -1.26 -1.80 115.64 111.87 2kui s THR 470 Ca 0.00 -1.04 -0.33 0.00 -1.18 0.00 0.00 61.69 59.13 2kui s THR 470 Cb 0.00 -2.22 -0.19 0.00 1.34 0.00 0.00 72.50 71.43 2kui s THR 470 CO 0.00 0.40 1.60 -1.13 -0.54 0.00 0.00 174.62 174.94 2kui h ASN 471 N 4.71 -0.82 -4.14 3.99 -0.73 -1.31 -3.42 115.58 113.85 2kui h ASN 471 Ca -0.47 0.02 -0.49 0.00 1.87 0.00 0.00 56.30 57.23 2kui h ASN 471 Cb 1.15 0.21 0.07 0.00 0.27 0.00 0.00 38.32 40.03 2kui h ASN 471 CO 0.49 -0.58 0.39 -2.16 -0.37 0.00 0.00 177.43 175.21 2kui s PRO 472 N -5.98 3.29 0.15 6.67 0.04 -1.26 -4.95 135.00 132.95 2kui s PRO 472 Ca -0.18 1.40 -0.31 0.00 0.04 0.00 0.00 61.00 61.95 2kui s PRO 472 Cb 0.03 -2.02 -0.10 0.00 0.04 0.00 0.00 34.50 32.45 2kui s PRO 472 CO 0.61 -0.86 1.69 -2.14 0.04 0.00 0.00 177.00 176.34 2kui s PRO 473 N -3.70 4.17 0.00 0.56 0.02 -1.26 -4.86 135.00 129.93 2kui s PRO 473 Ca 0.68 2.48 0.09 0.00 0.02 0.00 0.00 61.00 64.27 2kui s PRO 473 Cb -0.19 -3.33 0.56 0.00 0.02 0.00 0.00 34.50 31.56 2kui s PRO 473 CO 0.32 -0.73 1.22 0.00 -0.33 0.00 0.00 177.00 177.48 2kui n ALA 474 N 4.73 2.39 0.51 -1.55 0.00 -1.26 -0.93 120.51 124.40 2kui n ALA 474 Ca 0.16 -0.06 0.06 0.00 0.00 0.00 0.00 53.44 53.59 2kui n ALA 474 Cb 0.38 -1.15 -0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 -0.68 1.27 -4.76 0.00 5.03 -1.26 -4.03 115.26 110.83 2kui n ASN 475 Ca 0.07 -1.14 -0.30 0.00 0.87 0.00 0.00 54.58 54.09 2kui n ASN 475 Cb 0.03 0.50 -0.07 0.00 -1.02 0.00 0.00 39.78 39.22 2kui n ASN 475 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2kui s GLN 476 N -1.52 2.17 -0.01 3.52 -1.52 -0.10 -4.69 119.66 117.51 2kui s GLN 476 Ca 0.09 -2.21 -0.27 0.00 -1.95 0.00 0.00 55.36 51.03 2kui s GLN 476 Cb 0.09 -1.72 -0.04 0.00 -0.22 0.00 0.00 33.01 31.13 2kui s GLN 476 CO 0.30 -0.33 0.83 0.95 -0.25 0.00 0.00 175.29 176.79 2kui s THR 477 N -2.79 4.89 0.10 -0.19 -4.23 -1.26 -0.93 115.64 111.23 2kui s THR 477 Ca 0.20 1.74 0.10 0.00 -1.18 0.00 0.00 61.69 62.56 2kui s THR 477 Cb 0.02 -4.17 -0.04 0.00 1.34 0.00 0.00 72.50 69.65 2kui s THR 477 CO 0.11 0.24 -0.25 -0.44 -0.54 0.00 0.00 174.62 173.74 2kui s SER 478 N 0.67 3.09 0.63 3.99 0.01 0.12 -4.85 113.70 117.36 2kui s SER 478 Ca 0.44 -0.69 -0.14 0.00 1.31 0.00 0.00 55.95 56.86 2kui s SER 478 Cb -0.20 -0.22 -0.02 0.00 0.21 0.00 0.00 66.02 65.79 2kui s SER 478 CO 0.23 0.17 1.06 0.00 0.41 0.00 0.00 173.24 175.11 2kui s ALA 479 N -1.02 2.72 0.27 1.44 0.00 -1.26 -0.40 121.76 123.52 2kui s ALA 479 Ca 0.12 0.29 0.19 0.00 0.00 0.00 0.00 51.96 52.56 2kui s ALA 479 Cb -0.10 -3.21 0.86 0.00 0.00 0.00 0.00 23.12 20.67 2kui s ALA 479 CO 0.05 -0.95 1.83 0.82 0.00 0.00 0.00 175.76 177.51 2kui h ILE 480 N 0.06 0.91 -0.35 0.00 1.08 -1.94 -1.32 117.51 115.94 2kui h ILE 480 Ca -0.46 -1.24 0.00 0.00 -0.39 0.00 0.00 64.86 62.77 2kui h ILE 480 Cb 1.22 1.74 0.00 0.00 -3.07 0.00 0.00 36.82 36.70 2kui h ILE 480 CO 0.57 0.31 0.00 1.07 -0.69 0.00 0.00 178.15 179.41 2kui n THR 481 N -3.70 0.45 -3.52 -0.27 5.66 -1.26 -3.99 114.28 107.65 2kui n THR 481 Ca -0.01 -0.67 -0.37 0.00 -3.05 0.00 0.00 64.05 59.94 2kui n THR 481 Cb 0.42 0.86 -0.06 0.00 -1.55 0.00 0.00 70.33 70.00 2kui n THR 481 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 2kui s ASN 482 N -1.49 6.64 -0.15 1.09 2.47 -0.50 -5.05 114.94 117.94 2kui s ASN 482 Ca 0.38 0.76 -0.20 0.00 0.42 0.00 0.00 52.86 54.21 2kui s ASN 482 Cb 0.22 -2.22 -0.03 0.00 -1.45 0.00 0.00 41.25 37.77 2kui s ASN 482 CO 0.31 0.22 0.58 0.54 -3.72 0.00 0.00 177.10 175.03 2kui s VAL 483 N -0.37 5.09 -0.29 -5.21 0.11 -1.26 -4.58 120.40 113.88 2kui s VAL 483 Ca 0.21 1.13 -0.14 0.00 -2.93 0.00 0.00 61.98 60.25 2kui s VAL 483 Cb -0.15 -3.91 -0.03 0.00 -1.53 0.00 0.00 36.38 30.76 2kui s VAL 483 CO 0.09 0.21 0.34 -0.69 -3.33 0.00 0.00 175.10 171.73 2kui s VAL 484 N 1.27 5.19 -0.20 2.04 1.01 0.06 -4.93 120.40 124.84 2kui s VAL 484 Ca 0.29 0.35 -0.11 0.00 0.00 0.00 0.00 61.98 62.51 2kui s VAL 484 Cb -0.16 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 2kui s VAL 484 CO 0.12 0.09 0.17 -0.51 0.00 0.00 0.00 175.10 174.96 2kui s ILE 485 N 2.01 5.38 -0.12 2.22 -1.16 -1.26 -1.44 121.20 126.83 2kui s ILE 485 Ca 0.13 0.26 0.02 0.00 -0.51 0.00 0.00 60.65 60.55 2kui s ILE 485 Cb -0.16 -3.51 -0.00 0.00 0.61 0.00 0.00 42.46 39.40 2kui s ILE 485 CO 0.11 0.41 -0.21 -0.63 -2.81 0.00 0.00 174.94 171.81 2kui s ILE 486 N 0.52 2.30 -0.21 2.00 1.01 0.12 -0.72 121.20 126.21 2kui s ILE 486 Ca 0.09 -0.92 -0.08 0.00 0.00 0.00 0.00 60.65 59.74 2kui s ILE 486 Cb -0.12 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 2kui s ILE 486 CO 0.00 0.55 0.09 -0.51 0.00 0.00 0.00 174.94 175.07 2kui s ILE 487 N 0.52 4.84 0.11 2.92 2.07 -0.74 0.13 121.20 131.05 2kui s ILE 487 Ca -0.13 -0.00 0.05 0.00 -1.41 0.00 0.00 60.65 59.16 2kui s ILE 487 Cb -0.17 -3.22 -0.04 0.00 0.13 0.00 0.00 42.46 39.16 2kui s ILE 487 CO 0.05 0.40 0.00 0.68 -1.91 0.00 0.00 174.94 174.16 2kui s VAL 488 N 0.87 3.94 0.10 4.00 -7.23 0.64 -0.12 120.40 122.60 2kui s VAL 488 Ca 0.05 -1.10 -0.27 0.00 -1.81 0.00 0.00 61.98 58.85 2kui s VAL 488 Cb -0.13 -2.91 -0.06 0.00 0.56 0.00 0.00 36.38 33.84 2kui s VAL 488 CO 0.03 0.06 0.86 -0.83 -0.31 0.00 0.00 175.10 174.90 2kui s GLY 489 N -2.48 2.92 