#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 4.63 0.12 -0.61 1.10 -1.26 -5.02 121.20 120.15 2kui s ILE 356 Ca 0.00 1.91 -0.21 0.00 -0.51 0.00 0.00 60.65 61.84 2kui s ILE 356 Cb 0.00 -4.23 -0.07 0.00 0.15 0.00 0.00 42.46 38.31 2kui s ILE 356 CO 0.00 0.01 0.64 -0.89 -2.11 0.00 0.00 174.94 172.59 2kui s THR 357 N 2.03 4.62 -0.82 4.00 2.01 -1.26 -4.93 115.64 121.28 2kui s THR 357 Ca 0.51 1.35 0.25 0.00 0.31 0.00 0.00 61.69 64.11 2kui s THR 357 Cb -0.20 -3.96 0.06 0.00 0.01 0.00 0.00 72.50 68.41 2kui s THR 357 CO 0.19 0.50 1.44 -2.11 -0.69 0.00 0.00 174.62 173.96 2kui n ARG 358 N 1.56 0.15 -3.52 4.92 1.85 -1.26 -4.81 116.66 115.54 2kui n ARG 358 Ca -0.08 0.05 -0.32 0.00 -1.00 0.00 0.00 57.85 56.50 2kui n ARG 358 Cb 0.50 -1.60 -0.05 0.00 -1.05 0.00 0.00 32.46 30.26 2kui n ARG 358 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2kui s ASP 359 N -3.64 6.58 0.29 2.89 1.01 -1.26 -4.93 116.67 117.61 2kui s ASP 359 Ca 0.09 0.79 0.10 0.00 0.71 0.00 0.00 52.55 54.25 2kui s ASP 359 Cb 0.16 -2.17 -0.05 0.00 1.01 0.00 0.00 42.92 41.86 2kui s ASP 359 CO 0.69 -0.00 -0.09 0.68 0.21 0.00 0.00 175.17 176.65 2kui s VAL 360 N -1.72 2.82 -0.07 -1.27 -7.23 -0.71 -4.68 120.40 107.55 2kui s VAL 360 Ca 0.44 -2.15 -0.13 0.00 -1.81 0.00 0.00 61.98 58.32 2kui s VAL 360 Cb -0.12 -2.59 -0.05 0.00 0.56 0.00 0.00 36.38 34.18 2kui s VAL 360 CO 0.22 -0.34 0.34 -1.58 -0.31 0.00 0.00 175.10 173.43 2kui s GLN 361 N -3.61 3.95 -0.20 4.82 0.74 -1.26 -0.58 119.66 123.52 2kui s GLN 361 Ca 0.31 0.24 -0.13 0.00 0.05 0.00 0.00 55.36 55.84 2kui s GLN 361 Cb -0.04 -3.28 -0.05 0.00 1.10 0.00 0.00 33.01 30.74 2kui s GLN 361 CO 0.18 0.56 0.25 0.08 -0.55 0.00 0.00 175.29 175.80 2kui s VAL 362 N -0.57 5.32 0.31 1.34 1.01 0.24 -4.99 120.40 123.07 2kui s VAL 362 Ca 0.21 0.41 -0.29 0.00 0.00 0.00 0.00 61.98 62.31 2kui s VAL 362 Cb -0.15 -3.58 -0.10 0.00 0.00 0.00 0.00 36.38 32.54 2kui s VAL 362 CO 0.09 0.36 1.43 -2.84 0.00 0.00 0.00 175.10 174.14 2kui s PRO 363 N 0.77 4.24 0.02 2.72 0.02 -1.26 -3.86 135.00 137.65 2kui s PRO 363 Ca 0.13 2.37 -0.30 0.00 0.02 0.00 0.00 61.00 63.22 2kui s PRO 363 Cb -0.13 -3.06 -0.04 0.00 0.02 0.00 0.00 34.50 31.30 2kui s PRO 363 CO 0.04 -0.40 1.01 0.16 -0.33 0.00 0.00 177.00 177.48 2kui s ASP 364 N 0.01 7.33 0.00 2.53 1.47 -1.26 -4.90 116.67 121.85 2kui s ASP 364 Ca 0.55 1.73 0.14 0.00 1.18 0.00 0.00 52.55 56.15 2kui s ASP 364 Cb -0.43 -2.57 0.26 0.00 -0.34 0.00 0.00 42.92 39.84 2kui s ASP 364 CO 0.51 -0.28 1.15 0.55 0.68 0.00 0.00 175.17 177.79 2kui n VAL 365 N 3.82 0.52 -1.81 2.11 3.14 -1.26 -4.98 118.33 119.86 2kui n VAL 365 Ca 0.06 -0.76 -0.39 0.00 -2.96 0.00 0.00 64.34 60.29 2kui n VAL 365 Cb 0.50 0.88 0.03 0.00 -1.06 0.00 0.00 33.84 34.19 2kui n VAL 365 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kui s ARG 366 N -1.10 3.38 0.00 1.45 1.04 -1.26 -3.00 118.95 119.46 2kui s ARG 366 Ca 0.24 2.28 0.00 0.00 -1.04 0.00 0.00 55.73 57.21 2kui s ARG 366 Cb 0.14 -2.42 0.00 0.00 -2.04 0.00 0.00 34.95 30.63 2kui s ARG 366 CO 0.19 -1.02 0.00 0.41 -0.04 0.00 0.00 175.30 174.85 2kui n GLY 367 N 0.66 0.71 0.00 3.88 0.00 0.14 -4.94 105.19 105.64 2kui n GLY 367 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2kui n GLY 367 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kui n GLN 368 N -2.02 0.00 -3.65 1.61 6.02 -1.16 -4.94 117.38 113.24 2kui n GLN 368 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.84 2kui n GLN 368 Cb 0.00 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.19 2kui n GLN 368 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2kui s SER 369 N -0.22 -0.39 0.09 1.08 0.15 -1.26 -4.59 113.70 108.56 2kui s SER 369 Ca 0.00 0.31 -0.20 0.00 0.70 0.00 0.00 55.95 56.77 2kui s SER 369 Cb 0.00 0.42 -0.08 0.00 -1.71 0.00 0.00 66.02 64.65 2kui s SER 369 CO 0.00 -0.55 1.62 0.77 1.20 0.00 0.00 173.24 176.27 2kui h SER 370 N 3.37 0.31 -0.20 5.45 4.64 -1.85 -0.04 113.55 125.23 2kui h SER 370 Ca -0.29 -0.19 -0.06 0.00 -0.47 0.00 0.00 61.79 60.78 2kui h SER 370 Cb 1.17 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.17 2kui h SER 370 CO 0.40 0.41 -0.12 0.00 -0.87 0.00 0.00 176.83 176.65 2kui h ALA 371 N 0.91 0.28 -0.21 5.18 0.00 -1.96 -1.69 119.26 121.77 2kui h ALA 371 Ca 0.07 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 2kui h ALA 371 Cb 0.21 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2kui h ALA 371 CO -0.00 0.14 -0.37 0.22 0.00 0.00 0.00 179.25 179.24 2kui h ASP 372 N 0.12 0.48 0.07 0.00 3.58 -1.95 0.19 116.42 118.91 2kui h ASP 372 Ca 0.04 -0.20 -0.00 0.00 0.42 0.00 0.00 57.03 57.29 2kui h ASP 372 Cb 0.63 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.55 2kui h ASP 372 CO 0.03 0.81 -0.03 0.00 -2.88 0.00 0.00 179.24 177.17 2kui h ALA 373 N 1.22 -0.09 -0.49 -0.78 0.00 -0.95 -2.00 119.26 116.16 2kui h ALA 373 Ca 0.04 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 2kui h ALA 373 Cb 0.83 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2kui h ALA 373 CO 0.07 -0.35 -0.00 0.82 0.00 0.00 0.00 179.25 179.78 2kui h ILE 374 N -0.49 1.25 -0.35 0.00 5.03 -1.22 -1.97 117.51 119.76 2kui h ILE 374 Ca -0.01 -1.03 0.02 0.00 -0.12 0.00 0.00 64.86 63.72 2kui h ILE 374 Cb 0.42 0.87 -0.03 0.00 -3.03 0.00 0.00 36.82 35.06 2kui h ILE 374 CO 0.02 0.36 0.18 0.00 -0.68 0.00 0.00 178.15 178.03 2kui h ALA 375 N 1.22 0.43 -0.19 1.87 0.00 -0.58 0.34 119.26 122.35 2kui h ALA 375 Ca 0.15 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2kui h ALA 375 Cb 0.47 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2kui h ALA 375 CO 0.02 -0.19 0.09 1.15 0.00 0.00 0.00 179.25 180.32 2kui h THR 376 N 0.37 1.14 -0.67 0.00 2.02 -1.12 -1.68 112.91 112.97 2kui h THR 376 Ca 0.14 -0.40 -0.06 0.00 0.77 0.00 0.00 66.41 66.86 2kui h THR 376 Cb 0.04 1.05 -0.03 0.00 -1.74 0.00 0.00 68.15 67.48 2kui h THR 376 CO -0.09 0.13 0.16 -0.07 0.37 0.00 0.00 175.52 176.03 2kui h LEU 377 N 0.17 1.00 -0.50 2.58 4.07 -0.99 -2.03 115.31 119.61 2kui h LEU 377 Ca 0.06 -0.20 -0.01 0.00 0.08 0.00 0.00 57.88 57.81 2kui h LEU 377 Cb 0.13 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 41.58 2kui h LEU 377 CO -0.01 0.96 0.26 -0.61 -1.08 0.00 0.00 178.44 177.96 2kui h GLN 378 N 1.01 0.70 0.00 1.13 5.75 -0.16 0.20 115.11 123.74 2kui h GLN 378 Ca 0.21 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 2kui h GLN 378 Cb 0.35 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 28.77 2kui h GLN 378 CO 0.00 0.56 0.00 -0.91 -2.65 0.00 0.00 178.83 175.83 2kui h ASN 379 N 0.66 0.00 0.25 -0.69 2.35 -0.91 -2.20 115.58 115.04 2kui h ASN 379 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 2kui h ASN 379 Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 2kui h ASN 379 CO -0.03 0.00 -1.15 0.54 -1.65 0.00 0.00 177.43 175.15 2kui n ARG 380 N -2.99 0.25 -0.34 0.81 5.12 -0.70 -4.97 116.66 113.84 2kui n ARG 380 Ca 0.00 -0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.89 2kui n ARG 380 Cb 0.25 -1.55 0.00 0.00 -1.16 0.00 0.00 32.46 30.00 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 1.39 0.81 3.76 -0.13 0.00 0.01 -4.38 105.19 106.66 2kui n GLY 381 Ca 0.02 -0.17 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 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 3.74 0.04 1.61 0.40 0.50 -4.22 117.98 118.06 2kui s PHE 382 Ca 0.00 1.79 -0.25 0.00 -0.60 0.00 0.00 56.93 57.87 2kui s PHE 382 Cb 0.00 -3.16 -0.06 0.00 0.51 0.00 0.00 43.02 40.32 2kui s PHE 382 CO 0.00 -0.14 0.75 0.15 0.70 0.00 0.00 175.22 176.68 2kui s LYS 383 N -1.35 4.48 0.16 0.44 -0.14 0.12 -4.33 119.74 119.13 2kui s LYS 383 Ca 0.43 1.04 0.07 0.00 -1.36 0.00 0.00 55.97 56.15 2kui s LYS 383 Cb -0.29 -3.36 -0.04 0.00 -1.68 0.00 0.00 37.83 32.46 2kui s LYS 383 CO 0.37 0.30 -0.14 0.96 -0.76 0.00 0.00 175.35 176.08 2kui s ILE 384 N -0.10 1.51 -0.01 2.17 -0.00 -1.26 -0.12 121.20 123.39 2kui s ILE 384 Ca 0.38 -1.95 0.02 0.00 -0.00 0.00 0.00 60.65 59.09 2kui s ILE 384 Cb -0.20 -1.79 0.00 0.00 -0.00 0.00 0.00 42.46 40.47 2kui s ILE 384 CO 0.23 -0.50 -0.06 -0.60 -0.00 0.00 0.00 174.94 174.00 2kui s ARG 385 N -3.15 0.58 -0.11 0.37 3.52 -0.26 -4.90 118.95 115.00 2kui s ARG 385 Ca 0.15 -0.19 -0.02 0.00 -0.13 0.00 0.00 55.73 55.54 2kui s ARG 385 Cb -0.03 -0.58 0.04 0.00 -1.56 0.00 0.00 34.95 32.82 2kui s ARG 385 CO 0.04 0.08 0.01 0.99 -0.81 0.00 0.00 175.30 175.62 2kui s THR 386 N 0.12 0.44 -0.18 4.11 2.01 -1.25 0.17 115.64 121.05 2kui s THR 386 Ca -0.01 -0.11 -0.02 0.00 0.31 0.00 0.00 61.69 61.86 2kui s THR 386 Cb -0.06 -0.71 -0.01 0.00 0.01 0.00 0.00 72.50 71.74 2kui s THR 386 CO -0.00 0.11 -0.09 -0.22 -0.69 0.00 0.00 174.62 173.72 2kui s LEU 387 N 1.93 2.73 -0.17 4.42 1.98 -0.42 -4.97 118.68 124.18 2kui s LEU 387 Ca 0.03 -0.40 -0.20 0.00 -2.89 0.00 0.00 54.13 50.67 2kui s LEU 387 Cb -0.14 -1.66 -0.03 0.00 0.66 0.00 0.00 46.19 45.02 2kui s LEU 387 CO -0.06 0.05 0.59 -1.10 -1.89 0.00 0.00 176.35 173.94 2kui s GLN 388 N 1.06 4.25 -0.10 1.98 1.11 -1.26 0.01 119.66 126.71 2kui s GLN 388 Ca 0.00 0.58 0.02 0.00 0.01 0.00 0.00 55.36 55.97 2kui s GLN 388 Cb -0.15 -3.54 -0.02 0.00 -1.01 0.00 0.00 33.01 28.30 2kui s GLN 388 CO -0.02 -0.13 -0.15 0.15 0.01 