#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 3.75 0.00 -0.61 1.10 -1.26 -4.98 121.20 119.20 2kui s ILE 356 Ca 0.00 0.63 0.00 0.00 -0.51 0.00 0.00 60.65 60.77 2kui s ILE 356 Cb 0.00 -4.41 0.00 0.00 0.15 0.00 0.00 42.46 38.20 2kui s ILE 356 CO 0.00 -1.16 0.00 0.35 -2.11 0.00 0.00 174.94 172.02 2kui n THR 357 N 6.87 0.00 1.17 4.00 -2.24 -1.26 -4.89 114.28 117.93 2kui n THR 357 Ca 0.13 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.97 2kui n THR 357 Cb 0.49 -1.01 0.38 0.00 -2.10 0.00 0.00 70.33 68.09 2kui n THR 357 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2kui n ARG 358 N 0.00 0.58 -2.16 -0.78 5.12 -1.26 -4.76 116.66 113.41 2kui n ARG 358 Ca 0.00 0.00 -0.35 0.00 -1.93 0.00 0.00 57.85 55.57 2kui n ARG 358 Cb 0.00 -1.34 0.01 0.00 -1.16 0.00 0.00 32.46 29.97 2kui n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2kui s ASP 359 N -1.82 5.61 0.26 0.55 1.01 -1.26 -4.90 116.67 116.13 2kui s ASP 359 Ca 0.19 2.12 0.11 0.00 0.71 0.00 0.00 52.55 55.68 2kui s ASP 359 Cb 0.09 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.40 2kui s ASP 359 CO 0.15 -1.29 -0.12 0.68 0.21 0.00 0.00 175.17 174.80 2kui s VAL 360 N -1.92 2.90 -0.08 -1.27 -7.23 0.31 -4.78 120.40 108.33 2kui s VAL 360 Ca 0.71 -2.12 -0.13 0.00 -1.81 0.00 0.00 61.98 58.62 2kui s VAL 360 Cb -0.23 -2.52 -0.05 0.00 0.56 0.00 0.00 36.38 34.15 2kui s VAL 360 CO 0.30 -0.34 0.32 -1.58 -0.31 0.00 0.00 175.10 173.49 2kui s GLN 361 N -3.45 3.96 -0.18 4.82 -0.44 -1.26 -0.32 119.66 122.79 2kui s GLN 361 Ca 0.29 0.20 -0.15 0.00 -2.50 0.00 0.00 55.36 53.21 2kui s GLN 361 Cb -0.06 -3.29 -0.04 0.00 -1.64 0.00 0.00 33.01 27.97 2kui s GLN 361 CO 0.16 0.53 0.34 0.08 0.50 0.00 0.00 175.29 176.90 2kui s VAL 362 N -0.46 5.26 -0.23 1.34 1.01 -0.50 -4.98 120.40 121.84 2kui s VAL 362 Ca 0.20 0.61 -0.29 0.00 0.00 0.00 0.00 61.98 62.50 2kui s VAL 362 Cb -0.14 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 2kui s VAL 362 CO 0.08 0.33 1.75 -2.84 0.00 0.00 0.00 175.10 174.42 2kui s PRO 363 N 0.85 3.62 -0.38 2.72 0.02 -1.26 -4.53 135.00 136.05 2kui s PRO 363 Ca 0.17 1.70 -0.13 0.00 0.02 0.00 0.00 61.00 62.76 2kui s PRO 363 Cb -0.14 -4.12 0.01 0.00 0.02 0.00 0.00 34.50 30.27 2kui s PRO 363 CO 0.06 -1.51 0.25 0.16 -0.33 0.00 0.00 177.00 175.63 2kui s ASP 364 N 5.18 5.97 -0.18 2.53 -4.77 -1.26 -4.96 116.67 119.18 2kui s ASP 364 Ca 0.78 -0.76 -0.00 0.00 -3.30 0.00 0.00 52.55 49.27 2kui s ASP 364 Cb -0.26 -2.11 0.14 0.00 -1.09 0.00 0.00 42.92 39.60 2kui s ASP 364 CO 0.32 -0.36 1.86 1.33 0.70 0.00 0.00 175.17 179.02 2kui n VAL 365 N 5.10 2.30 -2.03 2.11 0.24 -1.26 -4.93 118.33 119.86 2kui n VAL 365 Ca -0.12 -1.06 -0.37 0.00 -2.04 0.00 0.00 64.34 60.74 2kui n VAL 365 Cb 0.48 -1.29 0.02 0.00 -1.47 0.00 0.00 33.84 31.57 2kui n VAL 365 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2kui s ARG 366 N -1.07 3.41 0.00 7.34 3.03 -1.26 -3.45 118.95 126.96 2kui s ARG 366 Ca 0.18 1.98 0.00 0.00 2.03 0.00 0.00 55.73 59.92 2kui s ARG 366 Cb 0.14 -2.29 0.00 0.00 -1.03 0.00 0.00 34.95 31.77 2kui s ARG 366 CO 0.00 -0.90 0.00 0.41 -1.13 0.00 0.00 175.30 173.69 2kui n GLY 367 N 0.57 0.48 0.00 3.88 0.00 0.13 -5.00 105.19 105.25 2kui n GLY 367 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2kui n GLY 367 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kui n GLN 368 N -1.56 3.63 -3.22 1.61 6.02 -1.22 -4.90 117.38 117.73 2kui n GLN 368 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.80 2kui n GLN 368 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 2kui n GLN 368 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2kui s SER 369 N -0.08 5.81 0.16 1.08 1.04 -1.26 -1.37 113.70 119.07 2kui s SER 369 Ca 0.00 -0.22 -0.15 0.00 0.48 0.00 0.00 55.95 56.05 2kui s SER 369 Cb 0.00 -1.03 0.07 0.00 0.10 0.00 0.00 66.02 65.16 2kui s SER 369 CO 0.00 -0.61 1.78 0.77 0.98 0.00 0.00 173.24 176.16 2kui h SER 370 N 0.72 0.29 -0.49 7.02 4.64 -1.58 -0.38 113.55 123.76 2kui h SER 370 Ca -0.44 0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 60.83 2kui h SER 370 Cb 1.27 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 2kui h SER 370 CO 0.50 0.21 -0.01 0.00 -0.87 0.00 0.00 176.83 176.66 2kui h ALA 371 N 1.22 0.67 -0.31 5.18 0.00 -1.95 0.19 119.26 124.26 2kui h ALA 371 Ca 0.17 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 2kui h ALA 371 Cb 0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2kui h ALA 371 CO -0.12 0.48 -0.25 0.22 0.00 0.00 0.00 179.25 179.58 2kui h ASP 372 N 0.74 0.76 -0.15 0.00 1.82 -1.91 -0.47 116.42 117.19 2kui h ASP 372 Ca 0.14 -0.45 -0.02 0.00 -0.39 0.00 0.00 57.03 56.31 2kui h ASP 372 Cb 0.53 -0.21 -0.01 0.00 0.68 0.00 0.00 39.33 40.32 2kui h ASP 372 CO 0.03 1.05 0.01 0.00 -1.61 0.00 0.00 179.24 178.72 2kui h ALA 373 N 0.73 0.21 -0.83 -0.78 0.00 -0.89 -1.85 119.26 115.84 2kui h ALA 373 Ca 0.06 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2kui h ALA 373 Cb 0.81 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 2kui h ALA 373 CO 0.06 -0.11 0.37 0.82 0.00 0.00 0.00 179.25 180.40 2kui h ILE 374 N 0.02 1.26 -0.64 0.00 2.04 -0.62 -1.91 117.51 117.66 2kui h ILE 374 Ca 0.04 -0.78 0.02 0.00 1.00 0.00 0.00 64.86 65.15 2kui h ILE 374 Cb 0.34 0.23 -0.04 0.00 -0.74 0.00 0.00 36.82 36.61 2kui h ILE 374 CO 0.01 0.33 0.40 0.00 0.00 0.00 0.00 178.15 178.89 2kui h ALA 375 N 1.20 0.82 -0.22 1.87 0.00 -0.87 0.18 119.26 122.25 2kui h ALA 375 Ca 0.28 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2kui h ALA 375 Cb 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2kui h ALA 375 CO -0.03 0.17 0.07 1.15 0.00 0.00 0.00 179.25 180.62 2kui h THR 376 N 0.80 1.18 -0.73 0.00 2.02 -1.02 -1.11 112.91 114.04 2kui h THR 376 Ca 0.25 -0.56 -0.02 0.00 0.77 0.00 0.00 66.41 66.85 2kui h THR 376 Cb -0.02 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 2kui h THR 376 CO -0.09 0.18 0.38 -0.07 0.37 0.00 0.00 175.52 176.30 2kui h LEU 377 N 0.18 0.93 -0.68 2.58 3.38 -0.85 -2.06 115.31 118.80 2kui h LEU 377 Ca 0.07 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 2kui h LEU 377 Cb 0.21 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2kui h LEU 377 CO -0.00 0.78 0.23 -0.61 0.09 0.00 0.00 178.44 178.92 2kui h GLN 378 N 1.01 1.04 0.00 1.13 5.75 -0.46 0.16 115.11 123.74 2kui h GLN 378 Ca 0.25 -0.22 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 2kui h GLN 378 Cb 0.07 -0.16 -0.00 0.00 1.07 0.00 0.00 27.48 28.46 2kui h GLN 378 CO -0.04 0.90 -0.11 -0.91 -2.65 0.00 0.00 178.83 176.02 2kui h ASN 379 N 0.98 0.00 0.35 -0.69 2.35 -0.72 -1.61 115.58 116.24 2kui h ASN 379 Ca 0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2kui h ASN 379 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 2kui h ASN 379 CO -0.01 0.11 -0.41 0.54 -1.65 0.00 0.00 177.43 176.01 2kui n ARG 380 N -3.99 0.40 -0.24 0.81 5.12 -0.60 -4.93 116.66 113.23 2kui n ARG 380 Ca -0.02 -0.24 0.00 0.00 -1.93 0.00 0.00 57.85 55.66 2kui n ARG 380 Cb 0.20 -1.50 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 1.43 0.83 3.79 -0.13 0.00 -0.55 -4.60 105.19 105.95 2kui n GLY 381 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.10 3.64 0.09 1.61 0.40 0.45 -4.21 117.98 117.87 2kui s PHE 382 Ca 0.00 1.75 -0.13 0.00 -0.60 0.00 0.00 56.93 57.95 2kui s PHE 382 Cb 0.00 -2.91 -0.06 0.00 0.51 0.00 0.00 43.02 40.56 2kui s PHE 382 CO 0.00 0.17 0.47 0.15 0.70 0.00 0.00 175.22 176.71 2kui s LYS 383 N -2.20 3.92 0.15 0.44 -0.14 0.71 -4.01 119.74 118.61 2kui s LYS 383 Ca 0.52 0.40 0.08 0.00 -1.36 0.00 0.00 55.97 55.60 2kui s LYS 383 Cb -0.17 -3.05 -0.04 0.00 -1.68 0.00 0.00 37.83 32.89 2kui s LYS 383 CO 0.22 0.57 -0.18 0.96 -0.76 0.00 0.00 175.35 176.16 2kui s ILE 384 N -1.32 1.72 -0.02 2.17 -0.00 -1.26 -0.13 121.20 122.36 2kui s ILE 384 Ca 0.32 -1.86 0.01 0.00 -0.00 0.00 0.00 60.65 59.13 2kui s ILE 384 Cb -0.15 -1.77 0.01 0.00 -0.00 0.00 0.00 42.46 40.55 2kui s ILE 384 CO 0.17 -0.32 -0.03 -0.60 -0.00 0.00 0.00 174.94 174.16 2kui s ARG 385 N -2.71 0.45 -0.26 0.37 3.52 -0.15 -4.88 118.95 115.29 2kui s ARG 385 Ca 0.14 -0.09 -0.09 0.00 -0.13 0.00 0.00 55.73 