0.21 2.32 0.00 0.80 -1.89 107.32 109.20 2kui s GLY 489 Ca 0.26 0.43 0.08 0.00 0.00 0.00 0.00 44.72 45.49 2kui s GLY 489 CO 0.18 1.22 -0.14 -0.45 0.00 0.00 0.00 173.10 173.91 2kui s SER 490 N -0.23 2.65 0.00 1.64 0.15 0.75 0.28 113.70 118.94 2kui s SER 490 Ca 0.42 -1.03 0.00 0.00 0.70 0.00 0.00 55.95 56.04 2kui s SER 490 Cb -0.22 -0.15 0.00 0.00 -1.71 0.00 0.00 66.02 63.94 2kui s SER 490 CO 0.27 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.16 2kui n GLY 491 N -0.41 0.91 3.79 9.45 0.00 -1.26 -1.17 105.19 116.50 2kui n GLY 491 Ca -0.08 0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.97 2kui n GLY 491 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2kui s PRO 492 N -0.02 3.59 -1.17 1.61 0.02 -1.26 -4.92 135.00 132.85 2kui s PRO 492 Ca 0.00 1.48 -0.14 0.00 0.02 0.00 0.00 61.00 62.36 2kui s PRO 492 Cb 0.00 -2.05 0.18 0.00 0.02 0.00 0.00 34.50 32.65 2kui s PRO 492 CO 0.00 -0.63 1.35 0.00 -0.33 0.00 0.00 177.00 177.40 2kui s ALA 493 N -1.88 4.05 0.18 -1.55 0.00 -1.26 -4.97 121.76 116.33 2kui s ALA 493 Ca 0.70 -3.38 0.10 0.00 0.00 0.00 0.00 51.96 49.38 2kui s ALA 493 Cb -0.20 -4.03 -0.04 0.00 0.00 0.00 0.00 23.12 18.85 2kui s ALA 493 CO 0.23 -2.70 -0.19 0.95 0.00 0.00 0.00 175.76 174.05 2kui s THR 494 N 1.25 2.67 -0.01 0.00 -4.23 -1.26 -0.43 115.64 113.62 2kui s THR 494 Ca 0.40 -1.84 0.01 0.00 -1.18 0.00 0.00 61.69 59.08 2kui s THR 494 Cb -0.04 -2.28 0.01 0.00 1.34 0.00 0.00 72.50 71.52 2kui s THR 494 CO -0.02 -0.08 -0.03 -0.54 -0.54 0.00 0.00 174.62 173.41 2kui s LYS 495 N -2.63 0.32 -0.20 3.99 -0.14 0.86 -4.79 119.74 117.16 2kui s LYS 495 Ca 0.21 -0.07 -0.27 0.00 -1.36 0.00 0.00 55.97 54.48 2kui s LYS 495 Cb -0.09 -0.36 -0.00 0.00 -1.68 0.00 0.00 37.83 35.70 2kui s LYS 495 CO 0.11 0.01 0.93 -0.51 -0.76 0.00 0.00 175.35 175.14 2kui s ASP 496 N 0.25 7.02 -0.09 2.83 1.11 -1.26 -0.86 116.67 125.67 2kui s ASP 496 Ca -0.02 1.27 -0.30 0.00 0.18 0.00 0.00 52.55 53.68 2kui s ASP 496 Cb -0.05 -2.50 -0.03 0.00 1.07 0.00 0.00 42.92 41.41 2kui s ASP 496 CO -0.01 -0.54 1.22 0.27 1.18 0.00 0.00 175.17 177.30 2kui s ILE 497 N 2.70 4.26 0.58 0.77 -4.36 0.35 -4.86 121.20 120.64 2kui s ILE 497 Ca 0.41 1.57 -0.06 0.00 -0.26 0.00 0.00 60.65 62.31 2kui s ILE 497 Cb -0.16 -4.01 0.01 0.00 1.25 0.00 0.00 42.46 39.55 2kui s ILE 497 CO 0.09 -0.04 0.89 -2.16 0.24 0.00 0.00 174.94 173.96 2kui s PRO 498 N 2.59 2.95 0.33 0.37 0.04 -1.26 -1.20 135.00 138.82 2kui s PRO 498 Ca 0.55 -0.02 -0.21 0.00 0.04 0.00 0.00 61.00 61.37 2kui s PRO 498 Cb -0.24 -2.29 -0.10 0.00 0.04 0.00 0.00 34.50 31.92 2kui s PRO 498 CO 0.20 -0.67 0.86 0.34 0.04 0.00 0.00 177.00 177.77 2kui s ASP 499 N -4.29 7.04 0.00 6.66 2.15 -1.26 -4.92 116.67 122.05 2kui s ASP 499 Ca 0.53 1.59 0.00 0.00 0.43 0.00 0.00 52.55 55.11 2kui s ASP 499 Cb -0.10 -2.49 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 2kui s ASP 499 CO 0.45 -0.16 0.66 0.55 -0.17 0.00 0.00 175.17 176.49 2kui n VAL 500 N 0.04 0.40 -2.26 1.11 3.14 -1.26 -5.07 118.33 114.43 2kui n VAL 500 Ca 0.03 -0.44 -0.31 0.00 -2.96 0.00 0.00 64.34 60.66 2kui n VAL 500 Cb 0.52 0.89 -0.01 0.00 -1.06 0.00 0.00 33.84 34.18 2kui n VAL 500 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kui s ALA 501 N -0.40 3.14 0.00 1.55 0.00 -1.26 -4.06 121.76 120.73 2kui s ALA 501 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.94 2kui s ALA 501 Cb 0.00 -3.02 0.00 0.00 0.00 0.00 0.00 23.12 20.10 2kui s ALA 501 CO 0.00 -0.40 0.00 0.41 0.00 0.00 0.00 175.76 175.77 2kui n GLY 502 N -2.06 0.79 3.70 0.00 0.00 0.84 -4.99 105.19 103.46 2kui n GLY 502 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.57 2.09 0.54 1.61 -0.21 -1.25 -4.93 119.66 116.94 2kui s GLN 503 Ca 0.00 -2.29 -0.08 0.00 0.02 0.00 0.00 55.36 53.01 2kui s GLN 503 Cb 0.00 -1.51 -0.04 0.00 1.00 0.00 0.00 33.01 32.46 2kui s GLN 503 CO 0.00 -0.26 0.90 -0.08 -2.12 0.00 0.00 175.29 173.73 2kui s THR 504 N -2.85 4.81 0.23 -0.19 -1.32 -1.26 -0.56 115.64 114.50 2kui s THR 504 Ca 0.17 0.53 -0.10 0.00 -1.21 0.00 0.00 61.69 61.07 2kui s THR 504 Cb 0.05 -3.86 0.26 0.00 -1.51 0.00 0.00 72.50 67.43 2kui s THR 504 CO 0.09 -0.98 1.63 0.58 -2.21 0.00 0.00 174.62 173.73 2kui h VAL 505 N 0.00 0.35 -0.64 5.08 2.07 -1.38 0.25 116.25 121.98 2kui h VAL 505 Ca -0.46 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.01 2kui h VAL 505 Cb 1.20 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 2kui h VAL 505 CO 0.62 0.01 0.24 0.44 0.02 0.00 0.00 177.57 178.90 2kui h ASP 506 N 0.05 0.90 0.03 0.57 3.32 -1.93 -0.64 116.42 118.72 2kui h ASP 506 Ca 0.36 -0.18 -0.26 0.00 0.02 0.00 0.00 57.03 56.96 2kui h ASP 506 Cb 0.58 -0.23 0.02 0.00 0.22 0.00 0.00 39.33 39.92 2kui h ASP 506 CO -0.66 0.84 -1.03 0.58 -1.72 0.00 0.00 179.24 177.25 2kui h VAL 507 N 0.91 1.30 -0.34 -1.35 2.07 -1.62 -2.40 116.25 114.83 2kui h VAL 507 Ca 0.21 -2.27 -0.02 0.00 0.82 0.00 0.00 66.70 65.44 2kui h VAL 507 Cb 0.23 2.48 -0.01 0.00 -1.52 0.00 0.00 31.29 32.47 2kui h VAL 507 CO -0.01 0.69 0.13 0.00 0.02 0.00 0.00 177.57 178.40 2kui h ALA 508 N 0.36 0.44 -0.37 1.67 0.00 -0.34 -0.31 119.26 120.71 2kui h ALA 508 Ca -0.14 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 2kui h ALA 508 Cb 1.70 