0.00 0.00 175.29 175.15 2kui s LYS 389 N 1.55 3.05 -0.09 2.91 1.02 0.86 -4.95 119.74 124.10 2kui s LYS 389 Ca 0.28 -0.71 -0.24 0.00 0.02 0.00 0.00 55.97 55.32 2kui s LYS 389 Cb -0.16 -2.51 -0.03 0.00 -0.52 0.00 0.00 37.83 34.61 2kui s LYS 389 CO 0.11 0.35 0.74 -2.14 -0.92 0.00 0.00 175.35 173.49 2kui s PRO 390 N -0.01 4.41 0.00 -1.68 0.02 -1.26 -0.27 135.00 136.22 2kui s PRO 390 Ca -0.04 0.94 0.00 0.00 0.02 0.00 0.00 61.00 61.91 2kui s PRO 390 Cb -0.14 -3.48 0.00 0.00 0.02 0.00 0.00 34.50 30.90 2kui s PRO 390 CO 0.04 -0.03 0.00 -0.40 -0.33 0.00 0.00 177.00 176.28 2kui n ASP 391 N 4.12 0.00 -0.48 2.53 5.68 -0.77 -4.94 116.55 122.68 2kui n ASP 391 Ca 0.00 0.00 0.06 0.00 -0.50 0.00 0.00 54.79 54.36 2kui n ASP 391 Cb 0.51 0.00 0.11 0.00 -1.14 0.00 0.00 41.12 40.60 2kui n ASP 391 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2kui n SER 392 N 0.00 1.53 -0.01 -1.12 3.41 -1.24 -3.18 113.62 113.01 2kui n SER 392 Ca 0.00 -2.94 -0.18 0.00 -0.26 0.00 0.00 58.87 55.49 2kui n SER 392 Cb 0.00 -0.39 -0.14 0.00 -0.26 0.00 0.00 64.21 63.42 2kui n SER 392 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2kui n THR 393 N -0.81 1.73 -3.31 6.66 -1.04 -1.26 -4.83 114.28 111.42 2kui n THR 393 Ca 0.12 -0.69 -0.37 0.00 -2.04 0.00 0.00 64.05 61.07 2kui n THR 393 Cb 0.73 -1.55 -0.06 0.00 -1.82 0.00 0.00 70.33 67.63 2kui n THR 393 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2kui s ILE 394 N -2.56 4.79 0.97 12.58 -1.09 -1.26 -5.06 121.20 129.57 2kui s ILE 394 Ca -0.19 1.06 -0.14 0.00 -2.23 0.00 0.00 60.65 59.16 2kui s ILE 394 Cb 0.07 -3.83 0.03 0.00 -1.58 0.00 0.00 42.46 37.15 2kui s ILE 394 CO 0.78 0.43 0.26 -0.81 -1.23 0.00 0.00 174.94 174.37 2kui n PRO 395 N 1.37 -0.40 -0.71 2.79 -0.04 -1.26 -4.89 135.00 131.86 2kui n PRO 395 Ca -0.08 -0.08 -0.32 0.00 -0.04 0.00 0.00 63.50 62.97 2kui n PRO 395 Cb 0.51 -1.77 0.16 0.00 -0.04 0.00 0.00 33.50 32.36 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 -1.40 -0.82 0.00 0.54 -0.02 -1.26 -4.24 135.00 127.80 2kui n PRO 396 Ca 0.05 -0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 2kui n PRO 396 Cb 0.55 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 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 -2.36 0.00 -4.77 2.55 5.75 -1.12 -4.57 116.55 112.03 2kui n ASP 397 Ca 0.06 0.40 -0.38 0.00 -0.01 0.00 0.00 54.79 54.87 2kui n ASP 397 Cb 0.55 -0.40 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 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 -2.81 2.77 -0.05 2.11 3.76 -1.26 -4.12 115.29 115.70 2kui s HIS 398 Ca 0.00 1.49 -0.30 0.00 -0.15 0.00 0.00 55.06 56.11 2kui s HIS 398 Cb 0.00 -3.49 -0.07 0.00 1.11 0.00 0.00 32.58 30.13 2kui s HIS 398 CO 0.00 -1.82 1.86 0.14 -0.85 0.00 0.00 174.74 174.07 2kui s VAL 399 N -1.46 3.26 -0.03 -0.90 -7.23 -1.26 -4.74 120.40 108.04 2kui s VAL 399 Ca 0.64 0.31 0.01 0.00 -1.81 0.00 0.00 61.98 61.14 2kui s VAL 399 Cb -0.32 -3.22 -0.26 0.00 0.56 0.00 0.00 36.38 33.14 2kui s VAL 399 CO 0.39 -0.05 0.70 -0.29 -0.31 0.00 0.00 175.10 175.54 2kui h ILE 400 N 5.83 0.96 -3.00 -0.62 -0.00 -1.88 0.41 117.51 119.20 2kui h ILE 400 Ca -0.44 -2.69 -0.05 0.00 -0.00 0.00 0.00 64.86 61.69 2kui h ILE 400 Cb 1.21 2.60 -0.14 0.00 -0.00 0.00 0.00 36.82 40.49 2kui h ILE 400 CO 0.95 0.74 0.05 -0.83 -0.00 0.00 0.00 178.15 179.07 2kui s GLY 401 N -5.14 -0.44 0.38 8.18 0.00 -1.26 -4.22 107.32 104.82 2kui s GLY 401 Ca -0.10 0.39 0.02 0.00 0.00 0.00 0.00 44.72 45.03 2kui s GLY 401 CO 0.82 0.09 0.08 -1.30 0.00 0.00 0.00 173.10 172.80 2kui n THR 402 N 0.02 0.00 -3.91 0.90 -2.24 -1.26 -4.86 114.28 102.93 2kui n THR 402 Ca -0.17 -2.05 -0.37 0.00 -2.27 0.00 0.00 64.05 59.19 2kui n THR 402 Cb 0.62 0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 69.41 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 -3.24 6.30 0.00 3.42 2.15 -1.26 -4.96 116.67 119.07 2kui s ASP 403 Ca 0.11 0.43 0.00 0.00 0.43 0.00 0.00 52.55 53.53 2kui s ASP 403 Cb 0.01 -2.03 0.00 0.00 -0.30 0.00 0.00 42.92 40.60 2kui s ASP 403 CO 0.08 0.39 0.47 -2.65 -0.17 0.00 0.00 175.17 173.30 2kui n PRO 404 N 2.08 0.00 -0.26 4.34 -0.02 -1.26 -2.16 135.00 137.72 2kui n PRO 404 Ca -0.20 0.10 0.11 0.00 -2.02 0.00 0.00 63.50 61.49 2kui n PRO 404 Cb 0.55 -1.56 0.36 0.00 -0.02 0.00 0.00 33.50 32.84 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 1.28 1.79 -0.39 3.55 0.00 -1.91 0.97 119.26 124.55 2kui h ALA 405 Ca 0.00 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 2kui h ALA 405 Cb 0.11 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2kui h ALA 405 CO 0.00 -0.01 -0.28 0.00 0.00 0.00 0.00 179.25 178.96 2kui h ALA 406 N 1.59 0.55 0.00 0.00 0.00 -1.73 -2.70 119.26 116.98 2kui h ALA 406 Ca 0.43 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2kui h ALA 406 Cb 0.63 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2kui h ALA 406 CO -0.19 0.58 0.00 0.09 0.00 0.00 0.00 179.25 179.73 2kui n ASN 407 N -4.16 0.00 -4.90 0.00 4.13 -0.37 -0.59 115.26 109.36 2kui n ASN 407 Ca -0.02 -0.71 -0.33 0.00 1.68 0.00 0.00 54.58 55.20 2kui n ASN 407 Cb 0.48 -0.06 -0.05 0.00 -1.54 0.00 0.00 39.78 38.61 2kui n ASN 407 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2kui s THR 408 N -2.12 5.35 -0.35 3.41 2.01 0.19 -4.90 115.64 119.22 2kui s THR 408 Ca 0.39 -0.09 -0.29 0.00 0.31 0.00 0.00 61.69 62.01 2kui s THR 408 Cb 0.19 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 69.12 2kui s THR 408 CO 0.34 0.26 1.43 -0.44 -0.69 0.00 0.00 174.62 175.52 2kui s SER 409 N -2.06 6.41 0.27 3.53 0.01 -1.26 -4.08 113.70 116.52 2kui s SER 409 Ca 0.31 1.05 0.02 0.00 1.31 0.00 0.00 55.95 58.64 2kui s SER 409 Cb -0.13 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.51 2kui s SER 409 CO 0.21 -1.33 0.08 0.68 0.41 0.00 0.00 173.24 173.29 2kui s VAL 410 N 5.19 0.68 0.44 3.43 -7.23 0.26 -4.70 120.40 118.48 2kui s VAL 410 Ca 0.62 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.67 2kui s VAL 410 Cb -0.16 -2.64 -0.07 0.00 0.56 0.00 0.00 36.38 34.07 2kui s VAL 410 CO 0.29 -0.03 0.84 -0.55 -0.31 0.00 0.00 175.10 175.34 2kui s SER 411 N -3.34 6.53 -0.37 4.85 0.15 -1.26 -1.73 113.70 118.53 2kui s SER 411 Ca 0.37 1.26 -0.28 0.00 0.70 0.00 0.00 55.95 58.00 2kui s SER 411 Cb 0.08 -2.38 -0.02 0.00 -1.71 0.00 0.00 66.02 61.99 2kui s SER 411 CO 0.13 -0.47 1.83 0.00 1.20 0.00 0.00 173.24 175.93 2kui s ALA 412 N -2.48 2.73 0.00 5.45 0.00 -1.26 -3.99 121.76 122.21 2kui s ALA 412 Ca 0.53 0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.62 2kui s ALA 412 Cb -0.10 -4.07 0.00 0.00 0.00 0.00 0.00 23.12 18.95 2kui s ALA 412 CO 0.32 -2.87 0.00 0.41 0.00 0.00 0.00 175.76 173.63 2kui n GLY 413 N 5.48 0.16 1.27 0.00 0.00 -1.26 -4.81 105.19 106.03 2kui n GLY 413 Ca 0.23 -0.18 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 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 1.08 -4.29 1.61 -0.08 -1.26 -4.72 116.55 108.89 2kui n ASP 414 Ca 0.00 -1.56 -0.33 0.00 -1.51 0.00 0.00 54.79 51.39 2kui n ASP 414 Cb 0.00 -0.09 -0.15 0.00 2.34 0.00 0.00 41.12 43.23 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 -2.81 3.27 -0.18 -0.67 2.02 -1.26 0.14 118.70 119.20 2kui s GLU 415 Ca 0.16 -0.72 0.01 0.00 0.02 0.00 0.00 54.97 54.44 2kui s GLU 415 Cb -0.01 -2.67 0.03 0.00 0.10 0.00 0.00 34.13 31.57 2kui s GLU 415 CO 0.10 0.03 -0.15 0.42 0.02 0.00 0.00 175.26 175.68 2kui s ILE 416 N 0.80 1.80 -0.18 -1.63 -1.09 0.83 -4.92 121.20 116.83 2kui s ILE 416 Ca -0.05 -0.90 -0.15 0.00 -2.23 0.00 0.00 60.65 57.32 2kui s ILE 416 Cb -0.15 -1.73 -0.04 0.00 -1.58 0.00 0.00 42.46 38.96 2kui s ILE 416 CO 0.00 0.38 0.34 0.42 -1.23 0.00 0.00 174.94 174.86 2kui s THR 417 N 1.37 5.26 -0.06 2.92 -4.23 -1.26 -1.10 115.64 118.53 2kui s THR 417 Ca 0.02 0.63 0.06 0.00 -1.18 0.00 0.00 61.69 61.22 2kui s THR 417 Cb -0.14 -3.68 -0.01 0.00 1.34 0.00 0.00 72.50 70.01 2kui s THR 417 CO -0.10 0.32 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.37 2kui s VAL 418 N 0.86 1.98 -0.17 2.29 1.01 0.13 -4.70 120.40 121.79 2kui s VAL 418 Ca 0.18 -1.02 -0.04 0.00 0.00 0.00 0.00 61.98 61.10 2kui s VAL 418 Cb -0.14 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 2kui s VAL 418 CO 0.06 0.55 -0.03 0.20 0.00 0.00 0.00 175.10 175.89 2kui s ASN 419 N -0.10 4.83 -0.02 3.32 0.01 -1.26 -1.30 114.94 120.42 2kui s ASN 419 Ca -0.05 -0.14 0.00 0.00 -0.71 0.00 0.00 52.86 51.96 2kui s ASN 419 Cb -0.14 -1.80 -0.04 0.00 0.41 0.00 0.00 41.25 39.69 2kui s ASN 419 CO 0.04 0.14 0.03 -0.69 -1.51 0.00 0.00 177.10 175.11 2kui s VAL 420 N 0.52 4.38 -0.16 1.60 1.01 0.10 -4.84 120.40 123.01 2kui s VAL 420 Ca -0.02 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.49 2kui s VAL 420 Cb -0.14 -2.95 0.01 0.00 0.00 0.00 0.00 36.38 33.30 2kui s VAL 420 CO 0.02 0.40 -0.19 -0.44 0.00 0.00 0.00 175.10 174.90 2kui s SER 421 N -1.51 3.32 -0.37 3.32 0.01 -1.26 -0.10 113.70 117.11 2kui s SER 421 Ca 0.20 -0.57 -0.08 0.00 1.31 0.00 0.00 55.95 56.80 2kui s SER 421 Cb -0.12 -1.50 0.05 0.00 0.21 0.00 0.00 66.02 64.67 2kui s SER 421 CO 0.10 0.05 0.18 0.42 0.41 0.00 0.00 173.24 174.40 2kui s THR 422 N 0.99 4.06 0.00 1.44 -4.23 0.63 -2.79 115.64 115.75 2kui s THR 422 Ca -0.02 -1.20 0.00 0.00 -1.18 0.00 0.00 61.69 59.28 2kui s THR 422 Cb -0.15 -3.37 0.00 0.00 1.34 0.00 0.00 72.50 70.32 2kui s THR 422 CO -0.05 -0.32 0.09 0.61 -0.54 0.00 0.00 174.62 174.42 2kui n GLY 423 N 4.87 -1.09 3.71 3.99 0.00 -1.19 -1.85 105.19 113.62 2kui n GLY 423 Ca -0.11 0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.19 4.31 -0.14 1.61 0.04 -1.26 -2.05 135.00 137.32 2kui s PRO 424 Ca 0.00 2.05 -0.06 0.00 0.04 0.00 0.00 61.00 63.02 2kui s PRO 424 Cb 0.00 -3.33 -0.04 0.00 0.04 0.00 0.00 34.50 31.17 2kui s PRO 424 CO 0.00 -0.47 0.09 -1.21 0.04 0.00 0.00 177.00 175.45 2kui s GLU 425 N 1.42 3.56 -0.02 4.56 2.02 -1.26 -4.85 118.70 124.13 2kui s GLU 425 Ca 0.64 -0.25 0.02 0.00 0.02 0.00 0.00 54.97 55.41 2kui s GLU 425 Cb -0.35 -3.14 0.00 0.00 0.10 0.00 0.00 34.13 30.74 2kui s GLU 425 CO 0.29 0.59 -0.08 -1.14 0.02 0.00 0.00 175.26 174.94 2kui s GLN 426 N -0.50 0.75 0.19 1.61 0.74 -1.26 -2.25 119.66 118.93 2kui s GLN 426 Ca 0.11 -0.27 0.07 0.00 0.05 0.00 0.00 55.36 55.32 2kui s GLN 426 Cb -0.12 -0.73 -0.05 0.00 1.10 0.00 0.00 33.01 33.22 2kui s GLN 426 CO 0.02 0.12 -0.13 1.03 -0.55 0.00 0.00 175.29 175.78 2kui s ARG 427 N 0.06 1.25 -0.11 1.67 1.81 -0.04 -4.92 118.95 118.66 2kui s ARG 427 Ca -0.01 -1.53 -0.05 0.00 -1.72 0.00 0.00 55.73 52.42 2kui s ARG 427 Cb -0.06 -0.99 -0.04 0.00 -0.45 0.00 0.00 34.95 33.41 2kui s ARG 427 CO -0.00 0.16 0.07 -1.83 -0.68 0.00 0.00 175.30 173.02 2kui s GLU 428 N -3.60 3.28 -0.19 3.54 -1.05 -1.26 -0.04 118.70 119.38 2kui s GLU 428 Ca 0.20 -0.28 -0.20 0.00 -0.15 0.00 0.00 54.97 54.54 2kui s GLU 428 Cb -0.00 -3.01 -0.03 0.00 -0.44 0.00 0.00 34.13 30.65 2kui s GLU 428 CO 0.05 0.69 0.59 0.42 0.95 0.00 0.00 175.26 177.96 2kui s ILE 429 N -0.82 5.06 0.54 1.83 1.09 -0.87 -4.99 121.20 123.03 2kui s ILE 429 Ca 0.13 1.10 -0.21 0.00 -1.10 0.00 0.00 60.65 60.57 2kui s ILE 429 Cb -0.12 -3.91 -0.05 0.00 -1.06 0.00 0.00 42.46 37.32 2kui s ILE 429 CO 0.03 0.14 1.20 -2.16 -0.10 0.00 0.00 174.94 174.06 2kui s PRO 430 N 1.75 3.30 -0.59 2.79 0.04 -1.26 -4.04 135.00 136.99 2kui s PRO 430 Ca 0.27 1.84 -0.28 0.00 0.04 0.00 0.00 61.00 62.87 2kui s PRO 430 Cb -0.16 -2.14 0.01 0.00 0.04 0.00 0.00 34.50 32.26 2kui s PRO 430 CO 0.10 -0.94 1.43 0.34 0.04 0.00 0.00 177.00 177.97 2kui s ASP 431 N -1.46 6.06 0.09 6.66 2.15 -1.26 -4.91 116.67 124.01 2kui s ASP 431 Ca 0.72 0.18 -0.02 0.00 0.43 0.00 0.00 52.55 53.85 2kui s ASP 431 Cb -0.30 -2.55 -0.05 0.00 -0.30 0.00 0.00 42.92 39.73 2kui s ASP 431 CO 0.35 -1.78 0.28 -0.69 -0.17 0.00 0.00 175.17 173.15 2kui s VAL 432 N 6.25 5.30 0.61 1.11 1.01 -1.26 -5.08 120.40 128.33 2kui s VAL 432 Ca 0.51 -0.22 -0.15 0.00 0.00 0.00 0.00 61.98 62.11 2kui s VAL 432 Cb -0.10 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 2kui s VAL 432 CO 0.23 0.10 1.07 -0.44 0.00 0.00 0.00 175.10 176.06 2kui s SER 433 N -2.48 5.65 0.35 3.32 0.01 -1.26 -4.95 113.70 114.34 2kui s SER 433 Ca 0.37 1.84 0.12 0.00 1.31 0.00 0.00 55.95 59.60 2kui s SER 433 Cb -0.13 -2.54 0.65 0.00 0.21 0.00 0.00 66.02 64.21 2kui s SER 433 CO 0.27 -1.26 1.79 0.71 0.41 0.00 0.00 173.24 175.15 2kui h THR 434 N 0.33 1.30 0.00 1.44 1.35 -1.97 -2.33 112.91 113.03 2kui h THR 434 Ca -0.47 -1.42 0.00 0.00 -0.55 0.00 0.00 66.41 63.97 2kui h THR 434 Cb 1.22 1.76 0.00 0.00 -1.73 0.00 0.00 68.15 69.40 2kui h THR 434 CO 0.57 0.41 -0.01 0.00 -0.25 0.00 0.00 175.52 176.24 2kui n LEU 435 N -4.05 0.25 -3.52 3.87 -0.00 -1.26 0.06 117.00 112.34 2kui n LEU 435 Ca -0.02 0.52 -0.35 0.00 -0.00 0.00 0.00 56.01 56.16 2kui n LEU 435 Cb 0.44 -0.44 -0.02 0.00 -0.00 0.00 0.00 43.42 43.40 2kui n LEU 435 CO 0.40 -0.05 0.73 0.35 -0.00 0.00 0.00 177.39 178.81 2kui n THR 436 N -1.73 4.32 -0.29 1.47 -2.24 -0.88 -4.82 114.28 110.10 2kui n THR 436 Ca 0.07 -5.70 0.01 0.00 -2.27 0.00 0.00 64.05 56.15 2kui n THR 436 Cb 0.37 -1.79 0.21 0.00 -2.10 0.00 0.00 70.33 67.01 2kui n THR 436 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2kui h TYR 437 N 4.25 1.07 -0.58 4.78 3.20 -1.76 -0.88 116.97 127.05 2kui h TYR 437 Ca 0.27 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.14 2kui h TYR 437 Cb 0.52 -0.36 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 2kui h TYR 437 CO 0.99 0.63 0.24 0.00 -1.64 0.00 0.00 178.16 178.38 2kui h ALA 438 N 1.48 1.32 -0.35 1.82 0.00 -1.96 0.17 119.26 121.74 2kui h ALA 438 Ca 0.34 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.95 2kui h ALA 438 Cb -0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2kui h ALA 438 CO -0.10 0.51 -0.40 1.49 0.00 0.00 0.00 179.25 180.75 2kui h GLU 439 N 0.83 0.89 0.11 0.00 4.57 -1.83 -2.69 114.58 116.46 2kui h GLU 439 Ca 0.20 -0.49 -0.01 0.00 -1.18 0.00 0.00 59.36 57.89 2kui h GLU 439 Cb 0.16 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.78 2kui h GLU 439 CO -0.02 1.13 -0.05 0.00 -1.18 0.00 0.00 179.01 178.89 2kui h ALA 440 N 0.74 -0.15 -0.72 2.92 0.00 -0.33 -0.71 119.26 121.01 2kui h ALA 440 Ca 0.05 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2kui h ALA 440 Cb 1.00 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2kui h ALA 440 CO 0.10 -0.56 0.20 -0.39 0.00 0.00 0.00 179.25 178.59 2kui h VAL 441 N -0.19 1.26 -0.33 0.00 -1.51 -1.04 -0.03 116.25 114.42 2kui h VAL 441 Ca -0.02 -0.94 -0.12 0.00 -1.23 0.00 0.00 66.70 64.39 2kui h VAL 441 Cb 0.15 0.49 -0.01 0.00 -2.13 0.00 0.00 31.29 29.79 2kui h VAL 441 CO 0.02 0.36 -0.30 0.07 -1.23 0.00 0.00 177.57 176.50 2kui h LYS 442 N 1.08 0.69 -0.51 5.19 2.10 -1.33 -1.60 116.57 122.19 2kui h LYS 442 Ca 0.23 -0.31 -0.09 0.00 -2.00 0.00 0.00 60.65 58.48 2kui h LYS 442 Cb 0.34 -0.02 -0.02 0.00 -0.90 0.00 0.00 32.23 31.63 2kui h LYS 442 CO -0.00 0.90 -0.05 0.87 -2.00 0.00 0.00 179.45 179.17 2kui h LYS 443 N 0.59 0.90 -0.50 0.07 1.79 -0.71 0.23 116.57 118.94 2kui h LYS 443 Ca 0.07 -0.29 -0.04 0.00 -2.18 0.00 0.00 60.65 58.21 2kui h LYS 443 Cb 0.80 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 31.34 2kui h LYS 443 CO 0.07 0.93 0.13 -0.07 -1.08 0.00 0.00 179.45 179.42 2kui h LEU 444 N 0.82 0.70 -0.23 2.94 3.38 -0.78 -0.69 115.31 121.46 2kui h LEU 444 Ca 0.15 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 2kui h LEU 444 Cb 0.56 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 2kui h LEU 444 CO 0.03 0.69 -0.26 0.74 0.09 0.00 0.00 178.44 179.73 2kui h THR 445 N 0.73 1.32 0.00 0.22 2.02 -0.46 -0.37 112.91 116.37 2kui h THR 445 Ca 0.16 -1.44 -0.01 0.00 0.77 0.00 0.00 66.41 65.89 2kui h THR 445 Cb 0.26 1.72 -0.00 0.00 -1.74 0.00 0.00 68.15 68.40 2kui h THR 445 CO -0.00 0.45 -0.06 0.00 0.37 0.00 0.00 175.52 176.28 2kui h ALA 446 N 0.66 1.07 -0.07 6.16 0.00 -0.25 -1.48 119.26 125.35 2kui h ALA 446 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2kui h ALA 446 Cb 0.82 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2kui h ALA 446 CO 0.06 0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.38 2kui n ALA 447 N -2.15 2.56 0.00 0.00 0.00 -0.29 -4.96 120.51 115.67 2kui n ALA 447 Ca -0.01 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2kui n ALA 447 Cb 0.26 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 0.90 1.83 0.38 0.00 0.00 -0.56 -4.72 105.19 103.01 2kui n GLY 448 Ca 0.14 -0.71 -0.10 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.40 -2.39 1.61 1.16 -1.26 -4.80 117.46 111.38 2kui n PHE 449 Ca 0.00 1.13 -0.20 0.00 -1.87 0.00 0.00 57.45 56.51 2kui n PHE 449 Cb 0.00 -0.57 -0.01 0.00 -1.61 0.00 0.00 39.48 37.29 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 -1.23 -0.44 3.39 4.97 0.00 -0.16 -4.90 105.19 106.82 2kui n GLY 450 Ca 0.02 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 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 -5.00 2.90 -0.00 1.61 1.81 -1.26 -4.74 118.95 114.27 2kui s ARG 451 Ca 0.01 -1.03 0.02 0.00 -1.72 0.00 0.00 55.73 53.00 2kui s ARG 451 Cb -0.00 -3.71 -0.00 0.00 -0.45 0.00 0.00 34.95 30.78 2kui s ARG 451 CO 0.01 -0.66 -0.05 -0.59 -0.68 0.00 0.00 175.30 173.32 2kui s PHE 452 N 1.56 0.46 -0.01 -0.53 -0.12 -1.26 -1.52 117.98 116.57 2kui s PHE 452 Ca 0.02 -0.10 0.03 0.00 -0.05 0.00 0.00 56.93 56.84 2kui s PHE 452 Cb -0.19 -0.30 -0.01 0.00 -0.63 0.00 0.00 43.02 41.90 2kui s PHE 452 CO 0.07 -0.01 -0.11 0.15 -0.05 0.00 0.00 175.22 175.27 2kui s LYS 453 N -0.16 0.88 -0.16 1.99 -0.14 -0.45 -4.96 119.74 116.73 2kui s LYS 453 Ca 0.02 -0.39 -0.04 0.00 -1.36 0.00 0.00 55.97 54.20 2kui s LYS 453 Cb -0.02 -0.85 -0.03 0.00 -1.68 0.00 0.00 37.83 35.25 2kui s LYS 453 CO -0.00 0.23 -0.04 -1.14 -0.76 0.00 0.00 175.35 173.64 2kui s GLN 454 N -0.26 3.65 0.13 1.68 0.74 -1.26 0.42 119.66 124.77 2kui s GLN 454 Ca 0.04 -0.53 0.11 0.00 0.05 0.00 0.00 55.36 55.03 2kui s GLN 454 Cb -0.04 -2.92 -0.04 0.00 1.10 0.00 0.00 33.01 31.11 2kui s GLN 454 CO -0.00 0.21 -0.25 0.00 -0.55 0.00 0.00 175.29 174.69 2kui s ALA 455 N 0.44 2.31 -0.01 1.58 0.00 0.95 -4.95 121.76 122.08 2kui s ALA 455 Ca -0.04 -1.46 0.07 0.00 0.00 0.00 0.00 51.96 50.54 2kui s ALA 455 Cb -0.14 -0.35 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 2kui s ALA 455 CO 0.03 0.49 -0.24 -0.80 0.00 0.00 0.00 175.76 175.25 2kui s ASN 456 N -2.13 2.77 -0.07 0.00 0.01 -1.26 -0.30 114.94 113.95 2kui