55.56 2kui s ARG 385 Cb -0.06 -0.49 -0.04 0.00 -1.56 0.00 0.00 34.95 32.80 2kui s ARG 385 CO 0.06 0.00 0.13 0.99 -0.81 0.00 0.00 175.30 175.66 2kui s THR 386 N 0.40 4.82 -0.23 4.11 2.01 -1.26 0.37 115.64 125.86 2kui s THR 386 Ca -0.04 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 61.92 2kui s THR 386 Cb -0.08 -3.27 -0.01 0.00 0.01 0.00 0.00 72.50 69.16 2kui s THR 386 CO -0.00 0.31 -0.03 -0.22 -0.69 0.00 0.00 174.62 173.98 2kui s LEU 387 N 1.57 2.98 -0.17 4.42 1.98 0.77 -4.93 118.68 125.30 2kui s LEU 387 Ca 0.06 -0.40 -0.08 0.00 -2.89 0.00 0.00 54.13 50.83 2kui s LEU 387 Cb -0.15 -1.75 -0.04 0.00 0.66 0.00 0.00 46.19 44.90 2kui s LEU 387 CO 0.07 -0.03 0.08 0.00 -1.89 0.00 0.00 176.35 174.58 2kui s GLN 388 N 1.49 3.90 0.08 1.98 0.00 -1.26 -1.01 119.66 124.84 2kui s GLN 388 Ca 0.06 -0.29 0.06 0.00 -0.00 0.00 0.00 55.36 55.18 2kui s GLN 388 Cb -0.14 -3.23 -0.03 0.00 0.00 0.00 0.00 33.01 29.60 2kui s GLN 388 CO -0.03 0.37 -0.16 0.15 0.00 0.00 0.00 175.29 175.62 2kui s LYS 389 N 0.11 0.92 0.89 9.60 1.02 0.37 -4.97 119.74 127.68 2kui s LYS 389 Ca 0.06 -1.04 -0.12 0.00 0.02 0.00 0.00 55.97 54.90 2kui s LYS 389 Cb -0.12 -1.00 0.12 0.00 -0.52 0.00 0.00 37.83 36.32 2kui s LYS 389 CO 0.00 0.22 1.10 -2.14 -0.92 0.00 0.00 175.35 173.61 2kui s PRO 390 N -1.86 1.34 -1.05 -1.68 0.02 -1.26 -0.03 135.00 130.48 2kui s PRO 390 Ca 0.01 0.66 -0.23 0.00 0.02 0.00 0.00 61.00 61.46 2kui s PRO 390 Cb -0.10 -1.83 0.01 0.00 0.02 0.00 0.00 34.50 32.61 2kui s PRO 390 CO 0.03 -2.15 1.67 -0.51 -0.33 0.00 0.00 177.00 175.72 2kui s ASP 391 N -3.63 6.06 -0.48 2.53 1.11 0.57 -4.61 116.67 118.23 2kui s ASP 391 Ca 0.63 -1.44 0.03 0.00 0.18 0.00 0.00 52.55 51.96 2kui s ASP 391 Cb -0.17 -2.57 0.44 0.00 1.07 0.00 0.00 42.92 41.69 2kui s ASP 391 CO 0.56 -1.92 1.50 -1.20 1.18 0.00 0.00 175.17 175.28 2kui n SER 392 N 10.66 5.94 -1.07 0.27 7.64 -1.26 -3.73 113.62 132.07 2kui n SER 392 Ca 0.39 -3.77 -0.10 0.00 1.01 0.00 0.00 58.87 56.41 2kui n SER 392 Cb 0.49 -0.61 -0.01 0.00 -1.01 0.00 0.00 64.21 63.07 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 -0.72 -0.42 -4.32 0.44 -1.04 -1.26 -5.03 114.28 101.93 2kui n THR 393 Ca 0.50 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 62.22 2kui n THR 393 Cb 0.76 -1.61 -0.11 0.00 -1.82 0.00 0.00 70.33 67.55 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 -2.47 2.84 -0.11 12.58 -4.36 -1.26 -5.03 121.20 123.38 2kui s ILE 394 Ca 0.00 -1.60 -0.10 0.00 -0.26 0.00 0.00 60.65 58.70 2kui s ILE 394 Cb 0.00 -2.33 -0.04 0.00 1.25 0.00 0.00 42.46 41.34 2kui s ILE 394 CO 0.00 0.04 0.47 -2.65 0.24 0.00 0.00 174.94 173.03 2kui n PRO 395 N 0.60 0.00 -1.15 0.37 -0.02 -1.26 -4.55 135.00 128.99 2kui n PRO 395 Ca -0.14 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.03 2kui n PRO 395 Cb 0.53 -0.33 0.12 0.00 -0.02 0.00 0.00 33.50 33.80 2kui n PRO 395 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2kui s PRO 396 N 1.28 1.62 0.26 0.52 0.02 -1.26 -1.56 135.00 135.87 2kui s PRO 396 Ca 0.26 1.06 0.15 0.00 0.02 0.00 0.00 61.00 62.50 2kui s PRO 396 Cb -0.33 -1.83 0.82 0.00 0.02 0.00 0.00 34.50 33.17 2kui s PRO 396 CO 0.15 -2.06 1.42 -0.40 -0.33 0.00 0.00 177.00 175.78 2kui n ASP 397 N -3.79 0.39 -4.58 2.53 5.68 -1.26 -4.20 116.55 111.32 2kui n ASP 397 Ca 0.08 0.64 -0.43 0.00 -0.50 0.00 0.00 54.79 54.59 2kui n ASP 397 Cb 0.54 -0.66 -0.04 0.00 -1.14 0.00 0.00 41.12 39.82 2kui n ASP 397 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 2kui s HIS 398 N -3.35 2.94 -0.05 2.11 3.76 -1.26 -1.38 115.29 118.05 2kui s HIS 398 Ca -0.02 0.53 -0.30 0.00 -0.15 0.00 0.00 55.06 55.13 2kui s HIS 398 Cb 0.04 -3.97 -0.07 0.00 1.11 0.00 0.00 32.58 29.69 2kui s HIS 398 CO 0.14 -1.07 1.88 0.14 -0.85 0.00 0.00 174.74 174.98 2kui s VAL 399 N 3.81 3.24 -0.12 -0.90 -7.23 -0.47 -4.83 120.40 113.88 2kui s VAL 399 Ca 0.39 0.28 0.13 0.00 -1.81 0.00 0.00 61.98 60.97 2kui s VAL 399 Cb -0.10 -3.21 -0.18 0.00 0.56 0.00 0.00 36.38 33.45 2kui s VAL 399 CO 0.25 -0.05 0.09 0.00 -0.31 0.00 0.00 175.10 175.08 2kui n ILE 400 N 5.94 0.83 -4.03 -0.62 0.00 -1.26 0.20 119.36 120.42 2kui n ILE 400 Ca 0.20 -0.56 -0.10 0.00 0.00 0.00 0.00 62.75 62.29 2kui n ILE 400 Cb 0.43 -0.51 -0.08 0.00 0.00 0.00 0.00 39.64 39.47 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 -4.60 0.68 0.48 4.50 0.00 -1.26 -4.72 107.32 102.40 2kui s GLY 401 Ca -0.07 -1.11 0.01 0.00 0.00 0.00 0.00 44.72 43.55 2kui s GLY 401 CO 0.59 -1.03 0.07 -1.30 0.00 0.00 0.00 173.10 171.43 2kui n THR 402 N -0.18 0.00 -4.04 0.90 -2.24 -1.26 -4.95 114.28 102.52 2kui n THR 402 Ca -0.06 -2.17 -0.36 0.00 -2.27 0.00 0.00 64.05 59.19 2kui n THR 402 Cb 0.63 0.34 -0.07 0.00 -2.10 0.00 0.00 70.33 69.14 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 -3.65 6.00 0.60 3.42 -1.08 -1.26 -5.00 116.67 115.70 2kui s ASP 403 Ca 0.05 0.35 0.30 0.00 -0.52 0.00 0.00 52.55 52.74 2kui s ASP 403 Cb -0.00 -1.86 1.67 0.00 -1.46 0.00 0.00 42.92 41.26 2kui s ASP 403 CO 0.03 0.39 2.06 1.55 0.52 0.00 0.00 175.17 179.72 2kui h PRO 404 N 4.96 0.00 -0.43 4.34 0.13 -1.99 -2.04 132.00 136.97 2kui h PRO 404 Ca -0.53 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.57 2kui h PRO 404 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 2kui h PRO 404 CO 0.57 0.00 0.15 0.00 -0.23 0.00 0.00 178.00 178.49 2kui h ALA 405 N 1.67 1.45 0.07 -0.56 0.00 -1.91 -1.28 119.26 118.71 2kui h ALA 405 Ca 0.09 -0.14 -0.25 0.00 0.00 0.00 0.00 54.91 54.61 2kui h ALA 405 Cb 0.60 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.22 2kui h ALA 405 CO -0.00 0.41 -1.11 0.00 0.00 0.00 0.00 179.25 178.55 2kui h ALA 406 N 1.55 0.21 0.00 0.00 0.00 -1.71 -3.24 119.26 116.07 2kui h ALA 406 Ca 0.15 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2kui h ALA 406 Cb 0.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2kui h ALA 406 CO -0.01 0.87 -0.11 0.09 0.00 0.00 0.00 179.25 180.09 2kui n ASN 407 N -3.65 0.23 -4.89 0.00 5.03 -0.93 -1.41 115.26 109.64 2kui n ASN 407 Ca -0.08 0.37 -0.21 0.00 0.87 0.00 0.00 54.58 55.52 2kui n ASN 407 Cb 0.93 -0.39 -0.03 0.00 -1.02 0.00 0.00 39.78 39.27 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 -3.02 4.74 -0.36 3.41 2.01 -0.53 -4.84 115.64 117.05 2kui s THR 408 Ca 0.13 -1.23 -0.29 0.00 0.31 0.00 0.00 61.69 60.61 2kui s THR 408 Cb 0.18 -3.58 0.01 0.00 0.01 0.00 0.00 72.50 69.11 2kui s THR 408 CO 0.58 -0.33 1.28 -0.94 -0.69 0.00 0.00 174.62 174.52 2kui s SER 409 N -3.91 6.60 0.25 3.53 1.04 -1.26 -4.05 113.70 115.90 2kui s SER 409 Ca 0.34 0.97 0.03 0.00 0.48 0.00 0.00 55.95 57.77 2kui s SER 409 Cb -0.08 -2.54 -0.05 0.00 0.10 0.00 0.00 66.02 63.44 2kui s SER 409 CO 0.27 -1.19 0.02 0.68 0.98 0.00 0.00 173.24 174.00 2kui s VAL 410 N 4.61 1.03 0.30 5.02 -7.23 0.56 -4.76 120.40 119.93 2kui s VAL 410 Ca 0.55 -2.03 -0.29 0.00 -1.81 0.00 0.00 61.98 58.40 2kui s VAL 410 Cb -0.14 -2.46 -0.10 0.00 0.56 0.00 0.00 36.38 34.24 2kui s VAL 410 CO 0.26 -0.23 1.23 -0.44 -0.31 0.00 0.00 175.10 175.61 2kui s SER 411 N -3.34 6.98 -0.25 4.85 0.01 -1.26 -0.53 113.70 120.15 2kui s SER 411 Ca 0.31 2.50 -0.28 0.00 1.31 0.00 0.00 55.95 59.79 2kui s SER 411 Cb 0.06 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 2kui s SER 411 CO 0.11 -0.38 2.14 0.00 0.41 0.00 0.00 173.24 175.52 2kui s ALA 412 N -1.02 2.73 0.00 1.44 0.00 -1.26 -3.48 121.76 120.16 2kui s ALA 412 Ca 0.48 0.66 0.00 0.00 0.00 0.00 0.00 51.96 53.10 2kui s ALA 412 Cb -0.36 -4.07 0.00 0.00 0.00 0.00 0.00 23.12 18.69 2kui s ALA 412 CO 0.47 -2.81 0.00 0.41 0.00 0.00 0.00 175.76 173.83 2kui n GLY 413 N 5.71 0.63 0.68 0.00 0.00 -1.26 -4.90 105.19 106.05 2kui n GLY 413 Ca 0.29 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.27 2kui n GLY 413 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kui n ASP 414 N 0.00 0.32 -4.37 1.61 -0.08 -1.23 -4.64 116.55 108.17 2kui n ASP 414 Ca 0.00 -1.25 -0.34 0.00 -1.51 0.00 0.00 54.79 51.69 2kui n ASP 414 Cb 0.00 -0.09 -0.14 0.00 2.34 0.00 0.00 41.12 43.24 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 -2.60 3.44 -0.20 -0.67 2.02 -1.26 -0.21 118.70 119.22 2kui s GLU 415 Ca 