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.34 2kui h ALA 508 CO 0.20 0.04 -0.06 1.96 0.00 0.00 0.00 179.25 181.39 2kui h GLN 509 N 0.40 0.61 -0.34 0.00 4.20 -1.19 0.08 115.11 118.87 2kui h GLN 509 Ca 0.11 -0.17 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 2kui h GLN 509 Cb 0.19 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 2kui h GLN 509 CO -0.01 0.68 0.15 -0.22 -0.67 0.00 0.00 178.83 178.76 2kui h LYS 510 N 0.57 0.50 -0.58 1.46 1.63 -0.94 -0.48 116.57 118.73 2kui h LYS 510 Ca 0.11 -0.08 -0.05 0.00 -0.85 0.00 0.00 60.65 59.78 2kui h LYS 510 Cb 0.45 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.97 2kui h LYS 510 CO 0.02 0.48 0.16 -0.91 -3.45 0.00 0.00 179.45 175.75 2kui h ASN 511 N 0.41 0.82 -0.69 4.20 2.35 -0.69 -0.99 115.58 120.99 2kui h ASN 511 Ca 0.12 -0.14 0.01 0.00 -0.55 0.00 0.00 56.30 55.73 2kui h ASN 511 Cb 0.15 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.27 2kui h ASN 511 CO -0.01 0.79 0.45 0.25 -1.65 0.00 0.00 177.43 177.26 2kui h LEU 512 N 0.85 0.78 -0.98 1.61 5.85 -0.55 -0.23 115.31 122.65 2kui h LEU 512 Ca 0.19 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 2kui h LEU 512 Cb 0.28 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 2kui h LEU 512 CO -0.00 0.56 0.22 0.78 -0.34 0.00 0.00 178.44 179.66 2kui h ASN 513 N 0.92 0.89 -0.14 1.25 -0.26 -0.39 -1.41 115.58 116.45 2kui h ASN 513 Ca 0.26 -0.14 -0.04 0.00 -0.56 0.00 0.00 56.30 55.81 2kui h ASN 513 Cb -0.09 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 36.92 2kui h ASN 513 CO -0.06 0.82 -0.03 0.58 -1.06 0.00 0.00 177.43 177.68 2kui h VAL 514 N 0.94 1.18 0.00 2.81 2.07 -0.34 -1.80 116.25 121.10 2kui h VAL 514 Ca 0.21 -0.72 -0.06 0.00 0.82 0.00 0.00 66.70 66.95 2kui h VAL 514 Cb 0.23 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 2kui h VAL 514 CO -0.01 0.24 -0.30 1.88 0.02 0.00 0.00 177.57 179.40 2kui h TYR 515 N 0.39 0.00 0.00 1.57 0.05 0.04 -3.46 116.97 115.56 2kui h TYR 515 Ca 0.08 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.86 2kui h TYR 515 Cb 0.31 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.05 2kui h TYR 515 CO 0.01 0.30 0.00 0.41 -1.05 0.00 0.00 178.16 177.83 2kui n GLY 516 N -0.34 1.41 3.63 3.88 0.00 -0.68 -5.08 105.19 108.02 2kui n GLY 516 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.84 2.95 -0.53 1.61 0.08 -1.02 -4.63 117.98 115.60 2kui s PHE 517 Ca 0.00 1.03 0.24 0.00 0.12 0.00 0.00 56.93 58.32 2kui s PHE 517 Cb 0.00 -3.86 0.31 0.00 -0.57 0.00 0.00 43.02 38.90 2kui s PHE 517 CO 0.00 -1.14 1.34 1.79 -0.10 0.00 0.00 175.22 177.11 2kui h THR 518 N 5.87 0.00 -3.42 0.64 1.35 -1.78 -3.15 112.91 112.42 2kui h THR 518 Ca -0.23 -0.67 -0.67 0.00 -0.55 0.00 0.00 66.41 64.29 2kui h THR 518 Cb 1.07 1.33 -0.30 0.00 -1.73 0.00 0.00 68.15 68.52 2kui h THR 518 CO 1.05 0.00 -0.83 -0.54 -0.25 0.00 0.00 175.52 174.95 2kui s LYS 519 N -3.21 3.12 0.14 4.72 1.02 -1.26 -5.01 119.74 119.26 2kui s LYS 519 Ca 0.05 -0.79 0.05 0.00 0.02 0.00 0.00 55.97 55.30 2kui s LYS 519 Cb 0.11 -2.43 -0.04 0.00 -0.52 0.00 0.00 37.83 34.95 2kui s LYS 519 CO 0.72 0.23 -0.13 -0.59 -0.92 0.00 0.00 175.35 174.66 2kui s PHE 520 N 0.25 1.36 0.05 3.18 -0.12 -1.26 -1.45 117.98 119.99 2kui s PHE 520 Ca -0.13 -0.62 -0.01 0.00 -0.05 0.00 0.00 56.93 56.12 2kui s PHE 520 Cb -0.16 -0.70 -0.04 0.00 -0.63 0.00 0.00 43.02 41.49 2kui s PHE 520 CO 0.07 0.14 -0.02 -1.12 -0.05 0.00 0.00 175.22 174.23 2kui s SER 521 N -2.75 0.44 0.02 1.98 0.01 0.26 -4.86 113.70 108.80 2kui s SER 521 Ca 0.12 -0.91 0.02 0.00 1.31 0.00 0.00 55.95 56.49 2kui s SER 521 Cb -0.02 0.19 -0.02 0.00 0.21 0.00 0.00 66.02 66.38 2kui s SER 521 CO 0.02 -0.55 -0.07 0.00 0.41 0.00 0.00 173.24 173.05 2kui s GLN 522 N -3.52 0.53 -0.15 12.44 1.03 -1.26 -0.05 119.66 128.68 2kui s GLN 522 Ca 0.03 -0.51 -0.01 0.00 0.04 0.00 0.00 55.36 54.91 2kui s GLN 522 Cb 0.05 -0.41 0.04 0.00 0.03 0.00 0.00 33.01 32.72 2kui s GLN 522 CO -0.09 0.10 -0.05 0.00 -2.54 0.00 0.00 175.29 172.71 2kui s ALA 523 N -0.78 1.38 -0.24 2.60 0.00 -0.30 -4.92 121.76 119.51 2kui s ALA 523 Ca -0.04 -0.73 -0.22 0.00 0.00 0.00 0.00 51.96 50.98 2kui s ALA 523 Cb -0.06 -1.06 -0.02 0.00 0.00 0.00 0.00 23.12 21.98 2kui s ALA 523 CO 0.00 -0.72 0.69 -1.12 0.00 0.00 0.00 175.76 174.62 2kui s SER 524 N 1.68 6.68 0.10 0.00 0.01 -1.26 0.09 113.70 121.00 2kui s SER 524 Ca 0.02 0.84 0.10 0.00 1.31 0.00 0.00 55.95 58.22 2kui s SER 524 Cb -0.15 -2.37 -0.04 0.00 0.21 0.00 0.00 66.02 63.68 2kui s SER 524 CO -0.08 -0.39 -0.26 -0.69 0.41 0.00 0.00 173.24 172.24 2kui s VAL 525 N 2.45 2.14 0.25 3.43 1.01 0.72 -4.87 120.40 125.53 2kui s VAL 525 Ca 0.29 -1.60 -0.30 0.00 0.00 0.00 0.00 61.98 60.38 2kui s VAL 525 Cb -0.16 -1.87 -0.09 0.00 0.00 0.00 0.00 36.38 34.26 2kui s VAL 525 CO 0.09 0.16 1.30 1.51 0.00 0.00 0.00 175.10 178.16 2kui s ASP 526 N -1.76 6.87 0.35 3.32 -4.77 -1.26 0.06 116.67 119.47 2kui s ASP 526 Ca 0.12 2.49 -0.14 0.00 -3.30 0.00 0.00 52.55 51.73 2kui s ASP 526 Cb -0.10 -2.62 0.03 0.00 -1.09 0.00 0.00 42.92 39.14 2kui s ASP 526 CO 0.04 -0.51 0.68 -0.44 0.70 0.00 0.00 175.17 175.65 2kui s SER 527 N 0.02 0.14 0.16 2.11 0.01 -0.06 -4.78 113.70 111.30 2kui s SER 527 Ca 0.54 -1.10 0.26 0.00 1.31 0.00 0.00 55.95 