s ASN 456 Ca 0.14 -0.44 -0.05 0.00 -0.71 0.00 0.00 52.86 51.79 2kui s ASN 456 Cb -0.10 -0.30 0.02 0.00 0.41 0.00 0.00 41.25 41.29 2kui s ASN 456 CO 0.06 0.28 0.17 -0.55 -1.51 0.00 0.00 177.10 175.55 2kui s SER 457 N -0.65 -0.17 0.19 -1.22 0.15 -0.20 -4.91 113.70 106.88 2kui s SER 457 Ca 0.09 0.35 -0.30 0.00 0.70 0.00 0.00 55.95 56.79 2kui s SER 457 Cb -0.09 0.33 -0.08 0.00 -1.71 0.00 0.00 66.02 64.46 2kui s SER 457 CO -0.00 -0.08 1.26 -2.16 1.20 0.00 0.00 173.24 173.45 2kui s PRO 458 N 0.39 4.43 0.36 5.44 0.04 -1.09 -0.52 135.00 144.04 2kui s PRO 458 Ca -0.02 1.97 -0.06 0.00 0.04 0.00 0.00 61.00 62.92 2kui s PRO 458 Cb -0.04 -3.22 0.03 0.00 0.04 0.00 0.00 34.50 31.31 2kui s PRO 458 CO -0.02 -0.18 0.58 0.43 0.04 0.00 0.00 177.00 177.85 2kui n SER 459 N 2.61 -1.65 -4.56 6.66 7.64 -1.12 -4.89 113.62 118.31 2kui n SER 459 Ca 0.05 -2.73 -0.47 0.00 1.01 0.00 0.00 58.87 56.73 2kui n SER 459 Cb 0.44 2.92 -0.03 0.00 -1.01 0.00 0.00 64.21 66.52 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 -0.55 1.46 -0.12 0.44 5.66 -1.26 -3.68 114.28 116.23 2kui n THR 460 Ca -0.03 -0.36 0.23 0.00 -3.05 0.00 0.00 64.05 60.84 2kui n THR 460 Cb 0.57 -0.76 0.67 0.00 -1.55 0.00 0.00 70.33 69.26 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 2.49 0.08 0.00 1.09 0.13 -1.94 -0.55 132.00 133.30 2kui h PRO 461 Ca -0.40 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.67 2kui h PRO 461 Cb 1.36 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.46 2kui h PRO 461 CO 0.64 0.05 -0.29 1.05 -0.23 0.00 0.00 178.00 179.23 2kui h GLU 462 N 0.08 0.00 0.00 0.86 4.11 -2.02 -2.41 114.58 115.20 2kui h GLU 462 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.79 2kui h GLU 462 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 2kui h GLU 462 CO -0.03 0.29 -1.21 1.28 0.07 0.00 0.00 179.01 179.40 2kui n LEU 463 N -3.73 0.55 -4.71 3.06 7.99 -0.26 -4.88 117.00 115.02 2kui n LEU 463 Ca -0.01 -0.02 -0.42 0.00 -0.01 0.00 0.00 56.01 55.54 2kui n LEU 463 Cb 0.39 -0.07 -0.03 0.00 -0.11 0.00 0.00 43.42 43.61 2kui n LEU 463 CO 0.35 0.03 1.38 -0.69 -1.51 0.00 0.00 177.39 176.96 2kui s VAL 464 N -3.26 2.22 0.00 4.08 1.01 -0.91 -1.63 120.40 121.91 2kui s VAL 464 Ca 0.01 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.07 2kui s VAL 464 Cb 0.14 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.47 2kui s VAL 464 CO 0.83 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.54 2kui n GLY 465 N 4.02 0.43 3.60 4.51 0.00 0.52 -4.98 105.19 113.29 2kui n GLY 465 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.00 1.93 0.42 1.61 3.01 -0.65 -4.91 119.74 120.15 2kui s LYS 466 Ca 0.00 -1.97 -0.23 0.00 -1.01 0.00 0.00 55.97 52.76 2kui s LYS 466 Cb 0.00 -1.73 -0.09 0.00 -1.01 0.00 0.00 37.83 35.00 2kui s LYS 466 CO 0.00 0.05 1.04 0.08 0.51 0.00 0.00 175.35 177.03 2kui s VAL 467 N -2.64 3.80 -0.20 3.17 1.01 0.11 -1.00 120.40 124.65 2kui s VAL 467 Ca 0.34 1.30 0.08 0.00 0.00 0.00 0.00 61.98 63.71 2kui s VAL 467 Cb 0.05 -3.64 -0.22 0.00 0.00 0.00 0.00 36.38 32.58 2kui s VAL 467 CO 0.18 -0.06 0.04 -0.38 0.00 0.00 0.00 175.10 174.88 2kui n ILE 468 N -0.29 1.50 -4.00 2.22 5.41 0.90 -4.68 119.36 120.43 2kui n ILE 468 Ca 0.06 -0.71 0.00 0.00 1.00 0.00 0.00 62.75 63.10 2kui n ILE 468 Cb 0.51 -1.05 0.00 0.00 -0.71 0.00 0.00 39.64 38.38 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 -0.52 3.47 7.39 0.00 -1.15 -5.04 105.19 111.30 2kui n GLY 469 Ca -0.36 -1.12 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 2kui n GLY 469 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 470 N -3.00 2.83 0.03 2.61 -4.23 -1.26 -0.67 115.64 111.94 2kui s THR 470 Ca 0.00 -1.21 -0.28 0.00 -1.18 0.00 0.00 61.69 59.02 2kui s THR 470 Cb 0.00 -2.21 -0.17 0.00 1.34 0.00 0.00 72.50 71.47 2kui s THR 470 CO 0.00 0.31 1.35 -1.13 -0.54 0.00 0.00 174.62 174.61 2kui h ASN 471 N 4.43 -0.56 -4.00 3.99 -0.73 -1.53 -3.42 115.58 113.76 2kui h ASN 471 Ca -0.48 -0.06 -0.45 0.00 1.87 0.00 0.00 56.30 57.18 2kui h ASN 471 Cb 1.16 0.14 -0.02 0.00 0.27 0.00 0.00 38.32 39.87 2kui h ASN 471 CO 0.48 -0.25 0.31 -2.16 -0.37 0.00 0.00 177.43 175.44 2kui s PRO 472 N -5.15 4.23 0.10 6.67 0.04 -1.26 -4.99 135.00 134.65 2kui s PRO 472 Ca -0.15 1.09 -0.31 0.00 0.04 0.00 0.00 61.00 61.66 2kui s PRO 472 Cb 0.03 -2.26 -0.09 0.00 0.04 0.00 0.00 34.50 32.21 2kui s PRO 472 CO 0.55 0.02 1.61 -2.14 0.04 0.00 0.00 177.00 177.08 2kui s PRO 473 N -3.06 4.21 -0.02 0.56 0.02 -1.26 -4.87 135.00 130.58 2kui s PRO 473 Ca 0.60 2.33 0.01 0.00 0.02 0.00 0.00 61.00 63.96 2kui s PRO 473 Cb -0.10 -3.43 -0.26 0.00 0.02 0.00 0.00 34.50 30.73 2kui s PRO 473 CO 0.14 -0.68 0.78 0.00 -0.33 0.00 0.00 177.00 176.91 2kui h ALA 474 N 7.74 0.41 0.00 -1.55 0.00 -1.91 -3.30 119.26 120.65 2kui h ALA 474 Ca -0.43 -1.21 0.00 0.00 0.00 0.00 0.00 54.91 53.27 2kui h ALA 474 Cb 1.20 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2kui h ALA 474 CO 0.92 1.27 0.00 0.09 0.00 0.00 0.00 179.25 181.53 2kui n ASN 475 N -3.36 0.14 -1.10 0.00 4.13 -1.26 -2.06 115.26 111.76 2kui n ASN 475 Ca -0.17 -1.22 0.00 0.00 1.68 0.00 0.00 54.58 54.86 2kui n ASN 475 Cb 1.04 -0.07 0.00 0.00 -1.54 0.00 0.00 39.78 39.21 2kui n ASN 475 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2kui n GLN 476 N -0.34 2.89 -4.12 3.52 1.13 -1.24 -4.86 117.38 114.36 2kui n GLN 476 Ca 0.00 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.70 2kui n GLN 476 Cb 0.04 0.00 -0.08 0.00 0.11 0.00 0.00 30.24 30.31 2kui n GLN 476 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 2kui s THR 477 N -0.08 4.91 -0.01 5.09 -4.23 -1.26 -2.64 115.64 117.42 2kui s THR 477 Ca 0.00 -0.02 0.01 0.00 -1.18 0.00 0.00 61.69 60.50 2kui s THR 477 Cb 0.00 -3.11 -0.00 0.00 1.34 0.00 0.00 72.50 70.73 2kui s THR 477 CO 0.00 0.61 -0.04 -0.44 -0.54 0.00 0.00 174.62 174.21 2kui s SER 478 N -0.97 0.47 0.93 3.99 0.01 0.95 -4.94 113.70 114.12 2kui s SER 478 Ca 0.14 -0.07 -0.12 0.00 1.31 0.00 0.00 55.95 57.22 2kui s SER 478 Cb -0.12 -0.07 0.15 0.00 0.21 0.00 0.00 66.02 66.19 2kui s SER 478 CO 0.03 0.04 1.09 0.00 0.41 0.00 0.00 173.24 174.81 2kui s ALA 479 N 0.01 1.30 -0.42 1.44 0.00 -1.26 -0.86 121.76 121.97 2kui s ALA 479 Ca 0.00 -0.01 0.25 0.00 0.00 0.00 0.00 51.96 52.20 2kui s ALA 479 Cb -0.03 -3.22 1.02 0.00 0.00 0.00 0.00 23.12 20.89 2kui s ALA 479 CO -0.00 -2.57 1.75 0.82 0.00 0.00 0.00 175.76 175.76 2kui h ILE 480 N -1.71 0.00 -0.15 0.00 1.08 -1.81 -0.85 117.51 114.07 2kui h ILE 480 Ca -0.50 -0.28 0.00 0.00 -0.39 0.00 0.00 64.86 63.68 2kui h ILE 480 Cb 1.29 1.07 0.00 0.00 -3.07 0.00 0.00 36.82 36.10 2kui h ILE 480 CO 0.53 0.00 0.00 1.07 -0.69 0.00 0.00 178.15 179.06 2kui n THR 481 N -2.36 0.18 -3.45 -0.27 5.66 -1.26 -4.21 114.28 108.57 2kui n THR 481 Ca 0.02 -0.40 -0.38 0.00 -3.05 0.00 0.00 64.05 60.25 2kui n THR 481 Cb 0.25 0.62 -0.06 0.00 -1.55 0.00 0.00 70.33 69.59 2kui n THR 481 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2kui s ASN 482 N -1.71 6.84 -0.18 1.09 -0.87 -0.33 -5.07 114.94 114.72 2kui s ASN 482 Ca 0.34 1.01 -0.05 0.00 -1.57 0.00 0.00 52.86 52.60 2kui s ASN 482 Cb 0.19 -2.27 -0.03 0.00 -0.02 0.00 0.00 41.25 39.13 2kui s ASN 482 CO 0.29 0.28 -0.01 0.54 -2.57 0.00 0.00 177.10 175.64 2kui s VAL 483 N -1.15 4.00 -0.16 1.60 0.11 -1.26 -4.51 120.40 119.03 2kui s VAL 483 Ca 0.27 -0.31 -0.06 0.00 -2.93 0.00 0.00 61.98 58.95 2kui s VAL 483 Cb -0.17 -2.79 -0.04 0.00 -1.53 0.00 0.00 36.38 31.86 2kui s VAL 483 CO 0.15 0.45 0.06 0.68 -3.33 0.00 0.00 175.10 173.11 2kui s VAL 484 N 0.71 4.75 -0.24 2.04 -7.23 -0.58 -4.99 120.40 114.86 2kui s VAL 484 Ca -0.00 -0.06 -0.09 0.00 -1.81 0.00 0.00 61.98 60.01 2kui s VAL 484 Cb -0.14 -3.10 -0.04 0.00 0.56 0.00 0.00 36.38 33.65 2kui s VAL 484 CO 0.02 0.50 0.13 -0.51 -0.31 0.00 0.00 175.10 174.94 2kui s ILE 485 N -0.00 5.07 -0.23 -0.62 -1.16 -1.26 -1.34 121.20 121.65 2kui s ILE 485 Ca 0.06 0.08 -0.10 0.00 -0.51 0.00 0.00 60.65 60.18 2kui s ILE 485 Cb -0.12 -3.36 -0.05 0.00 0.61 0.00 0.00 42.46 39.54 2kui s ILE 485 CO 0.01 0.35 0.14 -0.63 -2.81 0.00 0.00 174.94 172.00 2kui s ILE 486 N 1.14 5.23 -0.19 2.00 1.09 0.17 -1.19 121.20 129.45 2kui s ILE 486 Ca 0.06 0.13 -0.06 0.00 -1.10 0.00 0.00 60.65 59.69 2kui s ILE 486 Cb -0.14 -3.43 -0.03 0.00 -1.06 0.00 0.00 42.46 37.80 2kui s ILE 486 CO 0.05 0.36 0.02 -0.51 -0.10 0.00 0.00 174.94 174.76 2kui s ILE 487 N 0.98 4.21 0.12 2.92 2.07 0.15 -0.03 121.20 131.61 2kui s ILE 487 Ca 0.07 -0.23 0.06 0.00 -1.41 0.00 0.00 60.65 59.14 2kui s ILE 487 Cb -0.13 -2.90 -0.04 0.00 0.13 0.00 0.00 42.46 39.52 2kui s ILE 487 CO 0.04 0.44 -0.02 0.68 -1.91 0.00 0.00 174.94 174.16 2kui s VAL 488 N 0.80 3.79 -0.21 4.00 -7.23 0.58 -0.07 120.40 122.06 2kui s VAL 488 Ca 0.01 -1.17 -0.26 0.00 -1.81 0.00 0.00 61.98 58.75 2kui s VAL 488 Cb -0.14 -2.82 -0.01 0.00 0.56 0.00 0.00 36.38 33.97 2kui s VAL 488 CO 0.02 0.06 0.88 -0.83 -0.31 0.00 0.00 175.10 174.92 2kui s GLY 489 N -2.45 1.90 -0.04 2.32 0.00 -0.17 -1.03 107.32 107.84 2kui s GLY 489 Ca 0.25 0.01 -0.01 0.00 0.00 0.00 0.00 44.72 44.97 2kui s GLY 489 CO 0.17 1.84 0.07 -0.45 0.00 0.00 0.00 173.10 174.73 2kui s SER 490 N 1.24 0.12 0.00 1.64 0.15 0.32 -0.36 