0.11 -0.62 0.01 0.00 0.02 0.00 0.00 54.97 54.49 2kui s GLU 415 Cb -0.01 -2.89 0.03 0.00 0.10 0.00 0.00 34.13 31.36 2kui s GLU 415 CO 0.07 0.01 -0.16 0.42 0.02 0.00 0.00 175.26 175.61 2kui s ILE 416 N 0.94 2.21 -0.08 -1.63 -1.09 0.81 -4.92 121.20 117.43 2kui s ILE 416 Ca -0.01 -1.07 -0.20 0.00 -2.23 0.00 0.00 60.65 57.14 2kui s ILE 416 Cb -0.15 -2.02 -0.04 0.00 -1.58 0.00 0.00 42.46 38.67 2kui s ILE 416 CO 0.00 0.39 0.56 0.28 -1.23 0.00 0.00 174.94 174.95 2kui s THR 417 N 1.26 5.10 -0.13 2.92 -1.32 -1.26 -0.98 115.64 121.24 2kui s THR 417 Ca 0.02 1.14 -0.04 0.00 -1.21 0.00 0.00 61.69 61.59 2kui s THR 417 Cb -0.15 -3.90 -0.04 0.00 -1.51 0.00 0.00 72.50 66.91 2kui s THR 417 CO -0.10 0.32 0.03 0.54 -2.21 0.00 0.00 174.62 173.21 2kui s VAL 418 N 0.50 4.57 -0.17 5.08 0.11 0.16 -4.73 120.40 125.92 2kui s VAL 418 Ca 0.30 -0.13 -0.15 0.00 -2.93 0.00 0.00 61.98 59.07 2kui s VAL 418 Cb -0.16 -2.99 -0.04 0.00 -1.53 0.00 0.00 36.38 31.66 2kui s VAL 418 CO 0.14 0.55 0.34 0.20 -3.33 0.00 0.00 175.10 173.00 2kui s ASN 419 N -0.37 6.44 -0.06 3.54 0.02 -1.26 -0.16 114.94 123.09 2kui s ASN 419 Ca 0.08 0.52 0.03 0.00 -1.02 0.00 0.00 52.86 52.47 2kui s ASN 419 Cb -0.12 -2.20 0.01 0.00 0.02 0.00 0.00 41.25 38.95 2kui s ASN 419 CO 0.02 0.03 -0.13 0.54 0.02 0.00 0.00 177.10 177.57 2kui s VAL 420 N 0.80 1.21 -0.23 1.60 0.11 -0.18 -4.25 120.40 119.45 2kui s VAL 420 Ca 0.18 -0.54 -0.16 0.00 -2.93 0.00 0.00 61.98 58.53 2kui s VAL 420 Cb -0.14 -1.09 -0.04 0.00 -1.53 0.00 0.00 36.38 33.59 2kui s VAL 420 CO 0.06 0.37 0.40 -0.94 -3.33 0.00 0.00 175.10 171.65 2kui s SER 421 N 0.50 6.36 -0.29 3.54 1.04 -0.60 -0.48 113.70 123.77 2kui s SER 421 Ca -0.12 0.43 0.03 0.00 0.48 0.00 0.00 55.95 56.76 2kui s SER 421 Cb -0.15 -2.23 0.07 0.00 0.10 0.00 0.00 66.02 63.82 2kui s SER 421 CO 0.04 -0.14 -0.04 0.28 0.98 0.00 0.00 173.24 174.36 2kui s THR 422 N 1.69 2.32 0.04 2.02 -1.32 0.96 -4.63 115.64 116.73 2kui s THR 422 Ca 0.18 -1.84 0.00 0.00 -1.21 0.00 0.00 61.69 58.81 2kui s THR 422 Cb -0.15 -2.48 0.00 0.00 -1.51 0.00 0.00 72.50 68.36 2kui s THR 422 CO 0.09 -0.23 0.00 0.61 -2.21 0.00 0.00 174.62 172.87 2kui n GLY 423 N 4.40 -3.78 3.73 6.08 0.00 -1.26 -4.28 105.19 110.08 2kui n GLY 423 Ca -0.08 -0.78 -0.33 0.00 0.00 0.00 0.00 46.02 44.83 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 -3.11 2.20 0.51 1.61 0.02 -1.26 -0.31 135.00 134.65 2kui s PRO 424 Ca 0.00 1.60 -0.20 0.00 0.02 0.00 0.00 61.00 62.42 2kui s PRO 424 Cb 0.00 -1.86 -0.07 0.00 0.02 0.00 0.00 34.50 32.59 2kui s PRO 424 CO 0.00 -1.76 1.08 -1.21 -0.33 0.00 0.00 177.00 174.78 2kui s GLU 425 N -4.11 3.59 0.08 5.54 2.02 -1.24 -4.76 118.70 119.82 2kui s GLU 425 Ca 0.71 1.46 -0.20 0.00 0.02 0.00 0.00 54.97 56.95 2kui s GLU 425 Cb -0.25 -2.05 -0.07 0.00 0.10 0.00 0.00 34.13 31.86 2kui s GLU 425 CO 0.46 -0.62 0.61 -1.14 0.02 0.00 0.00 175.26 174.59 2kui s GLN 426 N -3.29 4.27 -0.01 1.61 2.00 -1.26 -4.67 119.66 118.32 2kui s GLN 426 Ca 0.69 0.81 0.07 0.00 -2.00 0.00 0.00 55.36 54.94 2kui s GLN 426 Cb -0.19 -3.25 -0.02 0.00 0.80 0.00 0.00 33.01 30.34 2kui s GLN 426 CO 0.24 0.60 -0.23 1.03 -0.50 0.00 0.00 175.29 176.42 2kui s ARG 427 N -1.02 1.82 0.15 1.67 1.81 -1.06 -4.97 118.95 117.35 2kui s ARG 427 Ca 0.30 -0.86 -0.26 0.00 -1.72 0.00 0.00 55.73 53.19 2kui s ARG 427 Cb -0.20 -1.80 -0.08 0.00 -0.45 0.00 0.00 34.95 32.43 2kui s ARG 427 CO 0.20 0.49 0.79 -1.83 -0.68 0.00 0.00 175.30 174.27 2kui s GLU 428 N -0.67 4.58 -0.38 3.54 -1.05 -1.26 -0.19 118.70 123.27 2kui s GLU 428 Ca 0.09 1.18 -0.15 0.00 -0.15 0.00 0.00 54.97 55.94 2kui s GLU 428 Cb -0.09 -3.28 0.00 0.00 -0.44 0.00 0.00 34.13 30.32 2kui s GLU 428 CO -0.00 0.52 0.34 0.42 0.95 0.00 0.00 175.26 177.48 2kui s ILE 429 N -0.96 5.20 0.31 1.83 1.01 0.74 -4.90 121.20 124.43 2kui s ILE 429 Ca 0.37 -0.29 -0.28 0.00 0.00 0.00 0.00 60.65 60.44 2kui s ILE 429 Cb -0.23 -3.88 -0.09 0.00 0.01 0.00 0.00 42.46 38.26 2kui s ILE 429 CO 0.26 -0.21 1.13 -2.84 0.00 0.00 0.00 174.94 173.28 2kui s PRO 430 N 1.89 4.49 0.01 2.79 0.02 -1.26 -3.51 135.00 139.44 2kui s PRO 430 Ca 0.09 1.83 -0.25 0.00 0.02 0.00 0.00 61.00 62.68 2kui s PRO 430 Cb -0.17 -3.05 -0.05 0.00 0.02 0.00 0.00 34.50 31.25 2kui s PRO 430 CO 0.11 0.07 0.78 0.16 -0.33 0.00 0.00 177.00 177.80 2kui s ASP 431 N -0.93 7.18 0.11 2.53 -4.77 -0.81 -4.89 116.67 115.09 2kui s ASP 431 Ca 0.48 1.42 0.04 0.00 -3.30 0.00 0.00 52.55 51.18 2kui s ASP 431 Cb -0.32 -2.47 -0.04 0.00 -1.09 0.00 0.00 42.92 39.00 2kui s ASP 431 CO 0.41 -0.06 0.09 -0.69 0.70 0.00 0.00 175.17 175.62 2kui s VAL 432 N 0.32 4.49 0.39 2.11 1.01 -1.26 -5.06 120.40 122.39 2kui s VAL 432 Ca 0.40 -0.88 -0.27 0.00 0.00 0.00 0.00 61.98 61.23 2kui s VAL 432 Cb -0.20 -3.21 -0.11 0.00 0.00 0.00 0.00 36.38 32.86 2kui s VAL 432 CO 0.23 0.04 1.33 -1.20 0.00 0.00 0.00 175.10 175.50 2kui n SER 433 N 0.19 2.89 0.25 3.32 7.64 -1.26 -4.88 113.62 121.76 2kui n SER 433 Ca -0.09 1.17 0.10 0.00 1.01 0.00 0.00 58.87 61.06 2kui n SER 433 Cb 0.53 -1.52 0.65 0.00 -1.01 0.00 0.00 64.21 62.86 2kui n SER 433 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2kui h THR 434 N 2.41 0.77 0.00 0.44 1.35 -1.98 0.03 112.91 115.94 2kui h THR 434 Ca -0.48 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 2kui h THR 434 Cb 1.28 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 2kui h THR 434 CO 0.62 0.14 -0.23 0.17 -0.25 0.00 0.00 175.52 175.96 2kui h LEU 435 N 0.00 0.00 -3.84 3.87 8.10 -1.90 0.10 115.31 121.64 2kui h LEU 435 Ca -0.00 -0.06 -0.57 0.00 0.11 0.00 0.00 57.88 57.36 2kui h LEU 435 Cb 0.32 0.00 -0.24 0.00 -0.44 0.00 0.00 40.66 40.30 2kui h LEU 435 CO 0.02 0.03 0.74 0.41 -4.11 0.00 0.00 178.44 175.53 2kui n THR 436 N -2.36 3.38 -0.33 0.15 -1.04 -0.00 -4.65 114.28 109.42 2kui n THR 436 Ca 0.04 -2.55 0.13 0.00 -2.04 0.00 0.00 64.05 59.64 2kui n THR 436 Cb 0.45 -1.21 0.35 0.00 -1.82 0.00 0.00 70.33 68.10 2kui n THR 436 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 2kui h TYR 437 N 1.85 0.96 -0.78 -1.42 3.20 -1.65 -0.57 116.97 118.56 2kui h TYR 437 Ca 0.51 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.41 2kui h TYR 437 Cb 0.84 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.78 2kui h TYR 437 CO 1.25 0.25 0.46 0.00 -1.64 0.00 0.00 178.16 178.48 2kui h ALA 438 N 1.62 0.99 -0.20 1.82 0.00 -1.93 -0.48 119.26 121.08 2kui h ALA 438 Ca 0.54 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 55.21 2kui h ALA 438 Cb 0.89 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2kui h ALA 438 CO -0.31 0.47 -0.50 1.49 0.00 0.00 0.00 179.25 180.39 2kui h GLU 439 N 1.07 0.55 0.15 0.00 4.81 -1.57 -2.80 114.58 116.78 2kui h GLU 439 Ca 0.28 -0.32 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2kui h GLU 439 Cb -0.03 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2kui h GLU 439 CO -0.05 0.92 -0.07 0.00 -0.73 0.00 0.00 179.01 179.08 2kui h ALA 440 N 1.02 -0.20 -0.74 2.92 0.00 -0.31 0.98 119.26 122.93 2kui h ALA 440 Ca 0.02 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2kui h ALA 440 Cb 1.03 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 2kui h ALA 440 CO 0.09 -0.60 0.31 -0.39 0.00 0.00 0.00 179.25 178.66 2kui h VAL 441 N -0.23 1.25 -0.21 0.00 -1.51 -1.13 -1.32 116.25 113.10 2kui h VAL 441 Ca -0.02 -0.77 -0.11 0.00 -1.23 0.00 0.00 66.70 64.56 2kui h VAL 441 Cb 0.18 0.37 -0.01 0.00 -2.13 0.00 0.00 31.29 29.70 2kui h VAL 441 CO 0.03 0.31 -0.35 0.07 -1.23 0.00 0.00 177.57 176.40 2kui h LYS 442 N 1.06 0.45 -0.65 5.19 5.09 -1.29 -1.90 116.57 124.53 2kui h LYS 442 Ca 0.25 -0.20 -0.06 0.00 0.09 0.00 0.00 60.65 60.72 2kui h LYS 442 Cb 0.20 -0.01 -0.03 0.00 0.10 0.00 0.00 32.23 32.49 2kui h LYS 442 CO -0.02 0.75 0.16 -0.22 -2.09 0.00 0.00 179.45 178.03 2kui h LYS 443 N 0.38 1.03 -0.23 0.07 3.11 -0.36 -0.22 116.57 120.36 2kui h LYS 443 Ca 0.04 -0.25 -0.04 0.00 -2.81 0.00 0.00 60.65 57.60 2kui h LYS 443 Cb 0.80 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.88 2kui h LYS 443 CO 0.06 0.93 -0.04 -0.07 -2.81 0.00 0.00 179.45 177.52 2kui h LEU 444 N 0.96 0.32 -0.29 5.20 4.07 -1.08 -0.83 115.31 123.66 2kui h