56.95 2kui s SER 527 Cb -0.38 0.77 0.65 0.00 0.21 0.00 0.00 66.02 67.27 2kui s SER 527 CO 0.43 -1.50 1.61 -2.65 0.41 0.00 0.00 173.24 171.54 2kui n PRO 528 N -0.51 0.25 -2.56 12.44 -0.02 -1.26 -4.21 135.00 139.13 2kui n PRO 528 Ca -0.05 0.15 -0.40 0.00 -2.02 0.00 0.00 63.50 61.19 2kui n PRO 528 Cb 0.60 -1.74 -0.05 0.00 -0.02 0.00 0.00 33.50 32.29 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 -3.12 4.65 0.48 -0.52 3.00 -1.26 -4.82 118.95 117.36 2kui s ARG 529 Ca 0.09 1.68 -0.23 0.00 0.00 0.00 0.00 55.73 57.27 2kui s ARG 529 Cb 0.13 -3.13 -0.08 0.00 0.00 0.00 0.00 34.95 31.87 2kui s ARG 529 CO 0.64 0.26 1.20 -0.35 0.00 0.00 0.00 175.30 177.05 2kui n PRO 530 N 1.12 1.61 -1.78 3.54 -0.04 -1.26 -2.78 135.00 135.41 2kui n PRO 530 Ca -0.01 0.58 -0.42 0.00 -0.04 0.00 0.00 63.50 63.62 2kui n PRO 530 Cb 0.46 -2.34 -0.03 0.00 -0.04 0.00 0.00 33.50 31.55 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 -1.29 3.39 0.00 0.55 0.00 -1.23 -2.18 121.76 121.00 2kui s ALA 531 Ca 0.66 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.66 2kui s ALA 531 Cb -0.48 -3.87 0.00 0.00 0.00 0.00 0.00 23.12 18.77 2kui s ALA 531 CO 0.54 -1.82 0.00 0.41 0.00 0.00 0.00 175.76 174.89 2kui n GLY 532 N 4.71 1.76 3.69 0.00 0.00 -1.00 -4.90 105.19 109.45 2kui n GLY 532 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 2kui n GLY 532 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kui s GLU 533 N 0.00 4.37 -0.26 1.61 2.12 -0.93 -0.93 118.70 124.69 2kui s GLU 533 Ca 0.00 1.10 -0.27 0.00 0.36 0.00 0.00 54.97 56.15 2kui s GLU 533 Cb 0.00 -3.53 0.01 0.00 0.26 0.00 0.00 34.13 30.86 2kui s GLU 533 CO 0.00 -0.22 0.97 0.08 -0.54 0.00 0.00 175.26 175.55 2kui s VAL 534 N 1.75 4.69 -0.04 3.70 1.01 0.28 -0.37 120.40 131.42 2kui s VAL 534 Ca 0.41 1.76 0.16 0.00 0.00 0.00 0.00 61.98 64.31 2kui s VAL 534 Cb -0.18 -4.27 -0.25 0.00 0.00 0.00 0.00 36.38 31.68 2kui s VAL 534 CO 0.16 -0.23 0.32 0.41 0.00 0.00 0.00 175.10 175.76 2kui n THR 535 N 5.46 0.16 -3.70 3.92 -1.04 -0.67 -0.12 114.28 118.30 2kui n THR 535 Ca 0.10 -0.43 -0.08 0.00 -2.04 0.00 0.00 64.05 61.60 2kui n THR 535 Cb 0.47 0.01 0.02 0.00 -1.82 0.00 0.00 70.33 69.01 2kui n THR 535 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2kui n GLY 536 N 1.62 1.21 3.35 3.41 0.00 -0.81 -4.75 105.19 109.23 2kui n GLY 536 Ca -0.06 -1.25 -0.21 0.00 0.00 0.00 0.00 46.02 44.49 2kui n GLY 536 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 537 N -2.27 1.87 0.07 2.61 -4.23 -1.26 0.03 115.64 112.45 2kui s THR 537 Ca 0.14 -2.02 -0.33 0.00 -1.18 0.00 0.00 61.69 58.30 2kui s THR 537 Cb -0.04 -1.93 -0.19 0.00 1.34 0.00 0.00 72.50 71.68 2kui s THR 537 CO 0.11 -0.38 1.62 -1.13 -0.54 0.00 0.00 174.62 174.30 2kui h ASN 538 N 3.02 -0.81 -3.63 3.99 -0.73 -1.24 -3.42 115.58 112.76 2kui h ASN 538 Ca -0.41 0.03 -0.51 0.00 1.87 0.00 0.00 56.30 57.28 2kui h ASN 538 Cb 1.21 0.21 -0.03 0.00 0.27 0.00 0.00 38.32 39.98 2kui h ASN 538 CO 0.54 -0.58 0.18 -2.16 -0.37 0.00 0.00 177.43 175.04 2kui s PRO 539 N -6.04 4.39 0.51 6.67 0.04 -1.26 -5.05 135.00 134.24 2kui s PRO 539 Ca -0.18 1.03 -0.21 0.00 0.04 0.00 0.00 61.00 61.68 2kui s PRO 539 Cb 0.03 -2.93 -0.07 0.00 0.04 0.00 0.00 34.50 31.57 2kui s PRO 539 CO 0.62 0.40 1.12 -2.14 0.04 0.00 0.00 177.00 177.03 2kui s PRO 540 N -1.84 3.57 0.28 0.56 0.02 -1.26 -4.97 135.00 131.36 2kui s PRO 540 Ca 0.43 1.60 -0.30 0.00 0.02 0.00 0.00 61.00 62.75 2kui s PRO 540 Cb -0.18 -2.14 -0.12 0.00 0.02 0.00 0.00 34.50 32.08 2kui s PRO 540 CO 0.23 -0.67 1.59 0.00 -0.33 0.00 0.00 177.00 177.82 2kui n ALA 541 N -0.99 2.41 0.00 -1.55 0.00 -1.26 -2.13 120.51 116.99 2kui n ALA 541 Ca 0.10 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2kui n ALA 541 Cb 0.50 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.51 2kui n ALA 541 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 542 N 2.35 0.63 3.72 0.00 0.00 -0.34 -5.01 105.19 106.54 2kui n GLY 542 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 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 4.87 -0.21 2.61 2.01 -0.90 -4.79 115.64 117.22 2kui s THR 543 Ca 0.00 1.82 -0.10 0.00 0.31 0.00 0.00 61.69 63.72 2kui s THR 543 Cb 0.00 -4.21 -0.05 0.00 0.01 0.00 0.00 72.50 68.26 2kui s THR 543 CO 0.00 0.23 0.13 0.28 -0.69 0.00 0.00 174.62 174.57 2kui s THR 544 N 0.70 5.21 0.14 -0.82 -1.32 -1.26 -0.50 115.64 117.80 2kui s THR 544 Ca 0.45 0.12 -0.00 0.00 -1.21 0.00 0.00 61.69 61.05 2kui s THR 544 Cb -0.20 -3.40 -0.04 0.00 -1.51 0.00 0.00 72.50 67.35 2kui s THR 544 CO 0.24 0.40 0.04 0.68 -2.21 0.00 0.00 174.62 173.78 2kui s VAL 545 N 0.70 0.26 0.45 5.08 -7.23 -0.04 -4.93 120.40 114.70 2kui s VAL 545 Ca 0.07 -1.93 -0.25 0.00 -1.81 0.00 0.00 61.98 58.06 2kui s VAL 545 Cb -0.12 -2.07 -0.08 0.00 0.56 0.00 0.00 36.38 34.67 2kui s VAL 545 CO 0.01 -0.47 1.37 -2.84 -0.31 0.00 0.00 175.10 172.87 2kui s PRO 546 N -4.01 3.71 0.63 4.82 0.02 -1.26 -0.09 135.00 138.81 2kui s PRO 546 Ca 0.24 2.30 0.42 0.00 0.02 0.00 0.00 61.00 63.97 2kui s PRO 546 Cb 0.07 -2.63 2.15 0.00 0.02 0.00 0.00 34.50 34.11 2kui s PRO 546 CO 0.02 -0.75 2.26 -0.39 -0.33 0.00 0.00 177.00 177.81 2kui h VAL 547 N 2.24 0.00 0.00 3.83 -1.51 -1.06 -1.89 116.25 117.87 2kui h VAL 547 