113.70 116.81 2kui s SER 490 Ca 0.38 0.12 0.00 0.00 0.70 0.00 0.00 55.95 57.16 2kui s SER 490 Cb -0.16 0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.16 2kui s SER 490 CO 0.09 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.00 2kui n GLY 491 N 4.31 -2.40 3.76 9.45 0.00 -1.26 -2.69 105.19 116.36 2kui n GLY 491 Ca -0.25 -0.45 -0.40 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.72 4.71 -0.28 1.61 0.02 -1.26 -2.80 135.00 136.30 2kui s PRO 492 Ca 0.00 1.58 0.05 0.00 0.02 0.00 0.00 61.00 62.65 2kui s PRO 492 Cb 0.00 -3.15 0.54 0.00 0.02 0.00 0.00 34.50 31.90 2kui s PRO 492 CO 0.00 0.35 1.59 0.00 -0.33 0.00 0.00 177.00 178.62 2kui n ALA 493 N 1.19 4.37 -2.42 -1.55 0.00 -1.24 -4.86 120.51 115.99 2kui n ALA 493 Ca -0.01 -1.90 -0.30 0.00 0.00 0.00 0.00 53.44 51.24 2kui n ALA 493 Cb 0.47 -1.25 -0.13 0.00 0.00 0.00 0.00 19.45 18.54 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 -2.40 2.52 -0.14 0.00 -4.23 -1.26 -0.45 115.64 109.68 2kui s THR 494 Ca 0.42 -1.47 -0.13 0.00 -1.18 0.00 0.00 61.69 59.32 2kui s THR 494 Cb 0.34 -2.09 0.04 0.00 1.34 0.00 0.00 72.50 72.13 2kui s THR 494 CO 0.09 0.22 0.38 -0.75 -0.54 0.00 0.00 174.62 174.02 2kui s LYS 495 N -1.75 0.45 -0.14 3.99 2.36 0.20 -4.86 119.74 120.00 2kui s LYS 495 Ca 0.15 0.52 -0.21 0.00 -2.55 0.00 0.00 55.97 53.87 2kui s LYS 495 Cb -0.10 0.22 -0.03 0.00 -1.05 0.00 0.00 37.83 36.86 2kui s LYS 495 CO 0.06 -0.06 0.61 0.16 1.55 0.00 0.00 175.35 177.68 2kui s ASP 496 N 0.17 6.78 0.05 1.43 -4.77 -1.26 -1.66 116.67 117.40 2kui s ASP 496 Ca -0.00 0.94 -0.30 0.00 -3.30 0.00 0.00 52.55 49.88 2kui s ASP 496 Cb -0.03 -2.35 -0.05 0.00 -1.09 0.00 0.00 42.92 39.40 2kui s ASP 496 CO 0.01 -0.16 1.13 0.27 0.70 0.00 0.00 175.17 177.12 2kui s ILE 497 N 1.25 4.27 0.42 2.11 -4.36 -0.79 -4.90 121.20 119.20 2kui s ILE 497 Ca 0.31 1.64 -0.04 0.00 -0.26 0.00 0.00 60.65 62.29 2kui s ILE 497 Cb -0.16 -4.05 0.09 0.00 1.25 0.00 0.00 42.46 39.59 2kui s ILE 497 CO 0.13 0.13 0.57 -0.81 0.24 0.00 0.00 174.94 175.20 2kui n PRO 498 N 3.88 -0.23 -2.72 0.37 -0.04 -1.26 0.64 135.00 135.64 2kui n PRO 498 Ca 0.08 -1.14 -0.41 0.00 -0.04 0.00 0.00 63.50 61.98 2kui n PRO 498 Cb 0.48 -0.51 -0.04 0.00 -0.04 0.00 0.00 33.50 33.39 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 -3.18 7.46 0.00 3.54 -4.77 -1.26 -4.59 116.67 113.86 2kui s ASP 499 Ca 0.35 1.75 0.00 0.00 -3.30 0.00 0.00 52.55 51.34 2kui s ASP 499 Cb -0.01 -2.58 0.00 0.00 -1.09 0.00 0.00 42.92 39.24 2kui s ASP 499 CO 0.24 -0.13 0.05 0.55 0.70 0.00 0.00 175.17 176.58 2kui n VAL 500 N 3.14 0.00 -2.18 2.11 3.14 -1.26 -5.03 118.33 118.25 2kui n VAL 500 Ca 0.03 -0.17 -0.43 0.00 -2.96 0.00 0.00 64.34 60.81 2kui n VAL 500 Cb 0.50 1.18 -0.02 0.00 -1.06 0.00 0.00 33.84 34.43 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 -0.25 3.28 0.00 1.55 0.00 -1.26 -1.79 121.76 123.29 2kui s ALA 501 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.34 2kui s ALA 501 Cb 0.00 -3.84 0.00 0.00 0.00 0.00 0.00 23.12 19.28 2kui s ALA 501 CO 0.00 -1.93 0.00 0.41 0.00 0.00 0.00 175.76 174.24 2kui n GLY 502 N 4.61 1.45 3.94 0.00 0.00 0.35 -4.98 105.19 110.55 2kui n GLY 502 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 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 2.41 0.56 1.61 -0.21 -0.74 -4.73 119.66 118.56 2kui s GLN 503 Ca 0.00 -0.30 -0.07 0.00 0.02 0.00 0.00 55.36 55.01 2kui s GLN 503 Cb 0.00 -2.25 -0.01 0.00 1.00 0.00 0.00 33.01 31.74 2kui s GLN 503 CO 0.00 -1.03 0.88 0.95 -2.12 0.00 0.00 175.29 173.97 2kui s THR 504 N -3.10 4.26 0.25 -0.19 -4.23 -1.26 -0.49 115.64 110.88 2kui s THR 504 Ca 0.58 0.21 -0.03 0.00 -1.18 0.00 0.00 61.69 61.27 2kui s THR 504 Cb -0.11 -3.67 0.23 0.00 1.34 0.00 0.00 72.50 70.30 2kui s THR 504 CO 0.44 -0.71 1.80 -0.37 -0.54 0.00 0.00 174.62 175.24 2kui h VAL 505 N -0.06 0.86 -0.42 2.29 -1.51 -1.21 0.28 116.25 116.47 2kui h VAL 505 Ca -0.46 -0.26 -0.09 0.00 -1.23 0.00 0.00 66.70 64.66 2kui h VAL 505 Cb 1.23 0.03 -0.01 0.00 -2.13 0.00 0.00 31.29 30.41 2kui h VAL 505 CO 0.61 0.14 -0.10 -0.78 -1.23 0.00 0.00 177.57 176.22 2kui h ASP 506 N 0.76 0.81 -0.39 4.19 3.58 -1.93 -0.58 116.42 122.86 2kui h ASP 506 Ca 0.43 -0.36 -0.16 0.00 0.42 0.00 0.00 57.03 57.36 2kui h ASP 506 Cb 0.46 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.28 2kui h ASP 506 CO -0.28 0.98 -0.38 0.58 -2.88 0.00 0.00 179.24 177.26 2kui h VAL 507 N 0.63 1.27 -0.05 2.25 2.07 -1.80 -0.80 116.25 119.82 2kui h VAL 507 Ca 0.11 -1.55 -0.00 0.00 0.82 0.00 0.00 66.70 66.08 2kui h VAL 507 Cb 0.62 1.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 2kui h VAL 507 CO 0.04 0.52 0.02 0.00 0.02 0.00 0.00 177.57 178.17 2kui h ALA 508 N 0.77 0.06 -0.44 1.67 0.00 -0.29 0.16 119.26 121.19 2kui h ALA 508 Ca 0.06 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2kui h ALA 508 Cb 0.97 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 2kui h ALA 508 CO 0.09 -0.35 0.11 1.96 0.00 0.00 0.00 179.25 181.06 2kui h GLN 509 N -0.08 0.65 -0.51 0.00 4.20 -1.07 -0.88 115.11 117.43 2kui h GLN 509 Ca 0.02 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 2kui h GLN 509 Cb 0.17 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 2kui h GLN 509 CO -0.00 0.60 0.24 -0.22 -0.67 0.00 0.00 178.83 178.78 2kui h LYS 510 N 0.64 0.74 -0.09 1.46 3.64 -0.74 0.18 116.57 122.39 2kui h LYS 510 Ca 0.15 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2kui h LYS 510 Cb 0.24 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2kui h LYS 510 CO -0.00 0.62 0.05 -0.91 -2.27 0.00 0.00 179.45 176.93 2kui h ASN 511 N 0.68 0.11 -0.21 4.20 -0.26 0.42 0.13 115.58 120.65 2kui h ASN 511 Ca 0.17 -0.08 -0.01 0.00 -0.56 0.00 0.00 56.30 55.83 2kui h ASN 511 Cb 0.13 -0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.35 2kui h ASN 511 CO -0.02 0.16 0.11 -0.07 -1.06 0.00 0.00 177.43 176.55 2kui h LEU 512 N 0.06 0.26 -0.66 1.61 -0.00 -1.04 -2.08 115.31 113.46 2kui h LEU 512 Ca 0.03 -0.10 -0.10 0.00 -0.00 0.00 0.00 57.88 57.71 2kui h LEU 512 Cb 0.07 -0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 40.65 2kui h LEU 512 CO -0.01 0.29 -0.05 0.78 -0.00 0.00 0.00 178.44 179.46 2kui h ASN 513 N 0.22 0.98 0.35 -0.43 -0.26 -0.76 0.34 115.58 116.02 2kui h ASN 513 Ca 0.07 -0.29 -0.06 0.00 -0.56 0.00 0.00 56.30 55.46 2kui h ASN 513 Cb 0.09 -0.26 -0.01 0.00 -1.06 0.00 0.00 38.32 37.07 2kui h ASN 513 CO -0.01 1.06 -0.29 0.58 -1.06 0.00 0.00 177.43 177.70 2kui h VAL 514 N 0.90 1.13 -0.00 2.81 2.07 -0.87 -2.23 116.25 120.05 2kui h VAL 514 Ca 0.15 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.64 2kui h VAL 514 Cb 0.59 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 2kui h VAL 514 CO 0.04 0.29 -0.19 -1.22 0.02 0.00 0.00 177.57 176.50 2kui n TYR 515 N -4.07 0.00 0.00 1.57 4.01 -0.74 -4.89 117.16 113.04 2kui n TYR 515 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 2kui n TYR 515 Cb 0.35 -0.17 0.00 0.00 -0.31 0.00 0.00 39.34 39.21 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 1.33 0.76 3.65 2.72 0.00 -0.84 -4.95 105.19 107.86 2kui n GLY 516 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 2kui n GLY 516 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kui s PHE 517 N -2.00 3.06 -0.05 1.61 0.08 0.03 -4.62 117.98 116.09 2kui s PHE 517 Ca 0.00 1.20 0.09 0.00 0.12 0.00 0.00 56.93 58.34 2kui s PHE 517 Cb 0.00 -3.48 -0.24 0.00 -0.57 0.00 0.00 43.02 38.73 2kui s PHE 517 CO 0.00 -1.10 0.63 1.79 -0.10 0.00 0.00 175.22 176.44 2kui h THR 518 N 5.56 0.83 -3.55 0.64 1.35 -1.62 -3.24 112.91 112.89 2kui h THR 518 Ca -0.23 -2.66 -0.66 0.00 -0.55 0.00 0.00 66.41 62.32 2kui h THR 518 Cb 1.08 2.45 -0.25 0.00 -1.73 0.00 0.00 68.15 69.70 2kui h THR 518 CO 0.99 0.56 -0.66 -0.54 -0.25 0.00 0.00 175.52 175.62 2kui s LYS 519 N -2.59 3.47 0.04 4.72 1.02 -1.24 -5.02 119.74 120.14 2kui s LYS 519 Ca -0.07 -0.59 0.05 0.00 0.02 0.00 0.00 55.97 55.38 2kui s LYS 519 Cb 0.08 -3.22 -0.02 0.00 -0.52 0.00 0.00 37.83 34.15 2kui s LYS 519 CO 0.82 -0.23 -0.14 -0.59 -0.92 0.00 0.00 175.35 174.29 2kui s PHE 520 N 1.55 1.20 -0.01 3.18 -0.12 -1.26 -0.86 117.98 121.66 2kui s PHE 520 Ca 0.06 -0.36 -0.02 0.00 -0.05 0.00 0.00 56.93 56.56 2kui s PHE 520 Cb -0.15 -0.71 -0.00 0.00 -0.63 0.00 0.00 43.02 41.53 2kui s PHE 520 CO 0.01 0.03 0.04 -1.12 -0.05 0.00 0.00 175.22 174.13 2kui s SER 521 N -1.14 0.02 -0.07 1.98 0.01 -0.34 -4.91 113.70 109.25 2kui s SER 521 Ca 0.01 -0.06 0.04 0.00 1.31 0.00 0.00 55.95 57.26 2kui s SER 521 Cb -0.08 0.10 -0.01 0.00 0.21 0.00 0.00 66.02 66.24 2kui s SER 521 CO 0.01 -0.10 -0.20 0.00 0.41 0.00 0.00 173.24 173.36 2kui s GLN 522 N -0.40 2.70 -0.16 12.44 -2.07 -1.26 -0.01 119.66 130.91 2kui s GLN 522 Ca -0.05 -0.82 0.00 0.00 -1.82 0.00 0.00 55.36 52.68 2kui s GLN 522 Cb -0.03 -2.30 0.02 0.00 -1.09 0.00 0.00 33.01 29.61 2kui s GLN 522 CO -0.00 0.40 -0.14 0.00 -1.32 0.00 0.00 175.29 174.23 2kui s ALA 523 N -0.19 1.92 -0.03 2.60 0.00 0.36 -4.94 121.76 121.48 2kui s ALA 523 Ca -0.02 -0.97 -0.25 0.00 0.00 0.00 0.00 51.96 50.73 2kui s ALA 523 Cb -0.13 -1.09 -0.04 0.00 0.00 0.00 0.00 23.12 21.86 2kui s ALA 523 CO 0.03 -0.42 0.78 -1.12 0.00 0.00 0.00 175.76 175.02 