LEU 444 Ca 0.20 -0.05 -0.11 0.00 0.08 0.00 0.00 57.88 58.00 2kui h LEU 444 Cb 0.35 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.00 2kui h LEU 444 CO 0.00 0.41 -0.24 0.74 -1.08 0.00 0.00 178.44 178.27 2kui h THR 445 N 0.34 1.30 0.00 0.22 2.02 -0.49 0.32 112.91 116.62 2kui h THR 445 Ca 0.07 -1.40 -0.05 0.00 0.77 0.00 0.00 66.41 65.81 2kui h THR 445 Cb 0.29 1.56 -0.01 0.00 -1.74 0.00 0.00 68.15 68.26 2kui h THR 445 CO 0.01 0.45 -0.22 0.00 0.37 0.00 0.00 175.52 176.12 2kui h ALA 446 N 0.72 1.23 0.00 6.16 0.00 -0.54 -2.17 119.26 124.65 2kui h ALA 446 Ca 0.05 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2kui h ALA 446 Cb 0.80 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2kui h ALA 446 CO 0.06 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.59 2kui n ALA 447 N -2.32 2.45 0.00 0.00 0.00 -0.37 -4.96 120.51 115.32 2kui n ALA 447 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2kui n ALA 447 Cb 0.34 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.31 2kui n ALA 447 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 448 N 1.26 2.39 0.06 0.00 0.00 -0.82 -4.84 105.19 103.25 2kui n GLY 448 Ca 0.13 -0.71 -0.02 0.00 0.00 0.00 0.00 46.02 45.42 2kui n GLY 448 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2kui h PHE 449 N 0.00 -0.28 -2.22 1.61 -5.15 -1.67 -3.46 116.94 105.76 2kui h PHE 449 Ca 0.00 0.02 -0.40 0.00 -0.20 0.00 0.00 57.97 57.39 2kui h PHE 449 Cb 0.00 0.14 -0.08 0.00 0.22 0.00 0.00 35.95 36.23 2kui h PHE 449 CO 0.00 -0.06 -0.45 0.41 -2.00 0.00 0.00 178.31 176.21 2kui n GLY 450 N -1.04 0.53 3.45 6.09 0.00 0.09 -4.88 105.19 109.43 2kui n GLY 450 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -4.46 3.08 0.01 1.61 1.81 -1.26 -4.75 118.95 114.99 2kui s ARG 451 Ca 0.00 -0.93 0.00 0.00 -1.72 0.00 0.00 55.73 53.09 2kui s ARG 451 Cb 0.00 -3.82 -0.01 0.00 -0.45 0.00 0.00 34.95 30.67 2kui s ARG 451 CO 0.00 -0.63 -0.03 -0.59 -0.68 0.00 0.00 175.30 173.37 2kui s PHE 452 N 1.64 0.24 -0.08 -0.53 -0.12 -1.26 -1.36 117.98 116.52 2kui s PHE 452 Ca 0.04 -0.31 0.00 0.00 -0.05 0.00 0.00 56.93 56.61 2kui s PHE 452 Cb -0.18 -0.16 0.02 0.00 -0.63 0.00 0.00 43.02 42.06 2kui s PHE 452 CO 0.09 -0.10 -0.06 0.21 -0.05 0.00 0.00 175.22 175.31 2kui s LYS 453 N -0.87 1.25 -0.27 1.99 2.47 0.13 -4.90 119.74 119.55 2kui s LYS 453 Ca -0.08 -0.18 -0.11 0.00 -1.56 0.00 0.00 55.97 54.03 2kui s LYS 453 Cb -0.06 -1.30 -0.05 0.00 -1.46 0.00 0.00 37.83 34.96 2kui s LYS 453 CO -0.00 -0.19 0.21 -1.14 0.16 0.00 0.00 175.35 174.39 2kui s GLN 454 N 1.44 4.00 0.19 4.03 0.74 -1.26 0.46 119.66 129.26 2kui s GLN 454 Ca -0.01 -0.25 0.10 0.00 0.05 0.00 0.00 55.36 55.25 2kui s GLN 454 Cb -0.13 -3.62 -0.04 0.00 1.10 0.00 0.00 33.01 30.31 2kui s GLN 454 CO -0.04 -0.13 -0.16 0.00 -0.55 0.00 0.00 175.29 174.41 2kui s ALA 455 N 1.60 2.76 0.01 1.58 0.00 0.85 -4.97 121.76 123.59 2kui s ALA 455 Ca 0.08 -1.56 0.04 0.00 0.00 0.00 0.00 51.96 50.53 2kui s ALA 455 Cb -0.15 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.41 2kui s ALA 455 CO 0.09 0.45 -0.13 0.54 0.00 0.00 0.00 175.76 176.71 2kui s ASN 456 N -2.78 1.49 -0.00 0.00 2.20 -1.26 -0.02 114.94 114.57 2kui s ASN 456 Ca 0.23 -0.30 -0.08 0.00 -0.94 0.00 0.00 52.86 51.77 2kui s ASN 456 Cb -0.08 -0.14 0.00 0.00 -2.00 0.00 0.00 41.25 39.03 2kui s ASN 456 CO 0.13 0.11 0.16 -0.44 -2.94 0.00 0.00 177.10 174.12 2kui s SER 457 N -0.57 -0.01 0.08 3.54 0.01 -0.54 -4.92 113.70 111.29 2kui s SER 457 Ca 0.03 -0.16 -0.31 0.00 1.31 0.00 0.00 55.95 56.83 2kui s SER 457 Cb -0.06 0.22 -0.08 0.00 0.21 0.00 0.00 66.02 66.32 2kui s SER 457 CO 0.00 -0.38 1.50 -2.16 0.41 0.00 0.00 173.24 172.61 2kui s PRO 458 N -1.37 4.26 0.36 12.44 0.04 -1.24 -0.46 135.00 149.02 2kui s PRO 458 Ca -0.14 2.17 -0.01 0.00 0.04 0.00 0.00 61.00 63.05 2kui s PRO 458 Cb -0.07 -3.41 0.00 0.00 0.04 0.00 0.00 34.50 31.06 2kui s PRO 458 CO 0.02 -0.58 0.47 -1.12 0.04 0.00 0.00 177.00 175.82 2kui s SER 459 N 1.68 1.11 0.26 6.66 0.01 -0.99 -4.86 113.70 117.56 2kui s SER 459 Ca 0.68 -1.56 -0.31 0.00 1.31 0.00 0.00 55.95 56.07 2kui s SER 459 Cb -0.37 0.67 -0.13 0.00 0.21 0.00 0.00 66.02 66.39 2kui s SER 459 CO 0.30 -1.30 1.35 1.07 0.41 0.00 0.00 173.24 175.07 2kui n THR 460 N -0.60 1.19 -0.18 1.44 5.66 -1.26 -4.76 114.28 115.78 2kui n THR 460 Ca 0.02 -0.30 0.28 0.00 -3.05 0.00 0.00 64.05 61.00 2kui n THR 460 Cb 0.61 -1.43 0.71 0.00 -1.55 0.00 0.00 70.33 68.67 2kui n THR 460 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2kui h PRO 461 N 3.74 0.03 0.00 1.09 0.13 -1.95 0.48 132.00 135.52 2kui h PRO 461 Ca -0.45 -0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.57 2kui h PRO 461 Cb 1.28 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 2kui h PRO 461 CO 0.72 0.02 -0.51 1.05 -0.23 0.00 0.00 178.00 179.05 2kui h GLU 462 N 0.03 0.00 0.00 0.86 9.09 -1.99 -2.80 114.58 119.77 2kui h GLU 462 Ca 0.43 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.84 2kui h GLU 462 Cb 1.66 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.76 2kui h GLU 462 CO -0.02 0.51 -0.55 1.28 0.05 0.00 0.00 179.01 180.29 2kui n LEU 463 N -3.61 0.55 -4.71 3.06 4.77 0.12 -4.84 117.00 112.33 2kui n LEU 463 Ca -0.00 0.10 -0.42 0.00 -0.03 0.00 0.00 56.01 55.65 2kui n LEU 463 Cb 0.59 -0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 41.42 2kui n LEU 463 CO 0.40 0.06 1.39 -0.69 -1.33 0.00 0.00 177.39 177.21 2kui s VAL 464 N -3.07 2.21 0.00 4.08 1.01 -0.97 -1.55 120.40 122.11 2kui s VAL 464 Ca 0.09 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.13 2kui s VAL 464 Cb 0.16 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.50 2kui s VAL 464 CO 0.70 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.42 2kui n GLY 465 N 4.03 1.60 3.63 4.51 0.00 0.10 -4.95 105.19 114.11 2kui n GLY 465 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.81 2.03 0.47 1.61 1.02 -0.59 -4.89 119.74 118.57 2kui s LYS 466 Ca 0.00 -1.87 -0.22 0.00 0.02 0.00 0.00 55.97 53.90 2kui s LYS 466 Cb 0.00 -1.84 -0.07 0.00 -0.52 0.00 0.00 37.83 35.40 2kui s LYS 466 CO 0.00 0.06 1.14 0.08 -0.92 0.00 0.00 175.35 175.71 2kui s VAL 467 N -2.59 3.23 -0.20 3.17 1.01 0.36 -0.76 120.40 124.62 2kui s VAL 467 Ca 0.35 0.88 0.07 0.00 0.00 0.00 0.00 61.98 63.29 2kui s VAL 467 Cb 0.03 -3.43 -0.21 0.00 0.00 0.00 0.00 36.38 32.77 2kui s VAL 467 CO 0.19 -0.05 0.03 -0.38 0.00 0.00 0.00 175.10 174.89 2kui n ILE 468 N -0.62 1.51 -0.41 2.22 5.41 0.75 -4.75 119.36 123.47 2kui n ILE 468 Ca 0.08 -0.70 0.00 0.00 1.00 0.00 0.00 62.75 63.13 2kui n ILE 468 Cb 0.49 -1.12 0.00 0.00 -0.71 0.00 0.00 39.64 38.30 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 2.00 -2.00 3.41 7.39 0.00 -1.21 -5.07 105.19 109.72 2kui n GLY 469 Ca -0.37 -1.16 -0.32 0.00 0.00 0.00 0.00 46.02 44.16 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 -2.12 2.80 0.10 2.61 -4.23 -1.26 -2.18 115.64 111.36 2kui s THR 470 Ca 0.00 -0.81 -0.20 0.00 -1.18 0.00 0.00 61.69 59.50 2kui s THR 470 Cb 0.00 -2.09 -0.08 0.00 1.34 0.00 0.00 72.50 71.68 2kui s THR 470 CO 0.00 0.58 1.65 -1.13 -0.54 0.00 0.00 174.62 175.18 2kui h ASN 471 N 5.65 0.29 -3.43 3.99 -0.00 -1.63 -3.38 115.58 117.06 2kui h ASN 471 Ca -0.41 -0.15 -0.53 0.00 -0.00 0.00 0.00 56.30 55.22 2kui h ASN 471 Cb 1.16 -0.07 -0.01 0.00 -0.00 0.00 0.00 38.32 39.40 2kui h ASN 471 CO 0.50 0.35 0.45 -2.84 -0.00 0.00 0.00 177.43 175.90 2kui s PRO 472 N -5.62 4.56 0.14 6.67 0.02 -1.26 -4.98 135.00 134.53 2kui s PRO 472 Ca -0.13 1.61 -0.31 0.00 0.02 0.00 0.00 61.00 62.19 2kui s PRO 472 Cb 0.08 -3.36 -0.10 0.00 0.02 0.00 0.00 34.50 31.14 2kui s PRO 472 CO 0.71 -0.01 1.73 -1.25 -0.33 0.00 0.00 177.00 177.85 2kui s PRO 473 N 0.38 4.16 -0.04 5.54 0.04 -1.26 -4.86 135.00 138.96 2kui s PRO 473 Ca 0.52 2.51 0.04 0.00 0.04 0.00 0.00 61.00 64.11 2kui s PRO 473 Cb -0.26 -3.41 0.20 0.00 0.04 0.00 0.00 34.50 31.07 2kui s PRO 473 CO 0.31 -0.76 0.93 0.00 0.04 0.00 0.00 177.00 177.52 2kui n ALA 474 N 5.01 2.74 0.39 8.56 0.00 -1.26 -1.94 120.51 134.00 2kui n ALA 474 Ca 0.16 -0.45 0.04 0.00 0.00 0.00 0.00 53.44 53.19 2kui n ALA 474 Cb 0.38 -1.02 -0.01 0.00 