Ca -0.50 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 64.85 2kui h VAL 547 Cb 1.26 1.10 0.00 0.00 -2.13 0.00 0.00 31.29 31.52 2kui h VAL 547 CO 0.61 0.00 -0.59 -0.67 -1.23 0.00 0.00 177.57 175.69 2kui n ASP 548 N -3.05 0.71 -4.66 4.19 -0.08 -1.26 -3.09 116.55 109.30 2kui n ASP 548 Ca -0.02 0.14 -0.30 0.00 -1.51 0.00 0.00 54.79 53.10 2kui n ASP 548 Cb 0.12 0.11 0.17 0.00 2.34 0.00 0.00 41.12 43.86 2kui n ASP 548 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 2kui s SER 549 N -4.24 2.89 -0.22 1.67 0.01 -0.71 -4.50 113.70 108.60 2kui s SER 549 Ca 0.06 1.97 -0.16 0.00 1.31 0.00 0.00 55.95 59.13 2kui s SER 549 Cb 0.13 -2.49 -0.04 0.00 0.21 0.00 0.00 66.02 63.84 2kui s SER 549 CO 0.71 -3.09 0.42 0.54 0.41 0.00 0.00 173.24 172.24 2kui s VAL 550 N -2.68 5.17 -0.09 3.43 0.11 -1.26 -4.20 120.40 120.88 2kui s VAL 550 Ca 0.66 0.74 -0.01 0.00 -2.93 0.00 0.00 61.98 60.44 2kui s VAL 550 Cb -0.22 -3.75 -0.03 0.00 -1.53 0.00 0.00 36.38 30.85 2kui s VAL 550 CO 0.59 0.21 -0.02 -0.63 -3.33 0.00 0.00 175.10 171.91 2kui s ILE 551 N 1.56 4.09 -0.26 7.04 1.01 -0.53 -4.92 121.20 129.19 2kui s ILE 551 Ca 0.19 -0.33 -0.10 0.00 0.00 0.00 0.00 60.65 60.42 2kui s ILE 551 Cb -0.15 -2.71 -0.04 0.00 0.01 0.00 0.00 42.46 39.56 2kui s ILE 551 CO 0.09 0.59 0.15 -0.70 0.00 0.00 0.00 174.94 175.07 2kui s GLU 552 N -0.72 3.89 -0.20 2.79 2.12 -1.26 -0.58 118.70 124.74 2kui s GLU 552 Ca 0.11 -0.36 -0.14 0.00 0.36 0.00 0.00 54.97 54.94 2kui s GLU 552 Cb -0.11 -3.54 -0.04 0.00 0.26 0.00 0.00 34.13 30.69 2kui s GLU 552 CO 0.02 -0.14 0.33 -0.51 -0.54 0.00 0.00 175.26 174.42 2kui s LEU 553 N 1.59 4.17 -0.27 2.70 2.01 0.93 -0.66 118.68 129.15 2kui s LEU 553 Ca 0.07 0.44 -0.10 0.00 0.01 0.00 0.00 54.13 54.55 2kui s LEU 553 Cb -0.15 -2.41 -0.04 0.00 0.01 0.00 0.00 46.19 43.59 2kui s LEU 553 CO 0.08 -0.01 0.14 0.00 1.01 0.00 0.00 176.35 177.57 2kui s GLN 554 N 1.07 3.86 -0.02 1.70 -2.07 0.10 -1.15 119.66 123.15 2kui s GLN 554 Ca 0.16 -0.37 -0.03 0.00 -1.82 0.00 0.00 55.36 53.31 2kui s GLN 554 Cb -0.14 -3.53 -0.04 0.00 -1.09 0.00 0.00 33.01 28.21 2kui s GLN 554 CO 0.06 -0.16 0.14 0.08 -1.32 0.00 0.00 175.29 174.10 2kui s VAL 555 N 1.64 5.22 0.05 3.63 1.01 0.11 -1.68 120.40 130.39 2kui s VAL 555 Ca 0.07 -0.19 -0.28 0.00 0.00 0.00 0.00 61.98 61.58 2kui s VAL 555 Cb -0.15 -3.40 -0.05 0.00 0.00 0.00 0.00 36.38 32.78 2kui s VAL 555 CO 0.08 0.37 0.88 -0.44 0.00 0.00 0.00 175.10 176.00 2kui s SER 556 N -1.75 7.33 0.06 3.32 0.01 0.50 -0.20 113.70 122.98 2kui s SER 556 Ca 0.24 1.60 -0.21 0.00 1.31 0.00 0.00 55.95 58.89 2kui s SER 556 Cb -0.12 -2.53 -0.06 0.00 0.21 0.00 0.00 66.02 63.51 2kui s SER 556 CO 0.15 -0.09 0.61 -0.75 0.41 0.00 0.00 173.24 173.57 2kui s LYS 557 N 0.30 4.30 -0.04 12.44 2.20 0.11 -2.38 119.74 136.66 2kui s LYS 557 Ca 0.45 0.80 -0.19 0.00 -0.36 0.00 0.00 55.97 56.67 2kui s LYS 557 Cb -0.21 -3.28 -0.31 0.00 -1.51 0.00 0.00 37.83 32.51 2kui s LYS 557 CO 0.26 0.52 0.83 0.78 -0.36 0.00 0.00 175.35 177.38 2kui h GLY 558 N 4.96 0.39 0.00 5.54 0.00 -1.70 -0.13 103.07 112.13 2kui h GLY 558 Ca -0.47 -1.01 0.00 0.00 0.00 0.00 0.00 47.33 45.85 2kui h GLY 558 CO 0.66 0.88 0.00 0.70 0.00 0.00 0.00 176.54 178.79 2kui n ASN 559 N -3.96 0.00 -4.17 0.19 3.02 -1.26 -4.33 115.26 104.75 2kui n ASN 559 Ca -0.18 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.13 2kui n ASN 559 Cb 0.92 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.93 2kui n ASN 559 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2kui s GLN 560 N 0.00 1.40 -0.05 3.52 2.00 -1.26 0.08 119.66 125.35 2kui s GLN 560 Ca 0.00 -0.65 -0.04 0.00 -2.00 0.00 0.00 55.36 52.67 2kui s GLN 560 Cb 0.00 -1.36 0.01 0.00 0.80 0.00 0.00 33.01 32.46 2kui s GLN 560 CO 0.00 0.37 0.13 -0.59 -0.50 0.00 0.00 175.29 174.70 2kui s PHE 561 N -0.45 -0.14 0.11 1.67 -0.71 -0.59 -4.86 117.98 113.01 2kui s PHE 561 Ca 0.07 0.35 -0.31 0.00 -1.04 0.00 0.00 56.93 55.99 2kui s PHE 561 Cb -0.07 0.03 -0.10 0.00 -1.21 0.00 0.00 43.02 41.67 2kui s PHE 561 CO -0.00 -0.07 1.87 1.55 -1.34 0.00 0.00 175.22 177.22 2kui n VAL 562 N 3.12 0.45 -3.59 -2.49 3.14 -1.26 -0.05 118.33 117.66 2kui n VAL 562 Ca -0.14 -0.08 -0.37 0.00 -2.96 0.00 0.00 64.34 60.79 2kui n VAL 562 Cb 0.58 -2.18 -0.06 0.00 -1.06 0.00 0.00 33.84 31.13 2kui n VAL 562 CO 0.00 0.00 0.00 -0.32 -6.46 0.00 0.00 176.83 170.05 2kui s MET 563 N 3.11 3.88 1.13 1.45 1.75 -0.03 -4.88 119.30 125.72 2kui s MET 563 Ca 0.83 0.23 -0.13 0.00 -1.25 0.00 0.00 55.69 55.37 2kui s MET 563 Cb -0.47 -3.26 0.26 0.00 2.84 0.00 0.00 34.83 34.20 2kui s MET 563 CO 0.38 0.61 1.05 -2.14 -0.65 0.00 0.00 175.02 174.27 2kui s PRO 564 N -0.71 -0.61 0.27 4.11 0.02 -1.26 -1.58 135.00 135.24 2kui s PRO 564 Ca 0.20 0.68 -0.29 0.00 0.02 0.00 0.00 61.00 61.61 2kui s PRO 564 Cb -0.15 -1.60 -0.09 0.00 0.02 0.00 0.00 34.50 32.67 2kui s PRO 564 CO 0.09 -3.47 1.22 0.16 -0.33 0.00 0.00 177.00 174.67 2kui s ASP 565 N -2.84 7.02 -0.01 2.53 -4.77 -1.26 -4.65 116.67 112.68 2kui s ASP 565 Ca 0.68 2.42 0.02 0.00 -3.30 0.00 0.00 52.55 52.37 2kui s ASP 565 Cb -0.23 -2.63 0.03 0.00 -1.09 0.00 0.00 42.92 39.00 2kui s ASP 565 CO 0.62 -0.37 0.84 0.18 0.70 0.00 0.00 175.17 177.14 2kui n LEU 566 N 1.52 0.42 -4.74 2.11 