2kui s SER 524 N 1.46 7.12 0.13 0.00 0.01 -1.25 -0.15 113.70 121.01 2kui s SER 524 Ca 0.04 1.34 0.10 0.00 1.31 0.00 0.00 55.95 58.75 2kui s SER 524 Cb -0.13 -2.46 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 2kui s SER 524 CO -0.11 -0.12 -0.24 0.68 0.41 0.00 0.00 173.24 173.86 2kui s VAL 525 N 0.68 2.07 -0.03 3.43 -7.23 0.47 -4.92 120.40 114.88 2kui s VAL 525 Ca 0.41 -1.72 -0.16 0.00 -1.81 0.00 0.00 61.98 58.70 2kui s VAL 525 Cb -0.19 -1.86 -0.05 0.00 0.56 0.00 0.00 36.38 34.83 2kui s VAL 525 CO 0.21 0.00 0.43 1.51 -0.31 0.00 0.00 175.10 176.95 2kui s ASP 526 N -2.10 6.79 0.33 4.85 1.47 -1.26 -0.73 116.67 126.03 2kui s ASP 526 Ca 0.12 0.94 -0.03 0.00 1.18 0.00 0.00 52.55 54.75 2kui s ASP 526 Cb -0.10 -2.27 0.01 0.00 -0.34 0.00 0.00 42.92 40.23 2kui s ASP 526 CO 0.06 0.23 0.50 -1.20 0.68 0.00 0.00 175.17 175.44 2kui n SER 527 N 2.33 -1.40 0.02 2.11 7.64 -0.93 -4.86 113.62 118.53 2kui n SER 527 Ca -0.12 -2.73 0.12 0.00 1.01 0.00 0.00 58.87 57.15 2kui n SER 527 Cb 0.52 2.55 0.32 0.00 -1.01 0.00 0.00 64.21 66.59 2kui n SER 527 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2kui n PRO 528 N -0.54 0.08 -2.16 1.43 -0.02 -1.26 -3.96 135.00 128.58 2kui n PRO 528 Ca -0.01 0.03 -0.42 0.00 -2.02 0.00 0.00 63.50 61.08 2kui n PRO 528 Cb 0.55 -1.56 -0.03 0.00 -0.02 0.00 0.00 33.50 32.44 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 -3.04 4.29 0.38 -0.52 0.52 -1.26 -4.73 118.95 114.59 2kui s ARG 529 Ca 0.11 2.07 -0.26 0.00 -0.52 0.00 0.00 55.73 57.12 2kui s ARG 529 Cb 0.17 -3.40 -0.11 0.00 0.52 0.00 0.00 34.95 32.12 2kui s ARG 529 CO 0.66 -0.52 1.24 -2.30 0.02 0.00 0.00 175.30 174.41 2kui n PRO 530 N 4.63 1.94 -1.69 3.54 -0.02 -1.26 -2.80 135.00 139.34 2kui n PRO 530 Ca 0.13 0.69 -0.42 0.00 -2.02 0.00 0.00 63.50 61.87 2kui n PRO 530 Cb 0.43 -2.31 -0.03 0.00 -0.02 0.00 0.00 33.50 31.57 2kui n PRO 530 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kui n ALA 531 N 0.01 2.28 0.00 3.55 0.00 -1.25 -2.44 120.51 122.66 2kui n ALA 531 Ca 0.06 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.83 2kui n ALA 531 Cb 0.38 -2.58 0.00 0.00 0.00 0.00 0.00 19.45 17.25 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 4.19 1.94 3.71 0.00 0.00 -1.16 -4.88 105.19 108.99 2kui n GLY 532 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2kui n GLY 532 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kui s GLU 533 N 0.00 4.50 -0.45 1.61 2.12 -1.02 -0.62 118.70 124.83 2kui s GLU 533 Ca 0.00 1.19 -0.29 0.00 0.36 0.00 0.00 54.97 56.23 2kui s GLU 533 Cb 0.00 -3.46 0.02 0.00 0.26 0.00 0.00 34.13 30.95 2kui s GLU 533 CO 0.00 -0.02 1.21 0.08 -0.54 0.00 0.00 175.26 175.99 2kui s VAL 534 N 1.00 4.13 0.14 3.70 1.01 0.35 -2.15 120.40 128.58 2kui s VAL 534 Ca 0.46 1.16 -0.02 0.00 0.00 0.00 0.00 61.98 63.58 2kui s VAL 534 Cb -0.19 -4.49 -0.17 0.00 0.00 0.00 0.00 36.38 31.53 2kui s VAL 534 CO 0.23 -0.92 1.33 0.74 0.00 0.00 0.00 175.10 176.48 2kui h THR 535 N 6.28 1.44 -2.31 3.92 2.02 -0.53 0.10 112.91 123.82 2kui h THR 535 Ca -0.24 -2.50 0.28 0.00 0.77 0.00 0.00 66.41 64.71 2kui h THR 535 Cb 1.07 2.43 -0.05 0.00 -1.74 0.00 0.00 68.15 69.86 2kui h THR 535 CO 1.11 0.74 0.79 -0.83 0.37 0.00 0.00 175.52 177.71 2kui s GLY 536 N -4.45 -0.02 0.11 2.16 0.00 -1.10 -4.76 107.32 99.27 2kui s GLY 536 Ca -0.05 -0.14 0.06 0.00 0.00 0.00 0.00 44.72 44.59 2kui s GLY 536 CO 0.85 4.74 -0.16 -0.51 0.00 0.00 0.00 173.10 178.02 2kui s THR 537 N -2.03 1.38 0.04 0.90 -4.23 -1.26 0.05 115.64 110.48 2kui s THR 537 Ca 0.27 -1.60 -0.30 0.00 -1.18 0.00 0.00 61.69 58.88 2kui s THR 537 Cb -0.02 -1.44 -0.18 0.00 1.34 0.00 0.00 72.50 72.21 2kui s THR 537 CO 0.02 -0.30 1.41 -1.13 -0.54 0.00 0.00 174.62 174.08 2kui h ASN 538 N 3.79 -0.74 -3.76 3.99 -0.73 -1.08 -3.41 115.58 113.63 2kui h ASN 538 Ca -0.41 -0.01 -0.50 0.00 1.87 0.00 0.00 56.30 57.24 2kui h ASN 538 Cb 1.19 0.19 0.01 0.00 0.27 0.00 0.00 38.32 39.98 2kui h ASN 538 CO 0.46 -0.44 0.45 -2.16 -0.37 0.00 0.00 177.43 175.37 2kui s PRO 539 N -5.42 4.67 0.36 6.67 0.04 -1.26 -5.02 135.00 135.05 2kui s PRO 539 Ca -0.16 1.74 -0.27 0.00 0.04 0.00 0.00 61.00 62.35 2kui s PRO 539 Cb 0.02 -3.22 -0.09 0.00 0.04 0.00 0.00 34.50 31.26 2kui s PRO 539 CO 0.55 0.25 1.16 -1.25 0.04 0.00 0.00 177.00 177.75 2kui s PRO 540 N -1.24 4.24 0.26 0.56 0.04 -1.26 -4.98 135.00 132.61 2kui s PRO 540 Ca 0.45 1.85 -0.30 0.00 0.04 0.00 0.00 61.00 63.03 2kui s PRO 540 Cb -0.31 -2.83 -0.10 0.00 0.04 0.00 0.00 34.50 31.30 2kui s PRO 540 CO 0.39 -0.16 1.44 0.00 0.04 0.00 0.00 177.00 178.71 2kui s ALA 541 N -1.34 3.63 0.00 8.56 0.00 -1.26 -2.39 121.76 128.95 2kui s ALA 541 Ca 0.53 1.34 0.00 0.00 0.00 0.00 0.00 51.96 53.83 2kui s ALA 541 Cb -0.31 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.25 2kui s ALA 541 CO 0.40 -0.75 0.00 0.41 0.00 0.00 0.00 175.76 175.81 2kui n GLY 542 N 2.11 2.75 3.72 0.00 0.00 0.21 -4.94 105.19 109.04 2kui n GLY 542 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2kui n GLY 542 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kui s THR 543 N -2.55 4.39 -0.18 2.61 2.01 -1.01 -4.69 115.64 116.22 2kui s THR 543 Ca 0.00 1.84 -0.27 0.00 0.31 0.00 0.00 61.69 63.56 2kui s THR 543 Cb 0.00 -4.17 -0.01 0.00 0.01 0.00 0.00 72.50 68.33 2kui s THR 543 CO 0.00 0.21 0.94 -0.89 -0.69 0.00 0.00 174.62 174.19 2kui s THR 544 N 0.53 4.79 0.11 -0.82 2.01 -1.26 -1.89 115.64 119.10 2kui s THR 544 Ca 0.52 1.86 0.02 0.00 0.31 0.00 0.00 61.69 64.40 2kui s THR 544 Cb -0.25 -4.24 -0.04 0.00 0.01 0.00 0.00 72.50 67.98 2kui s THR 544 CO 0.30 -0.06 -0.08 0.68 -0.69 0.00 0.00 174.62 174.78 2kui s VAL 545 N 2.52 0.80 0.28 3.82 -7.23 -0.67 -4.92 120.40 115.00 2kui s VAL 545 Ca 0.42 -1.92 -0.29 0.00 -1.81 0.00 0.00 61.98 58.38 2kui s VAL 545 Cb -0.16 -1.67 -0.10 0.00 0.56 0.00 0.00 36.38 35.01 2kui s VAL 545 CO 0.11 -0.82 1.34 -2.84 -0.31 0.00 0.00 175.10 172.58 2kui s PRO 546 N -3.70 4.35 0.63 4.82 0.02 -1.26 -0.63 135.00 139.23 2kui s PRO 546 Ca 0.12 2.19 0.42 0.00 0.02 0.00 0.00 61.00 63.75 2kui s PRO 546 Cb 0.04 -3.11 2.12 0.00 0.02 0.00 0.00 34.50 33.57 2kui s PRO 546 CO -0.03 -0.25 2.26 -0.39 -0.33 0.00 0.00 177.00 178.26 2kui h VAL 547 N 3.31 0.00 0.00 3.83 -1.51 -1.06 -1.09 116.25 119.73 2kui h VAL 547 Ca -0.47 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 64.85 2kui h VAL 547 Cb 1.22 1.15 0.00 0.00 -2.13 0.00 0.00 31.29 31.53 2kui h VAL 547 CO 0.71 0.00 -0.05 -0.67 -1.23 0.00 0.00 177.57 176.33 2kui n ASP 548 N -3.08 0.40 -4.74 4.19 2.03 -1.26 -1.89 116.55 112.20 2kui n ASP 548 Ca -0.02 0.48 -0.28 0.00 0.52 0.00 0.00 54.79 55.49 2kui n ASP 548 Cb 0.14 -0.56 0.11 0.00 -0.72 0.00 0.00 41.12 40.08 2kui n ASP 548 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2kui s SER 549 N -3.70 4.29 -0.26 1.67 0.15 -0.41 -4.63 113.70 110.80 2kui s SER 549 Ca 0.12 0.55 -0.12 0.00 0.70 0.00 0.00 55.95 57.21 2kui s SER 549 Cb 0.16 -0.98 -0.05 0.00 -1.71 0.00 0.00 66.02 63.44 2kui s SER 549 CO 0.57 -2.00 0.22 -0.69 1.20 0.00 0.00 173.24 172.54 2kui s VAL 550 N -3.55 5.30 -0.23 4.45 1.01 -1.26 -3.64 120.40 122.48 2kui s VAL 550 Ca 0.64 0.27 -0.09 0.00 0.00 0.00 0.00 61.98 62.80 2kui s VAL 550 Cb -0.09 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 2kui s VAL 550 CO 0.49 0.28 0.12 -0.63 0.00 0.00 0.00 175.10 175.35 2kui s ILE 551 N 1.49 4.92 -0.24 2.22 1.09 -0.04 -4.93 121.20 125.71 2kui s ILE 551 Ca 0.09 0.03 -0.09 0.00 -1.10 0.00 0.00 60.65 59.58 2kui s ILE 551 Cb -0.15 -3.29 -0.04 0.00 -1.06 0.00 0.00 42.46 37.92 2kui s ILE 551 CO 0.08 0.36 0.13 -0.70 -0.10 0.00 0.00 174.94 174.71 2kui s GLU 552 N 1.15 3.93 -0.27 2.79 2.12 -1.26 -1.20 118.70 125.97 2kui s GLU 552 Ca 0.06 -0.34 -0.12 0.00 0.36 0.00 0.00 54.97 54.92 2kui s GLU 552 Cb -0.14 -3.47 -0.05 0.00 0.26 0.00 0.00 34.13 30.74 2kui s GLU 552 CO 0.04 -0.02 0.26 -0.51 -0.54 0.00 0.00 175.26 174.49 2kui s LEU 553 N 1.24 4.05 -0.24 2.70 1.43 0.99 -0.36 118.68 128.48 2kui s LEU 553 Ca 0.06 0.14 -0.26 0.00 -1.03 0.00 0.00 54.13 53.04 2kui s LEU 553 Cb -0.14 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 43.84 2kui s LEU 553 CO 0.05 -0.08 0.91 -1.10 0.23 0.00 0.00 176.35 176.36 2kui s GLN 554 N 1.74 4.19 -0.14 1.70 1.11 0.11 -0.48 119.66 127.89 2kui s GLN 554 Ca 0.10 1.07 -0.01 0.00 0.01 0.00 0.00 55.36 56.53 2kui s GLN 554 Cb -0.16 -3.65 -0.02 0.00 -1.01 0.00 0.00 33.01 28.18 2kui s GLN 554 CO 0.10 -0.58 -0.11 0.08 0.01 0.00 0.00 175.29 174.79 2kui s VAL 555 N 3.00 3.22 0.32 1.09 1.01 0.78 0.24 120.40 130.06 2kui s VAL 555 Ca 0.38 -0.60 -0.21 0.00 0.00 0.00 0.00 61.98 61.55 2kui s VAL 555 Cb -0.15 -2.37 -0.10 0.00 0.00 0.00 0.00 36.38 33.76 2kui s VAL 555 CO 0.07 0.51 0.85 -0.94 0.00 0.00 0.00 175.10 175.60 2kui s SER 556 N 0.42 7.06 0.16 3.32 1.04 -0.92 -0.39 113.70 124.39 2kui s SER 556 Ca -0.09 1.59 -0.02 0.00 0.48 0.00 0.00 55.95 57.92 2kui s SER 556 Cb -0.15 -2.49 -0.05 0.00 0.10 0.00 0.00 66.02 63.43 2kui s SER 556 CO 0.05 -0.14 0.35 -1.59 0.98 0.00 0.00 173.24 172.88 2kui s LYS 557 N -2.49 3.53 0.09 4.02 -2.85 0.09 -3.00 119.74 119.14 2kui s LYS 557 Ca 0.52 -0.30 0.01 0.00 -1.00 0.00 0.00 55.97 55.19 2kui s LYS 557 Cb -0.14 -2.88 -0.25 0.00 -2.06 0.00 0.00 37.83 32.49 2kui s LYS 557 CO 0.19 0.46 1.19 0.78 0.10 0.00 0.00 175.35 178.07 2kui h GLY 558 N 2.42 0.18 -0.64 0.59 0.00 -1.69 -2.48 103.07 101.46 2kui h GLY 558 Ca -0.47 -0.45 -0.27 0.00 0.00 0.00 0.00 47.33 46.14 2kui h GLY 558 CO 0.71 0.39 -0.25 -2.01 0.00 0.00 0.00 176.54 175.38 2kui n ASN 559 N -3.45 -5.42 -3.92 0.19 5.15 -1.25 -4.07 115.26 102.48 2kui n ASN 559 Ca -0.05 0.33 -0.08 0.00 -0.60 0.00 0.00 54.58 54.17 2kui n ASN 559 Cb 0.99 -4.09 -0.08 0.00 -0.53 0.00 0.00 39.78 36.07 2kui n ASN 559 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2kui s GLN 560 N -3.07 0.74 -0.00 1.20 -0.21 -1.26 -0.16 119.66 116.90 2kui s GLN 560 Ca 0.00 -0.98 -0.05 0.00 0.02 0.00 0.00 55.36 54.35 2kui s GLN 560 Cb 0.00 0.29 -0.00 0.00 1.00 0.00 0.00 33.01 34.30 2kui s GLN 560 CO 0.00 -0.21 0.10 -0.59 -2.12 0.00 0.00 175.29 172.47 2kui s PHE 561 N -3.62 0.06 -0.28 0.91 -0.71 -0.12 -4.86 117.98 109.36 2kui s PHE 561 Ca 0.03 -0.16 -0.29 0.00 -1.04 0.00 0.00 56.93 55.48 2kui s PHE 561 Cb 0.04 -0.07 0.00 0.00 -1.21 0.00 0.00 43.02 41.79 2kui s PHE 561 CO -0.09 -0.24 1.27 0.08 -1.34 0.00 0.00 175.22 174.90 2kui s VAL 562 N -1.20 4.20 0.03 -2.49 1.01 -1.26 -0.05 120.40 120.64 2kui s VAL 562 Ca -0.13 1.38 -0.19 0.00 0.00 0.00 0.00 61.98 63.04 2kui s VAL 562 Cb -0.07 -4.15 -0.06 0.00 0.00 0.00 0.00 36.38 32.10 2kui s VAL 562 CO 0.01 -0.41 0.54 -0.32 0.00 0.00 0.00 175.10 174.92 2kui s MET 563 N 4.00 4.19 1.15 2.72 1.75 -0.64 -4.95 119.30 127.52 2kui s MET 563 Ca 0.55 0.67 -0.13 0.00 -1.25 0.00 0.00 55.69 55.52 2kui s MET 563 Cb -0.17 -3.27 0.27 0.00 2.84 0.00 0.00 34.83 34.50 2kui s MET 563 CO 0.21 0.56 1.04 -2.14 -0.65 0.00 0.00 175.02 174.03 2kui s PRO 564 N -0.78 -0.82 -0.35 4.11 0.02 -1.26 -0.52 135.00 135.40 2kui s PRO 564 Ca 0.28 0.67 -0.26 0.00 0.02 0.00 0.00 61.00 61.72 2kui s PRO 564 Cb -0.18 -1.58 0.01 0.00 0.02 0.00 0.00 34.50 32.77 2kui s PRO 564 CO 0.17 -3.61 0.91 0.34 -0.33 0.00 0.00 177.00 174.48 2kui s ASP 565 N -2.80 6.70 0.00 2.53 2.15 -1.26 -4.18 116.67 119.80 2kui s ASP 565 Ca 0.68 0.63 0.00 0.00 0.43 0.00 0.00 52.55 54.29 2kui s ASP 565 Cb -0.23 -2.46 0.00 0.00 -0.30 0.00 0.00 42.92 39.94 2kui s ASP 565 CO 0.63 -0.80 0.18 0.18 -0.17 0.00 0.00 175.17 175.19 2kui n LEU 566 N 6.64 0.37 -4.80 -1.34 4.32 -1.26 -5.07 117.00 115.87 2kui n LEU 566 Ca 0.07 -0.54 -0.35 0.00 -0.02 0.00 0.00 56.01 55.17 2kui n LEU 566 Cb 0.48 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.22 2kui n LEU 566 CO 0.56 0.09 0.66 -0.55 -1.22 0.00 0.00 177.39 176.93 2kui s SER 567 N -0.34 7.10 0.00 -1.43 0.15 -1.26 -3.46 113.70 114.47 2kui s SER 567 Ca 0.00 1.80 0.00 0.00 0.70 0.00 0.00 55.95 58.45 2kui s SER 567 Cb 0.00 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 2kui s SER 567 CO 0.00 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 174.81 2kui n GLY 568 N 0.04 0.74 4.02 9.45 0.00 -1.21 -5.05 105.19 113.19 2kui n GLY 568 Ca 0.04 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.87 2kui n GLY 568 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2kui s MET 569 N -0.56 2.36 0.61 1.61 1.00 -1.22 -4.76 119.30 118.34 2kui s MET 569 Ca 0.00 -1.63 -0.11 0.00 0.00 0.00 0.00 55.69 53.96 2kui s MET 569 Cb 0.00 -2.62 -0.04 0.00 0.00 0.00 0.00 34.83 32.17 2kui s MET 569 CO 0.00 -0.78 1.02 -0.06 0.00 0.00 0.00 175.02 175.20 2kui s PHE 570 N -2.64 3.61 0.47 -0.03 0.08 -1.26 -0.71 117.98 117.50 2kui s PHE 570 Ca 0.59 1.25 0.18 0.00 0.12 0.00 0.00 56.93 59.07 2kui s PHE 570 Cb -0.06 -2.71 1.19 0.00 -0.57 0.00 0.00 43.02 40.88 2kui s PHE 570 CO 0.37 -0.68 2.05 2.35 -0.10 0.00 0.00 175.22 179.22 2kui h TRP 571 N -0.30 0.00 0.00 0.36 7.01 -0.72 0.52 115.95 122.82 2kui h TRP 571 Ca -0.44 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.56 2kui h TRP 571 Cb 1.19 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.25 2kui h TRP 571 CO 0.65 0.13 0.00 1.33 -2.79 0.00 0.00 178.44 177.76 2kui n VAL 572 N -4.21 0.36 -0.10 2.65 0.24 -1.26 -1.29 118.33 114.72 2kui n VAL 572 Ca -0.02 0.09 -0.23 0.00 -2.04 0.00 0.00 64.34 62.14 2kui n VAL 572 Cb 0.20 -0.68 -0.12 0.00 -1.47 0.00 0.00 33.84 31.78 2kui n VAL 572 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2kui n ASP 573 N -1.50 1.99 -0.07 -1.34 8.00 -0.02 -4.49 116.55 119.10 2kui n ASP 573 Ca 0.06 0.17 -0.07 0.00 0.71 0.00 0.00 54.79 55.65 2kui n ASP 573 Cb 0.28 -0.72 -0.00 0.00 -0.02 0.00 0.00 41.12 40.65 2kui n ASP 573 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kui h ALA 574 N -0.34 0.29 0.08 2.24 0.00 -0.77 -2.45 119.26 118.30 2kui h ALA 574 Ca -0.54 0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.44 2kui h ALA 574 Cb 1.75 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 19.57 2kui h ALA 574 CO -0.16 -0.37 -0.52 0.93 0.00 0.00 0.00 179.25 179.13 2kui h GLU 575 N 0.15 -0.69 -0.75 0.00 4.39 -1.42 0.12 114.58 116.38 2kui h GLU 575 Ca 0.13 0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.86 2kui h GLU 575 Cb 0.14 0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.92 2kui h GLU 575 CO -0.18 -0.46 0.39 -1.35 -1.16 0.00 0.00 179.01 176.24 2kui h PRO 576 N -0.72 1.06 -0.83 2.33 0.11 -1.78 -2.63 132.00 129.55 2kui h PRO 576 Ca 0.01 -0.14 -0.01 0.00 0.11 0.00 0.00 66.00 65.96 2kui h PRO 576 Cb 0.74 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 31.61 2kui h PRO 576 CO -0.31 0.81 0.48 0.00 -0.21 0.00 0.00 178.00 178.77 2kui h ARG 577 N 1.05 1.15 -0.18 1.05 2.47 -1.01 0.14 114.38 119.05 2kui h ARG 577 Ca 0.26 -0.12 -0.03 0.00 -1.26 0.00 0.00 59.98 58.83 2kui h ARG 577 Cb 0.08 -0.23 -0.01 0.00 -1.65 0.00 0.00 29.97 28.16 2kui h ARG 577 CO -0.04 0.83 0.01 -0.07 0.56 0.00 0.00 179.97 181.27 2kui h LEU 578 N 1.15 0.30 -1.09 3.04 4.07 -0.67 -0.92 115.31 121.20 2kui h LEU 578 Ca 0.30 -0.29 -0.07 0.00 0.08 0.00 0.00 57.88 57.90 2kui h LEU 578 Cb -0.00 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 41.64 2kui h LEU 578 CO -0.05 0.52 -0.07 0.03 -1.08 0.00 0.00 178.44 177.78 2kui h ARG 579 N 0.08 0.56 -0.43 1.13 2.47 -1.19 0.19 114.38 117.19 2kui h ARG 579 Ca 0.05 -0.15 -0.12 0.00 -1.26 0.00 0.00 59.98 58.51 2kui h ARG 579 Cb 0.35 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.59 2kui h ARG 579 CO 0.01 0.64 -0.20 0.00 0.56 0.00 0.00 179.97 180.97 2kui h ALA 580 N 1.40 0.83 -0.03 0.04 0.00 -0.48 -2.44 119.26 118.59 2kui h ALA 580 Ca 0.10 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2kui h ALA 580 Cb 0.45 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2kui h ALA 580 CO 0.02 0.64 0.00 1.47 0.00 0.00 0.00 179.25 181.39 2kui n LEU 581 N -4.12 0.55 0.00 0.00 -0.00 -0.37 -4.88 117.00 108.17 2kui n LEU 581 Ca 0.00 -0.21 0.00 0.00 -0.00 0.00 0.00 56.01 55.81 2kui n LEU 581 Cb 0.43 -0.02 0.00 0.00 -0.00 0.00 0.00 43.42 43.83 2kui n LEU 581 CO 0.45 0.10 0.00 0.61 -0.00 0.00 0.00 177.39 178.55 2kui n GLY 582 N 0.98 0.68 3.70 1.47 0.00 -0.88 -5.02 105.19 106.11 2kui n GLY 582 Ca 0.18 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 45.06 2kui n GLY 582 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2kui s TRP 583 N -2.00 3.57 -0.35 1.61 -0.00 0.62 -4.98 118.94 117.41 2kui s TRP 583 Ca 0.00 1.57 0.01 0.00 -0.00 0.00 0.00 56.10 57.68 2kui s TRP 583 Cb 0.00 -3.11 0.14 0.00 -0.00 0.00 0.00 33.47 30.51 2kui s TRP 583 CO 0.00 -0.11 0.26 0.99 -0.00 0.00 0.00 176.95 178.09 2kui s THR 584 N 1.51 -0.05 0.00 5.86 2.01 -1.26 -4.46 115.64 119.25 2kui s THR 584 Ca 0.48 -1.38 0.00 0.00 0.31 0.00 0.00 61.69 61.09 2kui s THR 584 Cb -0.19 -0.95 0.00 0.00 0.01 0.00 0.00 72.50 71.37 2kui s THR 584 CO 0.21 -0.83 0.00 0.61 -0.69 0.00 0.00 174.62 173.93 2kui n GLY 585 N 4.21 5.06 3.06 4.40 0.00 -1.26 -5.05 105.19 115.61 2kui n GLY 585 Ca 0.10 -0.70 -0.27 0.00 0.00 0.00 0.00 46.02 45.16 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 4.37 2.02 -0.34 1.61 -2.45 -1.26 -5.08 119.30 118.17 2kui s MET 586 Ca 0.00 -0.51 -0.12 0.00 -1.25 0.00 0.00 55.69 53.80 2kui s MET 586 Cb 0.00 -1.66 -0.01 0.00 1.25 0.00 0.00 34.83 34.41 2kui s MET 586 CO 0.00 0.02 0.23 -1.17 1.05 0.00 0.00 175.02 175.15 2kui s LEU 587 N 0.73 4.48 -0.25 4.11 0.20 -1.26 -2.52 118.68 124.18 2kui s LEU 587 Ca -0.13 -0.48 0.02 0.00 0.69 0.00 0.00 54.13 54.23 2kui s LEU 587 Cb -0.16 -2.11 0.05 0.00 -0.43 0.00 0.00 46.19 43.54 2kui s LEU 587 CO 0.03 -0.24 -0.12 -0.62 -0.29 0.00 0.00 176.35 175.11 2kui s ASP 588 N 1.70 4.20 -0.39 3.68 2.15 -0.45 -5.03 116.67 122.52 2kui s ASP 588 Ca 0.06 -1.20 -0.23 0.00 0.43 0.00 0.00 52.55 51.60 2kui s ASP 588 Cb -0.17 -1.55 0.01 0.00 -0.30 0.00 0.00 42.92 40.91 2kui s ASP 588 CO 0.10 -0.15 0.78 -0.75 -0.17 0.00 0.00 175.17 174.97 2kui s LYS 589 N 1.16 3.63 0.00 4.34 2.36 -1.26 -1.66 119.74 128.31 2kui s LYS 589 Ca -0.05 0.15 0.00 0.00 -2.55 0.00 0.00 55.97 53.52 2kui s LYS 589 Cb -0.18 -3.86 0.00 0.00 -1.05 0.00 0.00 37.83 32.74 2kui s LYS 589 CO -0.06 -0.94 0.00 0.41 1.55 0.00 0.00 175.35 176.30 2kui n GLY 590 N 4.70 1.69 3.76 5.54 0.00 -1.03 -4.94 105.19 114.92 2kui n GLY 590 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 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 -3.99 3.06 0.15 4.61 0.00 -1.26 -5.02 121.76 119.30 2kui s ALA 591 Ca 0.00 1.16 0.09 0.00 0.00 0.00 0.00 51.96 53.22 2kui s ALA 591 Cb 0.00 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.60 2kui s ALA 591 CO 0.00 -0.91 -0.16 0.34 0.00 0.00 0.00 175.76 175.03 2kui s ASP 592 N -0.99 3.94 -0.10 0.00 -1.08 -1.26 -4.73 116.67 112.45 2kui s ASP 592 Ca 0.63 -0.62 -0.02 0.00 -0.52 0.00 0.00 52.55 52.02 2kui s ASP 592 Cb -0.36 -0.56 0.04 0.00 -1.46 0.00 0.00 42.92 40.59 2kui s ASP 592 CO 0.44 0.14 0.04 -0.69 0.52 0.00 0.00 175.17 175.63 2kui s VAL 593 N -1.41 0.18 -0.10 1.11 1.01 -1.26 -5.05 120.40 114.88 2kui s VAL 593 Ca 0.21 0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.92 2kui s VAL 593 Cb -0.10 -0.53 -0.02 0.00 0.00 0.00 0.00 36.38 35.74 2kui s VAL 593 CO 0.12 0.05 1.09 1.51 0.00 0.00 0.00 175.10 177.87 2kui s ASP 594 N 2.04 7.15 0.00 3.32 -4.77 -1.26 -0.67 116.67 122.48 2kui s ASP 594 Ca 0.03 1.62 0.00 0.00 -3.30 0.00 0.00 52.55 50.91 2kui s ASP 594 Cb -0.14 -2.55 0.00 0.00 -1.09 0.00 0.00 42.92 39.14 2kui s ASP 594 CO -0.06 -0.53 0.00 0.00 0.70 0.00 0.00 175.17 175.28 2kui n ALA 595 N 5.29 0.00 0.00 2.11 0.00 -1.26 -4.88 120.51 121.77 2kui n ALA 595 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2kui n ALA 595 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 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 0.94 0.33 0.00 0.00 -1.25 -4.99 105.19 100.24 2kui n GLY 596 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 0.16 1.29 -0.02 0.00 -0.87 -2.74 103.07 100.89 2kui h GLY 597 Ca 0.00 -0.05 0.07 0.00 0.00 0.00 0.00 47.33 47.35 2kui h GLY 597 CO 0.00 0.03 0.29 1.48 0.00 0.00 0.00 176.54 178.34 2kui h SER 598 N 0.12 0.00 0.00 0.19 4.64 -1.79 0.38 113.55 117.08 2kui h SER 598 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 2kui h SER 598 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2kui h SER 598 CO -0.02 0.00 -1.14 0.00 -0.87 0.00 0.00 176.83 174.80 2kui n GLN 599 N -3.64 0.75 -2.41 4.77 1.13 -1.03 -4.67 117.38 112.28 2kui n GLN 599 Ca 0.03 -0.04 -0.00 0.00 -1.94 0.00 0.00 57.00 55.04 2kui n GLN 599 Cb 0.42 -1.40 0.05 0.00 0.11 0.00 0.00 30.24 29.42 2kui n GLN 599 CO 0.00 0.00 0.00 -2.39 -1.44 0.00 0.00 177.06 173.23 2kui n HIS 600 N -1.63 0.30 -1.99 1.08 1.44 0.07 -5.04 115.22 109.45 2kui n HIS 600 Ca 0.02 -1.62 -0.26 0.00 -2.01 0.00 0.00 57.72 53.85 2kui n HIS 600 Cb 0.35 0.17 -0.05 0.00 0.12 0.00 0.00 29.99 30.57 2kui n HIS 600 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2kui s ASN 601 N -2.75 5.01 0.01 4.39 4.22 0.11 -4.51 114.94 121.42 2kui s ASN 601 Ca 0.23 -0.56 0.06 0.00 -2.14 0.00 0.00 52.86 50.45 2kui s ASN 601 Cb 0.34 -2.56 -0.03 0.00 1.28 0.00 0.00 41.25 40.28 2kui s ASN 601 CO -0.08 -2.86 -0.17 -0.60 -2.04 0.00 0.00 177.10 171.35 2kui s ARG 602 N 7.22 2.20 0.13 3.55 3.52 -1.26 0.04 118.95 134.35 2kui s ARG 602 Ca 0.72 -0.90 -0.31 0.00 -0.13 0.00 0.00 55.73 55.12 2kui s ARG 602 Cb -0.08 -2.24 -0.09 0.00 -1.56 0.00 0.00 34.95 30.99 2kui s ARG 602 CO 0.01 0.56 1.45 0.08 -0.81 0.00 0.00 175.30 176.59 2kui s VAL 603 N -0.86 3.07 -0.24 7.11 1.01 0.12 -4.02 120.40 126.59 2kui s VAL 603 Ca 0.14 0.77 -0.16 0.00 0.00 0.00 0.00 61.98 62.73 2kui s VAL 603 Cb -0.11 -3.49 -0.13 0.00 0.00 0.00 0.00 36.38 32.66 2kui s VAL 603 CO 0.04 0.06 -0.19 0.52 0.00 0.00 0.00 175.10 175.53 2kui n VAL 604 N 3.95 1.52 -3.92 2.92 0.31 0.24 -3.36 118.33 119.99 2kui n VAL 604 Ca 0.12 -0.18 -0.08 0.00 -0.01 0.00 0.00 64.34 64.19 2kui n VAL 604 Cb 0.41 -2.02 -0.08 0.00 -0.91 0.00 0.00 33.84 31.24 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 -2.50 0.25 -0.10 3.52 1.13 -1.26 -4.78 117.35 113.61 2kui s TYR 605 Ca -0.33 -0.72 -0.09 0.00 -1.41 0.00 0.00 57.07 54.53 2kui s TYR 605 Cb 0.10 -0.15 0.03 0.00 -1.10 0.00 0.00 41.96 40.84 2kui s TYR 605 CO 0.49 -0.50 0.26 1.14 -2.51 0.00 0.00 175.55 174.43 2kui s GLN 606 N -3.88 0.30 0.20 -3.49 -2.07 -1.26 -3.37 119.66 106.09 2kui s GLN 606 Ca 0.06 0.37 -0.11 0.00 -1.82 0.00 0.00 55.36 53.86 2kui s GLN 606 Cb 0.06 0.13 0.13 0.00 -1.09 0.00 0.00 33.01 32.23 2kui s GLN 606 CO -0.11 -0.04 1.83 -0.91 -1.32 0.00 0.00 175.29 174.74 2kui h ASN 607 N 5.84 0.84 -2.69 12.60 2.35 -1.73 -3.38 115.58 129.41 2kui h ASN 607 Ca -0.27 -0.07 -0.57 0.00 -0.55 0.00 0.00 56.30 54.85 2kui h ASN 607 Cb 1.19 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 39.31 2kui h ASN 607 CO 0.35 0.66 1.25 -2.84 -1.65 0.00 0.00 177.43 175.20 2kui s PRO 608 N -5.95 3.29 0.21 0.81 0.02 -1.26 -4.97 135.00 127.15 2kui s PRO 608 Ca -0.13 1.25 -0.30 0.00 0.02 0.00 0.00 61.00 61.84 2kui s PRO 608 Cb 0.14 -4.19 -0.09 0.00 0.02 0.00 0.00 34.50 30.38 2kui s PRO 608 CO 0.78 -1.91 1.26 -2.14 -0.33 0.00 0.00 177.00 174.66 2kui s PRO 609 N 5.70 4.43 0.22 5.54 0.02 -1.26 -4.97 135.00 144.69 2kui s PRO 609 Ca 0.75 1.99 -0.30 0.00 0.02 0.00 0.00 61.00 63.46 2kui s PRO 609 Cb -0.20 -3.20 -0.09 0.00 0.02 0.00 0.00 34.50 31.03 2kui s PRO 609 CO 0.32 -0.17 1.37 0.00 -0.33 0.00 0.00 177.00 178.19 2kui s ALA 610 N -0.08 3.57 0.00 -1.55 0.00 -1.26 -2.24 121.76 120.19 2kui s ALA 610 Ca 0.54 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.71 2kui s ALA 610 Cb -0.35 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.25 2kui s ALA 610 CO 0.39 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 175.93 2kui n GLY 611 N 2.27 1.11 3.70 0.00 0.00 0.32 -4.94 105.19 107.66 2kui n GLY 611 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 2kui n GLY 611 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kui s THR 612 N -3.17 3.44 -0.29 2.61 2.01 -0.95 -4.75 115.64 114.54 2kui s THR 612 Ca 0.00 -1.77 -0.29 0.00 0.31 0.00 0.00 61.69 59.94 2kui s THR 612 Cb 0.00 -2.97 -0.01 0.00 0.01 0.00 0.00 72.50 69.53 2kui s THR 612 CO 0.00 -0.31 1.54 -0.83 -0.69 0.00 0.00 174.62 174.33 2kui s GLY 613 N -3.76 1.16 -0.03 4.40 0.00 -1.26 -1.63 107.32 106.21 2kui s GLY 613 Ca 0.34 0.24 0.00 0.00 0.00 0.00 0.00 44.72 45.30 2kui s GLY 613 CO 0.22 2.92 -0.00 -1.34 0.00 0.00 0.00 173.10 174.89 2kui s VAL 614 N 5.34 4.17 0.16 1.40 -7.23 0.93 -4.76 120.40 120.41 2kui s VAL 614 Ca 0.68 -0.49 -0.32 0.00 -1.81 0.00 0.00 61.98 60.04 2kui s VAL 614 Cb -0.21 -2.82 -0.17 0.00 0.56 0.00 0.00 36.38 33.74 2kui s VAL 614 CO 0.29 0.46 0.81 -0.46 -0.31 0.00 0.00 175.10 175.89 2kui n ASN 615 N 1.66 -0.24 0.27 4.85 6.94 -1.26 -0.95 115.26 126.53 2kui n ASN 615 Ca -0.16 1.14 0.16 0.00 -0.02 0.00 0.00 54.58 55.71 2kui n ASN 615 Cb 0.53 -1.03 0.90 0.00 -2.36 0.00 0.00 39.78 37.83 2kui n ASN 615 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 2kui h ARG 616 N 1.98 0.00 -0.60 -3.83 1.12 -0.89 0.11 114.38 112.28 2kui h ARG 616 Ca -0.37 0.00 0.07 0.00 -1.11 0.00 0.00 59.98 58.57 2kui h ARG 616 Cb 1.41 0.00 -0.06 0.00 -0.01 0.00 0.00 29.97 31.31 2kui h ARG 616 CO 0.62 0.00 0.28 -0.44 -3.11 0.00 0.00 179.97 177.31 2kui h ASP 617 N 0.00 0.36 -0.40 -3.80 3.32 -1.88 -3.46 116.42 110.56 2kui h ASP 617 Ca 0.03 0.05 -0.17 0.00 0.02 0.00 0.00 57.03 56.96 2kui h ASP 617 Cb 0.19 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 39.66 2kui h ASP 617 CO -0.00 0.23 -0.16 0.61 -1.72 0.00 0.00 179.24 178.21 2kui n GLY 618 N -1.28 1.02 3.66 2.75 0.00 0.37 -4.70 105.19 107.02 2kui n GLY 618 Ca 0.07 -0.59 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.29 3.81 -0.20 -0.61 -1.16 -1.26 -4.72 121.20 114.76 2kui s ILE 619 Ca 0.00 0.98 -0.01 0.00 -0.51 0.00 0.00 60.65 61.10 2kui s ILE 619 Cb 0.00 -3.64 0.01 0.00 0.61 0.00 0.00 42.46 39.44 2kui s ILE 619 CO 0.00 -0.10 -0.12 -0.51 -2.81 0.00 0.00 174.94 171.41 2kui s ILE 620 N 3.92 2.73 -0.24 2.00 -1.16 -1.05 -4.65 121.20 122.74 2kui s ILE 620 Ca 0.67 -0.74 -0.08 0.00 -0.51 0.00 0.00 60.65 59.99 2kui s ILE 620 Cb -0.29 -2.21 -0.04 0.00 0.61 0.00 0.00 42.46 40.53 2kui s ILE 620 CO 0.25 0.46 0.10 0.42 -2.81 0.00 0.00 174.94 173.35 2kui s THR 621 N 1.38 4.61 0.15 4.00 -4.23 -1.26 -1.34 115.64 118.95 2kui s THR 621 Ca 0.05 -0.07 -0.00 0.00 -1.18 0.00 0.00 61.69 60.48 2kui s THR 621 Cb -0.14 -3.15 -0.04 0.00 1.34 0.00 0.00 72.50 70.51 2kui s THR 621 CO -0.08 0.34 0.04 -1.48 -0.54 0.00 0.00 174.62 172.90 2kui s LEU 622 N 1.44 1.85 -0.01 4.79 2.34 -0.66 -1.81 118.68 126.61 2kui s LEU 622 Ca 0.06 -1.21 0.02 0.00 0.06 0.00 0.00 54.13 53.06 2kui s LEU 622 Cb -0.15 0.19 0.00 0.00 -0.56 0.00 0.00 46.19 45.68 2kui s LEU 622 CO 0.05 -0.69 -0.06 -0.60 -1.06 0.00 0.00 176.35 173.99 2kui s ARG 623 N -4.01 0.63 0.05 1.48 3.52 -1.22 -2.45 118.95 116.95 2kui s ARG 623 Ca 0.25 -0.22 -0.03 0.00 -0.13 0.00 0.00 55.73 55.61 2kui s ARG 623 Cb 0.07 -0.62 -0.03 0.00 -1.56 0.00 0.00 34.95 32.81 2kui s ARG 623 CO 0.03 0.10 0.02 -0.59 -0.81 0.00 0.00 175.30 174.05 2kui s PHE 624 N 0.09 0.38 0.66 5.12 -0.12 -1.26 -0.59 117.98 122.26 2kui s PHE 624 Ca -0.01 -0.84 -0.17 0.00 -0.05 0.00 0.00 56.93 55.86 2kui s PHE 624 Cb -0.06 -0.28 -0.02 0.00 -0.63 0.00 0.00 43.02 42.04 2kui s PHE 624 CO -0.00 -0.37 1.06 0.41 -0.05 0.00 0.00 175.22 176.26 2kui n GLY 625 N 0.40 -0.11 0.37 1.99 0.00 -1.26 -4.50 105.19 102.08 2kui n GLY 625 Ca -0.16 -0.21 0.05 0.00 0.00 0.00 0.00 46.02 45.69 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14