0.00 0.00 0.00 19.45 18.80 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 0.14 0.93 -3.53 0.00 5.03 -1.23 -1.92 115.26 114.67 2kui n ASN 475 Ca 0.07 -0.96 -0.15 0.00 0.87 0.00 0.00 54.58 54.41 2kui n ASN 475 Cb 0.39 0.61 -0.01 0.00 -1.02 0.00 0.00 39.78 39.76 2kui n ASN 475 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2kui n GLN 476 N -0.52 1.10 -3.41 3.52 1.13 -0.82 -4.74 117.38 113.63 2kui n GLN 476 Ca 0.03 -1.90 -0.33 0.00 -1.94 0.00 0.00 57.00 52.86 2kui n GLN 476 Cb 0.17 0.26 -0.05 0.00 0.11 0.00 0.00 30.24 30.73 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 -1.57 4.93 0.05 5.09 -4.23 -1.26 -0.19 115.64 118.46 2kui s THR 477 Ca 0.14 0.54 0.03 0.00 -1.18 0.00 0.00 61.69 61.22 2kui s THR 477 Cb -0.01 -3.64 -0.03 0.00 1.34 0.00 0.00 72.50 70.16 2kui s THR 477 CO 0.09 0.01 -0.11 -0.55 -0.54 0.00 0.00 174.62 173.52 2kui s SER 478 N -2.21 1.21 0.58 3.99 0.15 0.73 -4.90 113.70 113.25 2kui s SER 478 Ca 0.45 -0.57 -0.14 0.00 0.70 0.00 0.00 55.95 56.40 2kui s SER 478 Cb -0.12 -0.01 -0.05 0.00 -1.71 0.00 0.00 66.02 64.13 2kui s SER 478 CO 0.21 -0.14 1.01 0.00 1.20 0.00 0.00 173.24 175.52 2kui s ALA 479 N -1.30 3.06 0.08 5.45 0.00 -1.26 -2.55 121.76 125.24 2kui s ALA 479 Ca -0.06 0.05 0.31 0.00 0.00 0.00 0.00 51.96 52.25 2kui s ALA 479 Cb -0.10 -3.10 1.20 0.00 0.00 0.00 0.00 23.12 21.11 2kui s ALA 479 CO 0.01 -0.52 1.92 0.82 0.00 0.00 0.00 175.76 178.00 2kui h ILE 480 N 0.22 0.14 -0.46 0.00 1.08 -1.94 -1.86 117.51 114.69 2kui h ILE 480 Ca -0.45 -0.69 0.00 0.00 -0.39 0.00 0.00 64.86 63.33 2kui h ILE 480 Cb 1.19 1.60 0.00 0.00 -3.07 0.00 0.00 36.82 36.54 2kui h ILE 480 CO 0.61 0.06 0.00 0.35 -0.69 0.00 0.00 178.15 178.48 2kui n THR 481 N -3.17 0.59 -3.10 -0.27 -2.24 -1.26 -3.88 114.28 100.95 2kui n THR 481 Ca 0.01 -0.80 -0.39 0.00 -2.27 0.00 0.00 64.05 60.60 2kui n THR 481 Cb 0.35 0.91 -0.05 0.00 -2.10 0.00 0.00 70.33 69.44 2kui n THR 481 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2kui s ASN 482 N -1.41 6.89 -0.37 3.42 3.84 -0.70 -5.03 114.94 121.59 2kui s ASN 482 Ca 0.41 1.08 -0.16 0.00 0.21 0.00 0.00 52.86 54.40 2kui s ASN 482 Cb 0.24 -2.38 0.00 0.00 -0.55 0.00 0.00 41.25 38.55 2kui s ASN 482 CO 0.32 -0.13 0.40 -0.69 -2.79 0.00 0.00 177.10 174.21 2kui s VAL 483 N 0.96 5.13 -0.13 -5.21 1.01 -1.26 -4.41 120.40 116.49 2kui s VAL 483 Ca 0.34 -0.07 -0.19 0.00 0.00 0.00 0.00 61.98 62.06 2kui s VAL 483 Cb -0.17 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 2kui s VAL 483 CO 0.15 -0.21 0.50 0.68 0.00 0.00 0.00 175.10 176.22 2kui s VAL 484 N 2.08 5.16 -0.20 2.92 -7.23 -0.46 -4.92 120.40 117.75 2kui s VAL 484 Ca 0.12 0.99 -0.16 0.00 -1.81 0.00 0.00 61.98 61.13 2kui s VAL 484 Cb -0.17 -3.84 -0.04 0.00 0.56 0.00 0.00 36.38 32.89 2kui s VAL 484 CO 0.12 0.29 0.40 -0.51 -0.31 0.00 0.00 175.10 175.10 2kui s ILE 485 N 0.81 5.20 -0.17 -0.62 -1.16 -1.26 -0.69 121.20 123.31 2kui s ILE 485 Ca 0.27 0.72 -0.01 0.00 -0.51 0.00 0.00 60.65 61.11 2kui s ILE 485 Cb -0.15 -3.73 -0.00 0.00 0.61 0.00 0.00 42.46 39.18 2kui s ILE 485 CO 0.11 0.25 -0.13 -0.63 -2.81 0.00 0.00 174.94 171.73 2kui s ILE 486 N 1.29 2.85 -0.20 2.00 1.01 0.17 -1.38 121.20 126.94 2kui s ILE 486 Ca 0.19 -0.70 -0.07 0.00 0.00 0.00 0.00 60.65 60.07 2kui s ILE 486 Cb -0.15 -2.23 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 2kui s ILE 486 CO 0.08 0.50 0.06 -0.51 0.00 0.00 0.00 174.94 175.07 2kui s ILE 487 N 0.94 4.59 0.12 2.92 2.07 -0.93 -0.11 121.20 130.80 2kui s ILE 487 Ca -0.02 -0.10 0.05 0.00 -1.41 0.00 0.00 60.65 59.17 2kui s ILE 487 Cb -0.15 -3.09 -0.04 0.00 0.13 0.00 0.00 42.46 39.31 2kui s ILE 487 CO -0.01 0.42 0.03 0.68 -1.91 0.00 0.00 174.94 174.15 2kui s VAL 488 N 0.77 4.11 0.05 4.00 -7.23 0.97 -0.18 120.40 122.88 2kui s VAL 488 Ca 0.03 -1.06 -0.23 0.00 -1.81 0.00 0.00 61.98 58.91 2kui s VAL 488 Cb -0.13 -3.01 -0.06 0.00 0.56 0.00 0.00 36.38 33.74 2kui s VAL 488 CO 0.02 0.03 0.68 -0.83 -0.31 0.00 0.00 175.10 174.70 2kui s GLY 489 N -2.58 2.73 0.07 2.32 0.00 0.06 -1.47 107.32 108.45 2kui s GLY 489 Ca 0.27 0.17 -0.00 0.00 0.00 0.00 0.00 44.72 45.16 2kui s GLY 489 CO 0.20 0.86 -0.03 -0.45 0.00 0.00 0.00 173.10 173.67 2kui s SER 490 N -0.40 0.61 0.00 1.64 0.15 0.39 0.02 113.70 116.11 2kui s SER 490 Ca 0.34 -1.02 0.00 0.00 0.70 0.00 0.00 55.95 55.98 2kui s SER 490 Cb -0.20 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.30 2kui s SER 490 CO 0.21 -0.58 0.00 0.61 1.20 0.00 0.00 173.24 174.68 2kui n GLY 491 N 0.06 -0.12 3.65 9.45 0.00 -1.26 -2.35 105.19 114.63 2kui n GLY 491 Ca -0.13 -0.32 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 2kui n GLY 491 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2kui s PRO 492 N -1.50 4.21 -0.31 1.61 0.04 -1.26 -4.51 135.00 133.28 2kui s PRO 492 Ca 0.00 0.77 0.10 0.00 0.04 0.00 0.00 61.00 61.91 2kui s PRO 492 Cb 0.00 -3.60 0.74 0.00 0.04 0.00 0.00 34.50 31.68 2kui s PRO 492 CO 0.00 -0.35 1.79 0.00 0.04 0.00 0.00 177.00 178.48 2kui n ALA 493 N 5.39 4.48 -2.35 8.56 0.00 -1.26 -4.89 120.51 130.45 2kui n ALA 493 Ca 0.02 -2.35 -0.30 0.00 0.00 0.00 0.00 53.44 50.81 2kui n ALA 493 Cb 0.49 -1.21 -0.15 0.00 0.00 0.00 0.00 19.45 18.58 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 -2.99 2.08 0.03 0.00 -4.23 -1.26 -0.69 115.64 108.58 2kui s THR 494 Ca 0.55 -1.31 0.01 0.00 -1.18 0.00 0.00 61.69 59.75 2kui s THR 494 Cb 0.44 -1.77 -0.02 0.00 1.34 0.00 0.00 72.50 72.49 2kui s THR 494 CO 0.13 0.40 -0.05 -0.54 -0.54 0.00 0.00 174.62 174.03 2kui s LYS 495 N -1.09 0.44 -0.09 3.99 1.02 -0.16 -4.91 119.74 118.94 2kui s LYS 495 Ca 0.11 -0.76 -0.29 0.00 0.02 0.00 0.00 55.97 55.05 2kui s LYS 495 Cb -0.10 -0.02 -0.02 0.00 -0.52 0.00 0.00 37.83 37.18 2kui s LYS 495 CO 0.01 -0.03 0.98 -0.51 -0.92 0.00 0.00 175.35 174.88 2kui s ASP 496 N -1.75 7.24 -0.03 2.83 1.01 -1.26 -0.89 116.67 123.82 2kui s ASP 496 Ca -0.10 1.52 -0.30 0.00 0.71 0.00 0.00 52.55 54.38 2kui s ASP 496 Cb -0.07 -2.55 -0.03 0.00 1.01 0.00 0.00 42.92 41.28 2kui s ASP 496 CO -0.02 -0.39 1.16 0.27 0.21 0.00 0.00 175.17 176.40 2kui s ILE 497 N 1.76 4.32 0.32 0.77 -4.36 -0.07 -4.83 121.20 119.12 2kui s ILE 497 Ca 0.48 1.65 -0.03 0.00 -0.26 0.00 0.00 60.65 62.48 2kui s ILE 497 Cb -0.19 -4.06 -0.04 0.00 1.25 0.00 0.00 42.46 39.42 2kui s ILE 497 CO 0.20 0.03 0.57 -2.16 0.24 0.00 0.00 174.94 173.82 2kui s PRO 498 N 1.88 3.58 -0.48 0.37 0.04 -1.26 -0.52 135.00 138.60 2kui s PRO 498 Ca 0.55 -0.09 -0.29 0.00 0.04 0.00 0.00 61.00 61.22 2kui s PRO 498 Cb -0.25 -2.63 0.03 0.00 0.04 0.00 0.00 34.50 31.69 2kui s PRO 498 CO 0.23 0.16 1.18 0.16 0.04 0.00 0.00 177.00 178.77 2kui s ASP 499 N -3.52 6.57 -0.13 6.66 -4.77 -1.26 -4.81 116.67 115.42 2kui s ASP 499 Ca 0.43 0.47 0.13 0.00 -3.30 0.00 0.00 52.55 50.28 2kui s ASP 499 Cb -0.10 -2.55 0.59 0.00 -1.09 0.00 0.00 42.92 39.77 2kui s ASP 499 CO 0.33 -1.31 1.44 0.55 0.70 0.00 0.00 175.17 176.88 2kui n VAL 500 N 6.87 1.71 -2.02 2.11 3.14 -1.26 -4.75 118.33 124.13 2kui n VAL 500 Ca 0.12 -0.97 -0.42 0.00 -2.96 0.00 0.00 64.34 60.11 2kui n VAL 500 Cb 0.49 -0.13 0.00 0.00 -1.06 0.00 0.00 33.84 33.14 2kui n VAL 500 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kui n ALA 501 N 0.67 5.09 -1.91 1.55 0.00 -1.26 -3.52 120.51 121.12 2kui n ALA 501 Ca 0.20 -3.95 0.00 0.00 0.00 0.00 0.00 53.44 49.69 2kui n ALA 501 Cb 0.83 -3.45 0.00 0.00 0.00 0.00 0.00 19.45 16.82 2kui n ALA 501 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 502 N 4.15 0.63 3.26 0.00 0.00 -1.26 -4.84 105.19 107.14 2kui n GLY 502 Ca 0.49 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.34 2kui n GLY 502 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kui s GLN 503 N 0.00 1.59 0.56 1.61 -0.21 -1.23 -5.01 119.66 116.97 2kui s GLN 503 Ca 0.00 -1.90 -0.09 0.00 0.02 0.00 0.00 55.36 53.39 2kui s GLN 503 Cb 0.00 0.30 -0.04 0.00 1.00 0.00 0.00 33.01 34.27 2kui s GLN 503 CO 0.00 -0.57 0.93 0.95 -2.12 0.00 0.00 175.29 174.48 2kui s THR 504 N -3.66 4.79 0.29 -0.19 -4.23 -1.26 -2.11 115.64 109.28 2kui s THR 504 Ca 0.40 0.60 0.04 0.00 -1.18 0.00 0.00 61.69 61.55 2kui s THR 504 Cb 0.04 -3.87 0.28 0.00 