4.77 -1.26 -5.08 117.00 114.75 2kui n LEU 566 Ca 0.01 -0.95 -0.41 0.00 -0.03 0.00 0.00 56.01 54.63 2kui n LEU 566 Cb 0.43 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.45 2kui n LEU 566 CO 0.57 0.23 1.06 -0.55 -1.33 0.00 0.00 177.39 177.36 2kui s SER 567 N -0.84 6.77 0.00 -1.43 0.15 -1.26 -3.19 113.70 113.90 2kui s SER 567 Ca 0.03 2.53 0.00 0.00 0.70 0.00 0.00 55.95 59.21 2kui s SER 567 Cb 0.03 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2kui s SER 567 CO 0.00 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.42 2kui n GLY 568 N 2.42 0.97 3.72 9.45 0.00 -1.26 -5.07 105.19 115.43 2kui n GLY 568 Ca 0.07 -0.47 -0.24 0.00 0.00 0.00 0.00 46.02 45.38 2kui n GLY 568 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2kui s MET 569 N -3.47 2.60 0.34 1.61 0.00 -1.19 -4.96 119.30 114.22 2kui s MET 569 Ca 0.00 -1.16 0.08 0.00 0.00 0.00 0.00 55.69 54.61 2kui s MET 569 Cb 0.00 -2.40 -0.03 0.00 0.00 0.00 0.00 34.83 32.40 2kui s MET 569 CO 0.00 0.41 0.22 -0.06 0.00 0.00 0.00 175.02 175.60 2kui s PHE 570 N -2.04 2.81 0.28 3.16 0.40 -1.26 -0.45 117.98 120.88 2kui s PHE 570 Ca 0.31 -0.34 0.10 0.00 -0.60 0.00 0.00 56.93 56.40 2kui s PHE 570 Cb -0.08 -1.73 0.40 0.00 0.51 0.00 0.00 43.02 42.12 2kui s PHE 570 CO 0.22 0.25 1.64 2.35 0.70 0.00 0.00 175.22 180.38 2kui h TRP 571 N 1.38 0.03 -0.00 0.36 7.01 -1.25 0.17 115.95 123.66 2kui h TRP 571 Ca -0.44 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.55 2kui h TRP 571 Cb 1.25 -0.01 0.00 0.00 -2.10 0.00 0.00 29.16 28.31 2kui h TRP 571 CO 0.57 0.60 -0.00 1.33 -2.79 0.00 0.00 178.44 178.15 2kui n VAL 572 N -3.85 0.00 -0.10 2.65 0.24 -1.26 -2.31 118.33 113.70 2kui n VAL 572 Ca -0.01 -0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.19 2kui n VAL 572 Cb 0.58 -0.49 -0.16 0.00 -1.47 0.00 0.00 33.84 32.30 2kui n VAL 572 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2kui n ASP 573 N -1.30 0.06 -0.24 -1.34 -0.08 -0.72 -4.34 116.55 108.60 2kui n ASP 573 Ca 0.14 0.03 -0.07 0.00 -1.51 0.00 0.00 54.79 53.38 2kui n ASP 573 Cb 0.25 0.93 0.04 0.00 2.34 0.00 0.00 41.12 44.68 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 1.00 0.86 0.07 -1.67 0.00 -0.27 -2.67 119.26 116.57 2kui h ALA 574 Ca -0.53 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.23 2kui h ALA 574 Cb 2.23 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.74 2kui h ALA 574 CO 0.03 0.45 -0.14 1.49 0.00 0.00 0.00 179.25 181.09 2kui h GLU 575 N 0.93 -0.26 -1.01 0.00 4.81 -1.68 0.32 114.58 117.69 2kui h GLU 575 Ca 0.22 0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.58 2kui h GLU 575 Cb 0.17 0.06 -0.08 0.00 0.63 0.00 0.00 28.75 29.53 2kui h GLU 575 CO -0.02 -0.17 0.64 -1.35 -0.73 0.00 0.00 179.01 177.37 2kui h PRO 576 N -0.27 1.02 -0.20 0.92 0.11 -1.75 -1.80 132.00 130.03 2kui h PRO 576 Ca 0.03 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 65.97 2kui h PRO 576 Cb 0.29 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.16 2kui h PRO 576 CO -0.09 0.67 -0.34 0.00 -0.21 0.00 0.00 178.00 178.04 2kui h ARG 577 N 1.05 0.41 -0.11 1.05 -0.00 -1.07 -1.17 114.38 114.54 2kui h ARG 577 Ca 0.48 -0.18 0.01 0.00 -0.50 0.00 0.00 59.98 59.79 2kui h ARG 577 Cb 0.40 -0.01 -0.01 0.00 0.00 0.00 0.00 29.97 30.34 2kui h ARG 577 CO -0.24 0.70 0.02 1.25 0.00 0.00 0.00 179.97 181.70 2kui h LEU 578 N 0.35 0.00 -0.49 3.04 6.46 0.46 0.82 115.31 125.96 2kui h LEU 578 Ca 0.04 0.02 -0.11 0.00 -0.12 0.00 0.00 57.88 57.71 2kui h LEU 578 Cb 0.77 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.70 2kui h LEU 578 CO 0.06 0.02 -0.11 0.08 -0.62 0.00 0.00 178.44 177.87 2kui h ARG 579 N 0.07 0.94 -0.58 1.25 0.11 -1.33 -0.97 114.38 113.87 2kui h ARG 579 Ca 0.05 -0.36 -0.10 0.00 0.10 0.00 0.00 59.98 59.67 2kui h ARG 579 Cb 0.04 -0.05 -0.02 0.00 1.11 0.00 0.00 29.97 31.05 2kui h ARG 579 CO -0.07 1.02 -0.04 0.00 0.10 0.00 0.00 179.97 180.98 2kui h ALA 580 N 0.89 0.81 -0.00 0.08 0.00 -0.85 -2.76 119.26 117.43 2kui h ALA 580 Ca 0.12 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2kui h ALA 580 Cb 0.67 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2kui h ALA 580 CO 0.05 0.67 -0.28 1.28 0.00 0.00 0.00 179.25 180.97 2kui n LEU 581 N -4.16 0.38 -1.02 0.00 4.32 0.25 -4.91 117.00 111.86 2kui n LEU 581 Ca 0.02 0.13 -0.12 0.00 -0.02 0.00 0.00 56.01 56.03 2kui n LEU 581 Cb 0.37 -0.31 -0.04 0.00 -1.62 0.00 0.00 43.42 41.82 2kui n LEU 581 CO 0.45 0.09 -0.12 0.61 -1.22 0.00 0.00 177.39 177.19 2kui n GLY 582 N 1.46 1.06 3.70 -0.72 0.00 -0.70 -4.93 105.19 105.06 2kui n GLY 582 Ca 0.08 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.48 2.43 -0.44 1.61 -0.00 -0.45 -4.96 118.94 114.65 2kui s TRP 583 Ca 0.00 0.13 0.02 0.00 -0.00 0.00 0.00 56.10 56.25 2kui s TRP 583 Cb 0.00 -4.15 0.14 0.00 -0.00 0.00 0.00 33.47 29.45 2kui s TRP 583 CO 0.00 -4.61 0.24 0.99 -0.00 0.00 0.00 176.95 173.57 2kui s THR 584 N 2.17 1.32 0.00 5.86 2.01 -1.26 -4.82 115.64 120.92 2kui s THR 584 Ca 0.78 -2.54 0.00 0.00 0.31 0.00 0.00 61.69 60.25 2kui s THR 584 Cb -0.47 -1.93 0.00 0.00 0.01 0.00 0.00 72.50 70.11 2kui s THR 584 CO 0.35 -0.91 0.00 0.61 -0.69 0.00 0.00 174.62 173.97 2kui n GLY 585 N 3.53 5.23 3.03 4.40 0.00 -1.26 -4.89 105.19 115.22 2kui n GLY 585 Ca 0.10 -0.81 -0.24 0.00 0.00 0.00 0.00 46.02 45.07 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 4.20 1.59 -0.25 1.61 -2.45 -1.26 -5.06 119.30 117.69 2kui s MET 586 Ca 0.00 -0.41 -0.13 0.00 -1.25 0.00 0.00 55.69 53.90 2kui s MET 586 Cb 0.00 -1.34 -0.05 0.00 1.25 0.00 0.00 34.83 34.69 2kui s MET 586 CO 0.00 0.06 0.25 -1.17 1.05 0.00 0.00 175.02 175.22 2kui s LEU 587 N 0.53 4.09 -0.45 4.11 1.98 -1.26 -4.08 118.68 123.59 2kui s LEU 587 Ca -0.12 0.20 -0.17 0.00 -2.89 0.00 0.00 54.13 51.16 2kui s LEU 587 Cb -0.14 -2.25 0.05 0.00 0.66 0.00 0.00 46.19 44.50 2kui s LEU 587 CO 0.03 -0.03 0.43 -0.62 -1.89 0.00 0.00 176.35 174.27 2kui s ASP 588 N 1.31 6.17 -0.09 3.68 2.15 -1.26 -5.05 116.67 123.58 2kui s ASP 588 Ca 0.11 -1.00 -0.16 0.00 0.43 0.00 0.00 52.55 51.93 2kui s ASP 588 Cb -0.15 -2.21 -0.05 0.00 -0.30 0.00 0.00 42.92 40.22 2kui s ASP 588 CO 0.08 -0.64 0.40 -1.59 -0.17 0.00 0.00 175.17 173.25 2kui s LYS 589 N 1.96 4.18 0.00 4.34 0.00 -1.26 -4.41 119.74 124.54 2kui s LYS 589 Ca 0.08 0.34 0.00 0.00 0.00 0.00 0.00 55.97 56.39 2kui s LYS 589 Cb -0.20 -3.36 0.00 0.00 0.00 0.00 0.00 37.83 34.26 2kui s LYS 589 CO 0.10 0.35 0.00 0.41 0.00 0.00 0.00 175.35 176.21 2kui n GLY 590 N 2.83 1.63 3.76 0.59 0.00 -1.26 -5.07 105.19 107.67 2kui n GLY 590 Ca -0.11 -2.04 -0.39 0.00 0.00 0.00 0.00 46.02 43.48 2kui n GLY 590 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kui s ALA 591 N -2.21 3.33 0.01 4.61 0.00 -1.26 -4.99 121.76 121.25 2kui s ALA 591 Ca 0.00 0.84 -0.24 0.00 0.00 0.00 0.00 51.96 52.56 2kui s ALA 591 Cb 0.00 -3.31 -0.05 0.00 0.00 0.00 0.00 23.12 19.76 2kui s ALA 591 CO 0.00 -0.15 0.73 -0.51 0.00 0.00 0.00 175.76 175.83 2kui s ASP 592 N -1.05 7.12 -0.19 0.00 1.11 -1.26 -4.83 116.67 117.59 2kui s ASP 592 Ca 0.47 1.35 0.01 0.00 0.18 0.00 0.00 52.55 54.55 2kui s ASP 592 Cb -0.29 -2.44 0.04 0.00 1.07 0.00 0.00 42.92 41.29 2kui s ASP 592 CO 0.38 -0.02 -0.10 -0.69 1.18 0.00 0.00 175.17 175.92 2kui s VAL 593 N 0.19 1.52 -0.51 -1.27 1.01 0.64 -4.94 120.40 117.03 2kui s VAL 593 Ca 0.38 -0.88 -0.25 0.00 0.00 0.00 0.00 61.98 61.23 2kui s VAL 593 Cb -0.19 -1.60 0.03 0.00 0.00 0.00 0.00 36.38 34.62 2kui s VAL 593 CO 0.21 0.20 0.92 1.51 0.00 0.00 0.00 175.10 177.94 2kui s ASP 594 N 1.46 6.40 0.00 3.32 -4.77 -1.26 -2.30 116.67 119.52 2kui s ASP 594 Ca -0.00 -0.16 0.00 0.00 -3.30 0.00 0.00 52.55 49.09 2kui s ASP 594 Cb -0.16 -2.44 0.00 0.00 -1.09 0.00 0.00 42.92 39.24 2kui s ASP 594 CO -0.08 -1.14 0.00 0.00 0.70 0.00 0.00 175.17 174.65 2kui n ALA 595 N 7.30 1.59 0.00 2.11 0.00 -1.26 -5.05 120.51 125.21 2kui n ALA 595 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2kui n ALA 595 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 0.94 0.27 0.35 0.00 0.00 -1.26 -4.79 105.19 100.70 2kui n GLY 596 Ca 0.00 -2.31 0.10 0.00 0.00 0.00 0.00 46.02 43.82 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 0.63 2.00 -0.02 0.00 -1.94 -0.82 103.07 102.92 2kui h GLY 597 Ca 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.11 2kui h GLY 597 CO 0.00 0.13 -0.14 1.76 0.00 0.00 0.00 176.54 178.28 2kui h SER 598 N 0.47 0.00 -0.01 0.19 0.02 -1.98 -2.26 113.55 109.97 2kui h SER 598 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2kui h SER 598 Cb 0.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.98 2kui h SER 598 CO -0.08 0.14 -0.04 0.00 -1.14 0.00 0.00 176.83 175.72 2kui n GLN 599 N -3.60 0.94 -1.96 3.45 1.13 -0.49 -4.87 117.38 111.98 2kui n GLN 599 Ca -0.01 -1.14 -0.41 0.00 -1.94 0.00 0.00 57.00 53.50 2kui n GLN 599 Cb 0.28 -1.22 -0.03 0.00 0.11 0.00 0.00 30.24 29.38 2kui n GLN 599 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 2kui s HIS 600 N -1.12 1.66 0.00 1.08 2.46 -0.43 -1.69 115.29 117.25 2kui s HIS 600 Ca 0.14 0.77 0.00 0.00 0.47 0.00 0.00 55.06 56.44 2kui s HIS 600 Cb 0.10 -4.05 0.00 0.00 -0.13 0.00 0.00 32.58 28.50 2kui s HIS 600 CO 0.18 -2.72 0.00 -1.71 -2.47 0.00 0.00 174.74 168.02 2kui n ASN 601 N 11.75 -0.52 -4.87 9.88 2.85 -1.25 -4.90 115.26 128.20 2kui n ASN 601 Ca 0.24 0.00 -0.33 0.00 -0.11 0.00 0.00 54.58 54.38 2kui n ASN 601 Cb 0.49 -2.23 -0.05 0.00 1.24 0.00 0.00 39.78 39.23 2kui n ASN 601 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 2kui s ARG 602 N -0.94 3.84 0.20 1.20 3.00 -1.24 -0.66 118.95 124.35 2kui s ARG 602 Ca 0.00 0.32 -0.33 0.00 -1.00 0.00 0.00 55.73 54.72 2kui s ARG 602 Cb 0.00 -2.74 -0.13 0.00 0.00 0.00 0.00 34.95 32.08 2kui s ARG 602 CO 0.00 0.37 1.55 1.55 0.00 0.00 0.00 175.30 178.77 2kui n VAL 603 N 0.16 0.35 -0.08 7.11 3.14 0.40 -3.90 118.33 125.52 2kui n VAL 603 Ca -0.01 -0.09 -0.09 0.00 -2.96 0.00 0.00 64.34 61.19 2kui n VAL 603 Cb 0.52 -1.61 -0.09 0.00 -1.06 0.00 0.00 33.84 31.60 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 2.95 0.94 -3.66 1.55 3.14 0.19 -4.92 118.33 118.52 2kui n VAL 604 Ca 0.15 -0.47 -0.15 0.00 -2.96 0.00 0.00 64.34 60.91 2kui n VAL 604 Cb 0.31 -0.87 -0.08 0.00 -1.06 0.00 0.00 33.84 32.14 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 -2.33 -0.42 -0.04 1.45 -0.85 -1.26 -5.02 117.35 108.88 2kui s TYR 605 Ca -0.15 0.75 0.06 0.00 -0.52 0.00 0.00 57.07 57.22 2kui s TYR 605 Cb 0.05 0.23 -0.01 0.00 0.38 0.00 0.00 41.96 42.61 