1.34 0.00 0.00 72.50 70.29 2kui s THR 504 CO 0.23 -1.03 1.75 1.62 -0.54 0.00 0.00 174.62 176.66 2kui h VAL 505 N -0.09 0.65 -0.59 2.29 3.04 -0.55 0.32 116.25 121.31 2kui h VAL 505 Ca -0.45 -0.22 -0.04 0.00 -1.01 0.00 0.00 66.70 64.98 2kui h VAL 505 Cb 1.20 -0.05 -0.03 0.00 -2.01 0.00 0.00 31.29 30.40 2kui h VAL 505 CO 0.62 0.12 0.21 -0.78 -1.01 0.00 0.00 177.57 176.72 2kui h ASP 506 N 0.64 0.84 0.11 3.17 3.58 -1.93 -0.44 116.42 122.39 2kui h ASP 506 Ca 0.56 -0.19 -0.25 0.00 0.42 0.00 0.00 57.03 57.56 2kui h ASP 506 Cb 0.91 -0.22 0.02 0.00 1.72 0.00 0.00 39.33 41.76 2kui h ASP 506 CO -0.42 0.80 -1.01 0.58 -2.88 0.00 0.00 179.24 176.32 2kui h VAL 507 N 0.82 1.32 -0.12 2.25 2.07 -1.57 -2.67 116.25 118.36 2kui h VAL 507 Ca 0.19 -2.31 -0.01 0.00 0.82 0.00 0.00 66.70 65.40 2kui h VAL 507 Cb 0.25 2.39 -0.01 0.00 -1.52 0.00 0.00 31.29 32.41 2kui h VAL 507 CO -0.01 0.71 0.05 0.00 0.02 0.00 0.00 177.57 178.33 2kui h ALA 508 N 0.51 0.15 -0.76 1.67 0.00 -0.30 -1.71 119.26 118.83 2kui h ALA 508 Ca -0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2kui h ALA 508 Cb 1.66 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.37 2kui h ALA 508 CO 0.19 -0.26 0.38 -0.56 0.00 0.00 0.00 179.25 179.00 2kui h GLN 509 N 0.03 1.07 -0.14 0.00 3.07 -1.12 -0.69 115.11 117.34 2kui h GLN 509 Ca 0.04 -0.14 0.01 0.00 0.09 0.00 0.00 58.65 58.65 2kui h GLN 509 Cb 0.17 -0.20 -0.01 0.00 0.08 0.00 0.00 27.48 27.51 2kui h GLN 509 CO -0.00 0.82 0.06 -0.22 0.09 0.00 0.00 178.83 179.57 2kui h LYS 510 N 1.07 0.13 -0.65 0.06 3.11 -1.26 0.11 116.57 119.14 2kui h LYS 510 Ca 0.26 -0.01 -0.03 0.00 -2.81 0.00 0.00 60.65 58.07 2kui h LYS 510 Cb 0.08 -0.03 -0.03 0.00 -1.00 0.00 0.00 32.23 31.25 2kui h LYS 510 CO -0.04 0.09 0.30 -0.91 -2.81 0.00 0.00 179.45 176.08 2kui h ASN 511 N 0.14 0.87 -0.63 4.20 2.35 -0.74 -1.86 115.58 119.90 2kui h ASN 511 Ca 0.06 -0.14 -0.08 0.00 -0.55 0.00 0.00 56.30 55.59 2kui h ASN 511 Cb 0.02 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.14 2kui h ASN 511 CO -0.05 0.77 0.10 -0.07 -1.65 0.00 0.00 177.43 176.53 2kui h LEU 512 N 0.90 1.01 -1.08 1.61 3.38 -0.75 -1.89 115.31 118.49 2kui h LEU 512 Ca 0.22 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2kui h LEU 512 Cb 0.15 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 2kui h LEU 512 CO -0.02 1.02 0.36 0.78 0.09 0.00 0.00 178.44 180.67 2kui h ASN 513 N 0.96 0.90 -0.47 -0.43 -0.26 -0.48 -0.42 115.58 115.39 2kui h ASN 513 Ca 0.19 -0.09 -0.02 0.00 -0.56 0.00 0.00 56.30 55.82 2kui h ASN 513 Cb 0.44 -0.23 -0.02 0.00 -1.06 0.00 0.00 38.32 37.45 2kui h ASN 513 CO 0.01 0.75 0.22 0.58 -1.06 0.00 0.00 177.43 177.94 2kui h VAL 514 N 1.01 1.18 0.00 2.81 2.07 -0.81 -2.04 116.25 120.47 2kui h VAL 514 Ca 0.25 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2kui h VAL 514 Cb 0.07 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 2kui h VAL 514 CO -0.04 0.22 0.00 -1.22 0.02 0.00 0.00 177.57 176.55 2kui n TYR 515 N -4.36 0.00 0.00 1.57 4.01 -0.47 -4.87 117.16 113.04 2kui n TYR 515 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 2kui n TYR 515 Cb 0.14 -0.41 0.00 0.00 -0.31 0.00 0.00 39.34 38.77 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 1.25 1.54 3.54 2.72 0.00 -0.77 -5.03 105.19 108.45 2kui n GLY 516 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.13 2.46 -2.22 1.61 0.08 -0.29 -4.71 117.98 112.78 2kui s PHE 517 Ca 0.00 -0.47 0.24 0.00 0.12 0.00 0.00 56.93 56.81 2kui s PHE 517 Cb 0.00 -4.60 0.19 0.00 -0.57 0.00 0.00 43.02 38.04 2kui s PHE 517 CO 0.00 -1.95 1.22 2.41 -0.10 0.00 0.00 175.22 176.80 2kui n THR 518 N 6.46 0.00 -4.08 0.64 -1.04 -1.26 -2.63 114.28 112.37 2kui n THR 518 Ca 0.14 -0.29 -0.32 0.00 -2.04 0.00 0.00 64.05 61.54 2kui n THR 518 Cb 0.49 1.15 -0.16 0.00 -1.82 0.00 0.00 70.33 70.00 2kui n THR 518 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2kui s LYS 519 N -2.36 2.51 0.07 -2.82 1.02 -1.26 -5.01 119.74 111.90 2kui s LYS 519 Ca 0.22 -1.08 0.05 0.00 0.02 0.00 0.00 55.97 55.18 2kui s LYS 519 Cb 0.19 -2.70 -0.03 0.00 -0.52 0.00 0.00 37.83 34.76 2kui s LYS 519 CO 0.50 -0.41 -0.13 -0.59 -0.92 0.00 0.00 175.35 173.80 2kui s PHE 520 N 1.21 1.16 0.02 3.18 -0.71 -1.26 -1.71 117.98 119.87 2kui s PHE 520 Ca -0.02 -0.49 0.05 0.00 -1.04 0.00 0.00 56.93 55.43 2kui s PHE 520 Cb -0.17 -0.65 -0.02 0.00 -1.21 0.00 0.00 43.02 40.98 2kui s PHE 520 CO -0.09 0.04 -0.16 -1.12 -1.34 0.00 0.00 175.22 172.56 2kui s SER 521 N -1.83 1.92 -0.15 1.98 0.01 -0.08 -4.92 113.70 110.63 2kui s SER 521 Ca -0.01 -0.40 0.01 0.00 1.31 0.00 0.00 55.95 56.85 2kui s SER 521 Cb -0.09 -0.17 0.00 0.00 0.21 0.00 0.00 66.02 65.97 2kui s SER 521 CO 0.02 0.13 -0.17 0.00 0.41 0.00 0.00 173.24 173.62 2kui s GLN 522 N -0.84 3.17 -0.22 12.44 0.00 -1.26 0.01 119.66 132.96 2kui s GLN 522 Ca 0.05 -0.78 -0.01 0.00 -0.00 0.00 0.00 55.36 54.62 2kui s GLN 522 Cb -0.07 -2.57 0.02 0.00 0.00 0.00 0.00 33.01 30.39 2kui s GLN 522 CO 0.01 0.02 -0.10 0.00 0.00 0.00 0.00 175.29 175.21 2kui s ALA 523 N 0.79 2.60 -0.13 2.60 0.00 0.56 -4.96 121.76 123.21 2kui s ALA 523 Ca -0.06 -1.36 -0.15 0.00 0.00 0.00 0.00 51.96 50.39 2kui s ALA 523 Cb -0.15 -1.54 -0.05 0.00 0.00 0.00 0.00 23.12 21.38 2kui s ALA 523 CO -0.00 -0.63 0.35 -1.12 0.00 0.00 0.00 175.76 174.35 2kui s SER 524 N 1.33 6.54 0.17 0.00 0.01 -1.26 -0.27 113.70 120.22 2kui s SER 524 Ca 0.02 0.63 0.11 0.00 1.31 0.00 0.00 55.95 58.02 2kui s SER 524 Cb -0.15 -2.21 -0.04 0.00 0.21 0.00 0.00 66.02 63.82 2kui s SER 524 CO -0.07 0.11 -0.23 0.68 0.41 0.00 0.00 173.24 174.14 2kui s VAL 525 N 0.26 2.19 0.14 3.43 -7.23 0.59 -4.89 120.40 114.89 2kui s VAL 525 Ca 0.20 -1.92 -0.24 0.00 -1.81 0.00 0.00 61.98 58.20 2kui s VAL 525 Cb -0.14 -2.01 -0.08 0.00 0.56 0.00 0.00 36.38 34.72 2kui s VAL 525 CO 0.07 -0.11 0.75 1.51 -0.31 0.00 0.00 175.10 177.00 2kui s ASP 526 N -2.50 7.33 0.05 4.85 -4.77 -1.26 0.13 116.67 120.50 2kui s ASP 526 Ca 0.17 1.57 -0.27 0.00 -3.30 0.00 0.00 52.55 50.73 2kui s ASP 526 Cb -0.08 -2.48 0.08 0.00 -1.09 0.00 0.00 42.92 39.35 2kui s ASP 526 CO 0.08 0.20 0.71 -0.94 0.70 0.00 0.00 175.17 175.92 2kui s SER 527 N -1.01 -0.53 0.19 2.11 1.04 0.99 -4.85 113.70 111.64 2kui s SER 527 Ca 0.35 0.21 0.14 0.00 0.48 0.00 0.00 55.95 57.13 2kui s SER 527 Cb -0.22 0.51 0.72 0.00 0.10 0.00 0.00 66.02 67.13 2kui s SER 527 CO 0.25 -0.75 1.42 -2.65 0.98 0.00 0.00 173.24 172.49 2kui n PRO 528 N 0.06 0.09 -2.25 4.02 -0.02 -1.26 -3.65 135.00 131.99 2kui n PRO 528 Ca -0.15 0.56 -0.42 0.00 -2.02 0.00 0.00 63.50 61.47 2kui n PRO 528 Cb 0.62 -1.77 -0.03 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 -3.32 4.37 0.55 -0.52 0.52 -1.26 -4.84 118.95 114.45 2kui s ARG 529 Ca -0.01 1.99 -0.21 0.00 -0.52 0.00 0.00 55.73 56.98 2kui s ARG 529 Cb 0.04 -3.26 -0.05 0.00 0.52 0.00 0.00 34.95 32.20 2kui s ARG 529 CO 0.14 -0.35 1.18 -2.30 0.02 0.00 0.00 175.30 173.99 2kui n PRO 530 N 3.69 1.35 -1.70 3.54 -0.02 -1.26 -2.82 135.00 137.77 2kui n PRO 530 Ca 0.10 0.50 -0.43 0.00 -2.02 0.00 0.00 63.50 61.65 2kui n PRO 530 Cb 0.43 -2.37 -0.03 0.00 -0.02 0.00 0.00 33.50 31.51 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 -1.25 2.37 0.00 3.55 0.00 -1.24 -2.38 120.51 121.55 2kui n ALA 531 Ca 0.12 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.93 2kui n ALA 531 Cb 0.45 -2.53 0.00 0.00 0.00 0.00 0.00 19.45 17.37 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 4.02 2.19 3.73 0.00 0.00 -0.75 -4.96 105.19 109.42 2kui n GLY 532 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.03 4.44 -0.37 1.61 2.56 -1.00 0.21 118.70 126.12 2kui s GLU 533 Ca 0.00 1.88 -0.22 0.00 0.00 0.00 0.00 54.97 56.63 2kui s GLU 533 Cb 0.00 -3.28 0.01 0.00 2.00 0.00 0.00 34.13 32.86 2kui s GLU 533 CO 0.00 -0.21 0.70 0.08 -0.56 0.00 0.00 175.26 175.27 2kui s VAL 534 N 0.53 4.81 -0.28 3.70 1.01 -0.90 0.23 120.40 129.50 2kui s VAL 534 Ca 0.57 0.66 0.22 0.00 0.00 0.00 0.00 61.98 63.43 2kui s VAL 534 Cb -0.32 -4.15 0.09 0.00 0.00 0.00 0.00 36.38 31.99 2kui s VAL 534 CO 0.33 -0.40 1.20 0.00 0.00 0.00 0.00 175.10 176.22 2kui h THR 535 N 5.74 0.06 0.00 3.92 