2kui s TYR 605 CO 0.47 -0.45 -0.22 1.14 -1.52 0.00 0.00 175.55 174.97 2kui s GLN 606 N -1.03 2.14 0.09 -3.49 -2.07 -1.26 -2.67 119.66 111.36 2kui s GLN 606 Ca -0.11 -0.80 -0.26 0.00 -1.82 0.00 0.00 55.36 52.38 2kui s GLN 606 Cb -0.03 -1.89 -0.15 0.00 -1.09 0.00 0.00 33.01 29.86 2kui s GLN 606 CO 0.06 0.37 1.69 -0.97 -1.32 0.00 0.00 175.29 175.12 2kui h ASN 607 N 5.99 -0.31 -3.60 12.60 -0.73 -0.82 -3.38 115.58 125.32 2kui h ASN 607 Ca -0.34 0.02 -0.70 0.00 1.87 0.00 0.00 56.30 57.14 2kui h ASN 607 Cb 1.16 0.09 -0.25 0.00 0.27 0.00 0.00 38.32 39.60 2kui h ASN 607 CO 0.47 -0.20 -0.53 -2.16 -0.37 0.00 0.00 177.43 174.64 2kui s PRO 608 N -6.14 2.85 0.73 6.67 0.05 -1.26 -5.03 135.00 132.87 2kui s PRO 608 Ca -0.15 -1.05 -0.13 0.00 0.05 0.00 0.00 61.00 59.72 2kui s PRO 608 Cb 0.06 -3.67 0.04 0.00 0.05 0.00 0.00 34.50 30.98 2kui s PRO 608 CO 0.65 -0.66 1.12 -2.14 0.05 0.00 0.00 177.00 176.02 2kui s PRO 609 N 1.54 2.36 0.33 0.56 0.02 -1.26 -4.93 135.00 133.62 2kui s PRO 609 Ca 0.02 1.40 -0.29 0.00 0.02 0.00 0.00 61.00 62.14 2kui s PRO 609 Cb -0.19 -1.89 -0.11 0.00 0.02 0.00 0.00 34.50 32.32 2kui s PRO 609 CO 0.06 -1.59 1.56 0.00 -0.33 0.00 0.00 177.00 176.70 2kui s ALA 610 N -2.48 3.68 0.00 -1.55 0.00 -1.26 -1.66 121.76 118.48 2kui s ALA 610 Ca 0.66 1.60 0.00 0.00 0.00 0.00 0.00 51.96 54.22 2kui s ALA 610 Cb -0.21 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.27 2kui s ALA 610 CO 0.48 -1.04 0.00 0.41 0.00 0.00 0.00 175.76 175.61 2kui n GLY 611 N 1.37 0.75 3.74 0.00 0.00 -0.61 -4.98 105.19 105.47 2kui n GLY 611 Ca 0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.90 4.15 0.03 2.61 2.01 -0.67 -4.83 115.64 116.04 2kui s THR 612 Ca 0.00 -1.28 -0.28 0.00 0.31 0.00 0.00 61.69 60.43 2kui s THR 612 Cb 0.00 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 2kui s THR 612 CO 0.00 -0.15 0.90 -0.83 -0.69 0.00 0.00 174.62 173.85 2kui s GLY 613 N -3.15 2.88 -0.07 4.40 0.00 -1.26 -0.85 107.32 109.28 2kui s GLY 613 Ca 0.30 0.46 -0.04 0.00 0.00 0.00 0.00 44.72 45.43 2kui s GLY 613 CO 0.22 1.45 0.13 -1.34 0.00 0.00 0.00 173.10 173.56 2kui s VAL 614 N 0.50 5.29 0.59 1.40 -7.23 0.93 -4.68 120.40 117.19 2kui s VAL 614 Ca 0.46 -0.02 -0.19 0.00 -1.81 0.00 0.00 61.98 60.43 2kui s VAL 614 Cb -0.21 -3.36 -0.05 0.00 0.56 0.00 0.00 36.38 33.31 2kui s VAL 614 CO 0.26 0.50 0.93 -0.46 -0.31 0.00 0.00 175.10 176.02 2kui n ASN 615 N 1.58 0.65 0.30 4.85 2.04 -1.25 -1.55 115.26 121.88 2kui n ASN 615 Ca -0.16 0.81 0.16 0.00 -0.44 0.00 0.00 54.58 54.95 2kui n ASN 615 Cb 0.54 -1.37 0.93 0.00 -2.53 0.00 0.00 39.78 37.34 2kui n ASN 615 CO 0.00 0.00 0.00 0.08 -0.44 0.00 0.00 177.26 176.90 2kui h ARG 616 N 0.51 0.00 -0.06 -3.83 -0.00 -0.74 0.23 114.38 110.49 2kui h ARG 616 Ca -0.48 0.00 -0.10 0.00 -0.00 0.00 0.00 59.98 59.40 2kui h ARG 616 Cb 1.37 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.32 2kui h ARG 616 CO 0.51 0.02 -0.41 -0.44 -0.00 0.00 0.00 179.97 179.65 2kui h ASP 617 N 0.00 0.13 0.00 0.08 3.32 -1.91 -3.47 116.42 114.58 2kui h ASP 617 Ca -0.00 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.00 2kui h ASP 617 Cb 0.07 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.58 2kui h ASP 617 CO 0.00 0.53 0.00 0.61 -1.72 0.00 0.00 179.24 178.67 2kui n GLY 618 N -0.26 0.73 3.66 2.75 0.00 0.07 -4.63 105.19 107.50 2kui n GLY 618 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.05 3.80 -0.09 -0.61 -1.16 -1.26 -4.82 121.20 115.00 2kui s ILE 619 Ca 0.00 0.96 0.04 0.00 -0.51 0.00 0.00 60.65 61.13 2kui s ILE 619 Cb 0.00 -3.63 -0.01 0.00 0.61 0.00 0.00 42.46 39.43 2kui s ILE 619 CO 0.00 -0.10 -0.22 -0.51 -2.81 0.00 0.00 174.94 171.30 2kui s ILE 620 N 3.98 2.31 -0.13 2.00 -1.16 -1.26 -4.81 121.20 122.14 2kui s ILE 620 Ca 0.68 -0.95 0.02 0.00 -0.51 0.00 0.00 60.65 59.89 2kui s ILE 620 Cb -0.29 -1.89 -0.00 0.00 0.61 0.00 0.00 42.46 40.89 2kui s ILE 620 CO 0.25 0.56 -0.20 -0.89 -2.81 0.00 0.00 174.94 171.85 2kui s THR 621 N 0.15 2.38 0.03 4.00 2.01 -1.26 -4.24 115.64 118.71 2kui s THR 621 Ca -0.12 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.00 2kui s THR 621 Cb -0.16 -1.96 -0.02 0.00 0.01 0.00 0.00 72.50 70.37 2kui s THR 621 CO 0.06 0.54 -0.05 -1.48 -0.69 0.00 0.00 174.62 173.01 2kui s LEU 622 N 0.56 2.27 0.15 4.42 -0.00 -1.26 0.01 118.68 124.83 2kui s LEU 622 Ca -0.12 -0.56 0.07 0.00 -0.00 0.00 0.00 54.13 53.52 2kui s LEU 622 Cb -0.16 0.01 -0.04 0.00 -0.00 0.00 0.00 46.19 45.99 2kui s LEU 622 CO 0.04 -0.29 -0.15 -0.60 -0.00 0.00 0.00 176.35 175.35 2kui s ARG 623 N -1.72 1.16 0.23 1.48 3.52 -1.09 -4.67 118.95 117.86 2kui s ARG 623 Ca -0.12 -1.37 0.04 0.00 -0.13 0.00 0.00 55.73 54.15 2kui s ARG 623 Cb -0.08 -1.05 -0.05 0.00 -1.56 0.00 0.00 34.95 32.20 2kui s ARG 623 CO -0.01 0.20 -0.00 -0.59 -0.81 0.00 0.00 175.30 174.08 2kui s PHE 624 N -2.35 1.56 0.00 5.12 -0.71 -1.26 0.55 117.98 120.89 2kui s PHE 624 Ca 0.14 -0.92 0.00 0.00 -1.04 0.00 0.00 56.93 55.11 2kui s PHE 624 Cb -0.04 -0.91 0.00 0.00 -1.21 0.00 0.00 43.02 40.87 2kui s PHE 624 CO 0.05 -0.04 0.10 0.41 -1.34 0.00 0.00 175.22 174.40 2kui n GLY 625 N -0.42 -0.06 0.00 1.99 0.00 -0.68 -4.61 105.19 101.40 2kui n GLY 625 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14