1.03 -1.56 -3.35 112.91 118.74 2kui h THR 535 Ca -0.26 -1.10 0.00 0.00 -0.01 0.00 0.00 66.41 65.05 2kui h THR 535 Cb 1.10 1.70 0.00 0.00 -1.07 0.00 0.00 68.15 69.88 2kui h THR 535 CO 0.88 0.03 0.00 0.61 -0.01 0.00 0.00 175.52 177.03 2kui n GLY 536 N 1.17 -0.79 3.24 2.99 0.00 -1.06 -4.95 105.19 105.79 2kui n GLY 536 Ca 0.01 -0.91 -0.18 0.00 0.00 0.00 0.00 46.02 44.94 2kui n GLY 536 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 537 N -3.00 1.32 -0.01 2.61 -4.23 -1.26 -0.90 115.64 110.17 2kui s THR 537 Ca 0.00 -1.73 -0.24 0.00 -1.18 0.00 0.00 61.69 58.54 2kui s THR 537 Cb 0.00 -1.54 -0.16 0.00 1.34 0.00 0.00 72.50 72.14 2kui s THR 537 CO 0.00 -0.43 1.15 -1.13 -0.54 0.00 0.00 174.62 173.67 2kui h ASN 538 N 3.50 -0.28 -3.60 3.99 -1.24 -1.54 -3.43 115.58 112.97 2kui h ASN 538 Ca -0.40 -0.24 -0.52 0.00 0.71 0.00 0.00 56.30 55.86 2kui h ASN 538 Cb 1.20 0.07 0.03 0.00 0.73 0.00 0.00 38.32 40.35 2kui h ASN 538 CO 0.51 0.14 0.58 -2.16 -1.29 0.00 0.00 177.43 175.20 2kui s PRO 539 N -4.33 4.48 0.44 6.67 0.04 -1.26 -4.99 135.00 136.05 2kui s PRO 539 Ca -0.14 1.96 -0.24 0.00 0.04 0.00 0.00 61.00 62.62 2kui s PRO 539 Cb 0.02 -3.19 -0.08 0.00 0.04 0.00 0.00 34.50 31.29 2kui s PRO 539 CO 0.53 -0.08 1.21 -1.25 0.04 0.00 0.00 177.00 177.46 2kui s PRO 540 N -0.76 3.80 0.41 0.56 0.04 -1.26 -4.98 135.00 132.81 2kui s PRO 540 Ca 0.51 1.92 -0.26 0.00 0.04 0.00 0.00 61.00 63.20 2kui s PRO 540 Cb -0.35 -2.53 -0.09 0.00 0.04 0.00 0.00 34.50 31.58 2kui s PRO 540 CO 0.41 -0.56 1.41 0.00 0.04 0.00 0.00 177.00 178.31 2kui s ALA 541 N -1.43 3.36 0.00 8.56 0.00 -1.26 -2.37 121.76 128.62 2kui s ALA 541 Ca 0.62 1.44 0.00 0.00 0.00 0.00 0.00 51.96 54.02 2kui s ALA 541 Cb -0.32 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.23 2kui s ALA 541 CO 0.40 -1.05 0.00 0.41 0.00 0.00 0.00 175.76 175.52 2kui n GLY 542 N 0.57 0.79 3.72 0.00 0.00 0.32 -4.98 105.19 105.62 2kui n GLY 542 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.22 4.29 -0.18 2.61 2.01 -1.00 -4.69 115.64 116.47 2kui s THR 543 Ca 0.00 1.79 -0.22 0.00 0.31 0.00 0.00 61.69 63.56 2kui s THR 543 Cb 0.00 -4.14 -0.02 0.00 0.01 0.00 0.00 72.50 68.34 2kui s THR 543 CO 0.00 0.22 0.69 0.28 -0.69 0.00 0.00 174.62 175.12 2kui s THR 544 N 0.44 4.99 0.15 -0.82 -1.32 -1.26 -0.89 115.64 116.93 2kui s THR 544 Ca 0.52 1.33 0.08 0.00 -1.21 0.00 0.00 61.69 62.40 2kui s THR 544 Cb -0.26 -4.00 -0.04 0.00 -1.51 0.00 0.00 72.50 66.69 2kui s THR 544 CO 0.31 0.10 -0.18 0.68 -2.21 0.00 0.00 174.62 173.32 2kui s VAL 545 N 1.88 1.72 0.22 5.08 -7.23 -0.06 -4.87 120.40 117.14 2kui s VAL 545 Ca 0.32 -1.86 -0.30 0.00 -1.81 0.00 0.00 61.98 58.33 2kui s VAL 545 Cb -0.16 -1.77 -0.09 0.00 0.56 0.00 0.00 36.38 34.92 2kui s VAL 545 CO 0.11 -0.32 1.21 -2.84 -0.31 0.00 0.00 175.10 172.95 2kui s PRO 546 N -2.74 4.48 0.61 4.82 0.02 -1.26 -0.99 135.00 139.94 2kui s PRO 546 Ca 0.14 1.93 0.39 0.00 0.02 0.00 0.00 61.00 63.48 2kui s PRO 546 Cb -0.06 -3.21 1.91 0.00 0.02 0.00 0.00 34.50 33.17 2kui s PRO 546 CO 0.06 -0.08 2.18 -0.39 -0.33 0.00 0.00 177.00 178.44 2kui h VAL 547 N 3.57 0.00 0.00 3.83 -1.51 -1.23 -0.86 116.25 120.05 2kui h VAL 547 Ca -0.45 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 64.77 2kui h VAL 547 Cb 1.21 1.24 0.00 0.00 -2.13 0.00 0.00 31.29 31.61 2kui h VAL 547 CO 0.73 0.00 0.00 -0.67 -1.23 0.00 0.00 177.57 176.40 2kui n ASP 548 N -3.07 0.78 -2.53 4.19 2.03 -1.26 -4.01 116.55 112.68 2kui n ASP 548 Ca -0.01 0.61 -0.04 0.00 0.52 0.00 0.00 54.79 55.87 2kui n ASP 548 Cb 0.18 -0.81 0.02 0.00 -0.72 0.00 0.00 41.12 39.79 2kui n ASP 548 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2kui n SER 549 N -2.28 0.31 -4.29 1.67 7.64 -0.33 -4.95 113.62 111.40 2kui n SER 549 Ca 0.04 -1.25 -0.33 0.00 1.01 0.00 0.00 58.87 58.34 2kui n SER 549 Cb 0.36 -0.12 -0.15 0.00 -1.01 0.00 0.00 64.21 63.29 2kui n SER 549 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2kui s VAL 550 N -0.23 2.72 -0.00 0.44 1.01 -1.26 -4.19 120.40 118.88 2kui s VAL 550 Ca 0.13 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 2kui s VAL 550 Cb -0.01 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 2kui s VAL 550 CO 0.08 0.52 0.13 0.27 0.00 0.00 0.00 175.10 176.10 2kui s ILE 551 N 0.70 5.03 -0.22 2.22 -0.00 -0.69 -4.94 121.20 123.29 2kui s ILE 551 Ca -0.07 -0.31 -0.05 0.00 -0.00 0.00 0.00 60.65 60.21 2kui s ILE 551 Cb -0.16 -3.33 -0.02 0.00 -0.00 0.00 0.00 42.46 38.95 2kui s ILE 551 CO 0.02 0.33 0.01 -0.70 -0.00 0.00 0.00 174.94 174.60 2kui s GLU 552 N -1.85 3.55 -0.14 0.37 2.12 -1.26 -0.91 118.70 120.59 2kui s GLU 552 Ca 0.25 -0.54 -0.11 0.00 0.36 0.00 0.00 54.97 54.93 2kui s GLU 552 Cb -0.12 -3.14 -0.05 0.00 0.26 0.00 0.00 34.13 31.08 2kui s GLU 552 CO 0.16 -0.13 0.22 -0.51 -0.54 0.00 0.00 175.26 174.46 2kui s LEU 553 N 1.38 4.31 -0.25 2.70 1.43 0.10 -1.31 118.68 127.04 2kui s LEU 553 Ca 0.05 0.48 -0.07 0.00 -1.03 0.00 0.00 54.13 53.56 2kui s LEU 553 Cb -0.15 -2.23 -0.02 0.00 0.03 0.00 0.00 46.19 43.82 2kui s LEU 553 CO 0.01 0.25 0.07 0.00 0.23 0.00 0.00 176.35 176.91 2kui s GLN 554 N -0.24 3.60 0.00 1.70 -2.07 -0.08 -0.33 119.66 122.25 2kui s GLN 554 Ca 0.15 -0.51 0.01 0.00 -1.82 0.00 0.00 55.36 53.18 2kui s GLN 554 Cb -0.13 -3.33 -0.04 0.00 -1.09 0.00 0.00 33.01 28.43 2kui s GLN 554 CO 0.04 -0.21 0.05 0.08 -1.32 0.00 0.00 175.29 173.92 2kui s VAL 555 N 1.61 4.49 0.04 3.63 1.01 0.63 -1.42 120.40 130.39 2kui s VAL 555 Ca 0.06 -0.51 -0.26 0.00 0.00 0.00 0.00 61.98 61.26 2kui s VAL 555 Cb -0.15 -3.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.13 2kui s VAL 555 CO 0.03 0.34 0.82 -0.44 0.00 0.00 0.00 175.10 175.86 2kui s SER 556 N -1.72 7.27 -0.12 3.32 0.01 0.14 -0.30 113.70 122.30 2kui s SER 556 Ca 0.22 1.52 -0.04 0.00 1.31 0.00 0.00 55.95 58.96 2kui s SER 556 Cb -0.12 -2.50 -0.04 0.00 0.21 0.00 0.00 66.02 63.58 2kui s SER 556 CO 0.13 -0.04 0.04 -0.75 0.41 0.00 0.00 173.24 173.03 2kui s LYS 557 N 0.15 3.33 -0.06 12.44 2.20 0.12 -1.82 119.74 136.11 2kui s LYS 557 Ca 0.42 -0.34 -0.25 0.00 -0.36 0.00 0.00 55.97 55.44 2kui s LYS 557 Cb -0.21 -2.98 -0.24 0.00 -1.51 0.00 0.00 37.83 32.90 2kui s LYS 557 CO 0.24 0.61 1.02 0.78 -0.36 0.00 0.00 175.35 177.64 2kui h GLY 558 N 5.52 0.17 0.00 5.54 0.00 -1.59 0.28 103.07 113.00 2kui h GLY 558 Ca -0.48 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 46.55 2kui h GLY 558 CO 0.59 0.27 0.00 -2.01 0.00 0.00 0.00 176.54 175.39 2kui n ASN 559 N -4.52 0.00 -3.90 0.19 5.15 -1.26 -4.03 115.26 106.88 2kui n ASN 559 Ca -0.10 0.00 -0.12 0.00 -0.60 0.00 0.00 54.58 53.76 2kui n ASN 559 Cb 0.50 -1.64 -0.14 0.00 -0.53 0.00 0.00 39.78 37.97 2kui n ASN 559 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 2kui s GLN 560 N -0.23 0.11 0.03 1.20 2.00 -1.26 -0.63 119.66 120.87 2kui s GLN 560 Ca 0.00 -0.11 -0.03 0.00 -2.00 0.00 0.00 55.36 53.23 2kui s GLN 560 Cb 0.00 -0.06 -0.02 0.00 0.80 0.00 0.00 33.01 33.74 2kui s GLN 560 CO 0.00 0.01 0.03 -0.59 -0.50 0.00 0.00 175.29 174.24 2kui s PHE 561 N -0.20 0.26 -0.14 1.67 -0.71 0.76 -4.87 117.98 114.75 2kui s PHE 561 Ca -0.02 -0.56 -0.29 0.00 -1.04 0.00 0.00 56.93 55.02 2kui s PHE 561 Cb -0.02 -0.19 -0.04 0.00 -1.21 0.00 0.00 43.02 41.57 2kui s PHE 561 CO -0.00 -0.29 1.56 0.08 -1.34 0.00 0.00 175.22 175.23 2kui s VAL 562 N -2.24 3.76 -0.01 -2.49 1.01 -1.26 -0.08 120.40 119.09 2kui s VAL 562 Ca -0.08 0.90 -0.21 0.00 0.00 0.00 0.00 61.98 62.59 2kui s VAL 562 Cb -0.04 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 2kui s VAL 562 CO -0.03 -0.16 0.60 -0.32 0.00 0.00 0.00 175.10 175.18 2kui s MET 563 N 4.16 4.32 0.88 2.72 1.75 -1.05 -4.89 119.30 127.19 2kui s MET 563 Ca 0.69 0.73 -0.11 0.00 -1.25 0.00 0.00 55.69 55.75 2kui s MET 563 Cb -0.28 -3.35 0.12 0.00 2.84 0.00 0.00 34.83 34.16 2kui s MET 563 CO 0.26 0.34 1.10 -2.14 -0.65 0.00 0.00 175.02 173.93 2kui s PRO 564 N -0.08 1.36 0.05 4.11 0.02 -1.26 -0.60 135.00 138.60 2kui s PRO 564 Ca 0.31 1.19 -0.29 0.00 0.02 0.00 0.00 61.00 62.23 2kui s PRO 564 Cb -0.18 -1.79 -0.05 0.00 0.02 0.00 0.00 34.50 32.50 2kui s PRO 564 CO 0.17 -2.28 0.93 0.34 -0.33 0.00 0.00 177.00 175.83 2kui s ASP 565 N -3.09 7.39 -0.01 2.53 2.15 -1.26 -4.75 116.67 119.63 2kui s ASP 565 Ca 0.64 1.67 0.02 0.00 0.43 0.00 0.00 52.55 55.31 2kui s ASP 565 Cb -0.20 -2.56 0.02 0.00 -0.30 0.00 0.00 42.92 39.89 2kui s ASP 565 CO 0.58 -0.13 0.98 -0.11 -0.17 0.00 0.00 175.17 176.32 2kui n LEU 566 N 3.25 0.21 -4.72 -1.34 7.94 -1.26 -5.08 117.00 116.00 2kui n LEU 566 Ca 0.03 -1.12 -0.42 0.00 -1.11 0.00 0.00 56.01 53.39 2kui n LEU 566 Cb 0.50 -0.04 -0.03 0.00 0.53 0.00 0.00 43.42 44.38 2kui n LEU 566 CO 0.51 0.27 0.89 -0.44 -1.11 0.00 0.00 177.39 177.51 2kui s SER 567 N -1.09 7.08 0.00 1.96 0.01 -1.26 -3.00 113.70 117.39 2kui s SER 567 Ca 0.03 2.08 0.00 0.00 1.31 0.00 0.00 55.95 59.37 2kui s SER 567 Cb 0.02 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.67 2kui s SER 567 CO 0.00 -0.44 0.00 0.61 0.41 0.00 0.00 173.24 173.82 2kui n GLY 568 N 2.96 0.29 3.89 3.44 0.00 -1.24 -4.98 105.19 109.55 2kui n GLY 568 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.84 3.70 0.29 1.61 1.00 -1.16 -4.52 119.30 119.38 2kui s MET 569 Ca 0.00 0.16 -0.29 0.00 0.00 0.00 0.00 55.69 55.56 2kui s MET 569 Cb 0.00 -2.60 -0.10 0.00 0.00 0.00 0.00 34.83 32.14 2kui s MET 569 CO 0.00 0.19 1.13 -0.06 0.00 0.00 0.00 175.02 176.28 2kui s PHE 570 N -2.08 3.49 0.05 -0.03 0.08 -1.26 -1.65 117.98 116.58 2kui s PHE 570 Ca 0.46 1.66 0.32 0.00 0.12 0.00 0.00 56.93 59.49 2kui s PHE 570 Cb -0.11 -3.34 1.51 0.00 -0.57 0.00 0.00 43.02 40.52 2kui s PHE 570 CO 0.28 -0.75 1.97 2.35 -0.10 0.00 0.00 175.22 178.97 2kui h TRP 571 N 3.69 0.00 0.00 0.36 7.01 -0.36 0.33 115.95 126.97 2kui h TRP 571 Ca -0.47 0.00 -0.08 0.00 2.11 0.00 0.00 58.89 60.45 2kui h TRP 571 Cb 1.21 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 28.26 2kui h TRP 571 CO 0.58 0.00 -0.38 -0.39 -2.79 0.00 0.00 178.44 175.46 2kui h VAL 572 N 0.00 0.69 0.00 2.65 -1.51 -1.91 -2.38 116.25 113.79 2kui h VAL 572 Ca 0.00 -1.82 -0.28 0.00 -1.23 0.00 0.00 66.70 63.36 2kui h VAL 572 Cb 0.27 2.22 -0.05 0.00 -2.13 0.00 0.00 31.29 31.60 2kui h VAL 572 CO 0.00 0.37 -2.23 -0.67 -1.23 0.00 0.00 177.57 173.81 2kui n ASP 573 N -3.25 0.36 0.10 4.19 2.03 -0.33 -4.27 116.55 115.37 2kui n ASP 573 Ca 0.02 0.00 0.01 0.00 0.52 0.00 0.00 54.79 55.33 2kui n ASP 573 Cb 0.64 1.13 0.32 0.00 -0.72 0.00 0.00 41.12 42.50 2kui n ASP 573 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kui h ALA 574 N 1.09 1.36 0.19 -1.67 0.00 -0.42 -2.62 119.26 117.18 2kui h ALA 574 Ca -0.42 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.21 2kui h ALA 574 Cb 1.95 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.63 2kui h ALA 574 CO 0.02 0.44 -0.18 1.49 0.00 0.00 0.00 179.25 181.02 2kui h GLU 575 N 0.24 -0.39 -0.69 0.00 4.57 -1.61 0.80 114.58 117.51 2kui h GLU 575 Ca 0.04 0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.26 2kui h GLU 575 Cb 0.53 0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 29.17 2kui h GLU 575 CO 0.04 -0.26 0.45 -1.35 -1.18 0.00 0.00 179.01 176.71 2kui h PRO 576 N -0.40 0.86 -0.54 0.92 0.11 -1.75 -2.96 132.00 128.23 2kui h PRO 576 Ca 0.00 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.07 2kui h PRO 576 Cb 0.38 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.26 2kui h PRO 576 CO -0.04 0.57 0.36 0.00 -0.21 0.00 0.00 178.00 178.67 2kui h ARG 577 N 0.89 0.70 -0.64 1.05 2.47 -1.00 -1.92 114.38 115.93 2kui h ARG 577 Ca 0.26 -0.04 -0.08 0.00 -1.26 0.00 0.00 59.98 58.86 2kui h ARG 577 Cb -0.04 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.09 2kui h ARG 577 CO -0.06 0.47 0.08 1.37 0.56 0.00 0.00 179.97 182.38 2kui h LEU 578 N 0.72 1.03 -1.01 3.04 8.10 -0.70 0.43 115.31 126.92 2kui h LEU 578 Ca 0.20 -0.27 -0.08 0.00 0.11 0.00 0.00 57.88 57.84 2kui h LEU 578 Cb -0.07 -0.27 -0.02 0.00 -0.44 0.00 0.00 40.66 39.86 2kui h LEU 578 CO -0.05 1.04 -0.10 0.03 -4.11 0.00 0.00 178.44 175.25 2kui h ARG 579 N 0.98 0.60 -0.32 0.17 3.08 -1.42 0.47 114.38 117.94 2kui h ARG 579 Ca 0.19 -0.18 -0.17 0.00 0.07 0.00 0.00 59.98 59.90 2kui h ARG 579 Cb 0.47 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.45 2kui h ARG 579 CO 0.02 0.69 -0.45 0.00 -1.07 0.00 0.00 179.97 179.16 2kui h ALA 580 N 1.34 0.59 -0.00 0.04 0.00 -0.66 -3.09 119.26 117.47 2kui h ALA 580 Ca 0.10 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2kui h ALA 580 Cb 0.51 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2kui h ALA 580 CO 0.03 0.68 -0.11 1.28 0.00 0.00 0.00 179.25 181.13 2kui n LEU 581 N -4.03 0.23 -1.35 0.00 4.77 0.08 -4.91 117.00 111.79 2kui n LEU 581 Ca -0.03 0.21 -0.07 0.00 -0.03 0.00 0.00 56.01 56.10 2kui n LEU 581 Cb 0.57 -0.31 0.02 0.00 -2.33 0.00 0.00 43.42 41.38 2kui n LEU 581 CO 0.49 0.05 0.06 0.61 -1.33 0.00 0.00 177.39 177.27 2kui n GLY 582 N 1.38 0.51 3.70 -0.72 0.00 -0.64 -4.97 105.19 104.45 2kui n GLY 582 Ca 0.11 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 2kui n GLY 582 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2kui s TRP 583 N -3.05 2.87 -0.32 1.61 -0.00 0.06 -4.87 118.94 115.24 2kui s TRP 583 Ca 0.16 0.69 0.04 0.00 -0.00 0.00 0.00 56.10 56.99 2kui s TRP 583 Cb -0.07 -3.79 0.11 0.00 -0.00 0.00 0.00 33.47 29.73 2kui s TRP 583 CO 0.20 -2.96 1.09 2.41 -0.00 0.00 0.00 176.95 177.69 2kui n THR 584 N 4.39 1.03 -1.74 5.86 -1.04 -1.22 -4.86 114.28 116.70 2kui n THR 584 Ca 0.13 -1.03 -0.30 0.00 -2.04 0.00 0.00 64.05 60.81 2kui n THR 584 Cb 0.42 0.48 0.19 0.00 -1.82 0.00 0.00 70.33 69.60 2kui n THR 584 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2kui s GLY 585 N -1.05 1.73 -0.09 3.41 0.00 -0.07 -4.85 107.32 106.39 2kui s GLY 585 Ca 0.09 -1.11 -0.04 0.00 0.00 0.00 0.00 44.72 43.67 2kui s GLY 585 CO 0.05 -0.33 0.06 -0.29 0.00 0.00 0.00 173.10 172.59 2kui s MET 586 N -5.76 3.15 -0.00 2.90 -2.45 -1.26 -4.91 119.30 110.97 2kui s MET 586 Ca 0.73 -0.31 -0.29 0.00 -1.25 0.00 0.00 55.69 54.56 2kui s MET 586 Cb -0.06 -2.94 -0.03 0.00 1.25 0.00 0.00 34.83 33.05 2kui s MET 586 CO 0.53 0.73 0.95 -1.17 1.05 0.00 0.00 175.02 177.12 2kui s LEU 587 N -0.99 4.37 -0.56 4.11 1.98 -1.26 -4.00 118.68 122.34 2kui s LEU 587 Ca 0.14 1.63 -0.19 0.00 -2.89 0.00 0.00 54.13 52.82 2kui s LEU 587 Cb -0.12 -3.53 0.09 0.00 0.66 0.00 0.00 46.19 43.29 2kui s LEU 587 CO 0.04 -0.24 0.66 -0.62 -1.89 0.00 0.00 176.35 174.29 2kui s ASP 588 N 0.94 6.19 -0.45 3.68 2.15 -1.26 -5.00 116.67 122.93 2kui s ASP 588 Ca 0.50 -1.27 -0.23 0.00 0.43 0.00 0.00 52.55 51.98 2kui s ASP 588 Cb -0.21 -2.29 0.03 0.00 -0.30 0.00 0.00 42.92 40.15 2kui s ASP 588 CO 0.27 -1.01 0.79 -0.75 -0.17 0.00 0.00 175.17 174.30 2kui s LYS 589 N 2.57 3.42 0.00 4.34 2.47 -1.26 -4.63 119.74 126.65 2kui s LYS 589 Ca 0.12 -0.09 0.00 0.00 -1.56 0.00 0.00 55.97 54.44 2kui s LYS 589 Cb -0.23 -3.93 0.00 0.00 -1.46 0.00 0.00 37.83 32.21 2kui s LYS 589 CO 0.08 -1.11 0.00 0.41 0.16 0.00 0.00 175.35 174.89 2kui n GLY 590 N 4.97 0.28 2.97 5.54 0.00 -1.26 -5.11 105.19 112.58 2kui n GLY 590 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.67 0.19 0.07 4.61 0.00 -1.26 -5.14 121.76 117.55 2kui s ALA 591 Ca 0.00 -0.51 -0.17 0.00 0.00 0.00 0.00 51.96 51.29 2kui s ALA 591 Cb 0.00 0.10 -0.06 0.00 0.00 0.00 0.00 23.12 23.15 2kui s ALA 591 CO 0.00 -0.10 0.52 -0.51 0.00 0.00 0.00 175.76 175.67 2kui s ASP 592 N -1.19 6.93 -0.23 0.00 1.11 -1.26 -4.76 116.67 117.27 2kui s ASP 592 Ca -0.12 1.12 -0.06 0.00 0.18 0.00 0.00 52.55 53.67 2kui s ASP 592 Cb -0.08 -2.31 -0.03 0.00 1.07 0.00 0.00 42.92 41.58 2kui s ASP 592 CO -0.01 0.24 0.04 -0.69 1.18 0.00 0.00 175.17 175.93 2kui s VAL 593 N -1.20 4.11 -0.51 -1.27 1.01 -1.06 -4.88 120.40 116.60 2kui s VAL 593 Ca 0.30 -0.25 -0.24 0.00 0.00 0.00 0.00 61.98 61.79 2kui s VAL 593 Cb -0.17 -2.90 0.04 0.00 0.00 0.00 0.00 36.38 33.34 2kui s VAL 593 CO 0.18 0.38 0.90 -0.62 0.00 0.00 0.00 175.10 175.94 2kui s ASP 594 N 1.38 6.39 0.00 3.32 2.15 -1.26 -0.03 116.67 128.61 2kui s ASP 594 Ca 0.05 -0.21 0.03 0.00 0.43 0.00 0.00 52.55 52.85 2kui s ASP 594 Cb -0.15 -2.43 0.06 0.00 -0.30 0.00 0.00 42.92 40.10 2kui s ASP 594 CO 0.02 -1.13 0.84 0.00 -0.17 0.00 0.00 175.17 174.73 2kui n ALA 595 N 7.24 2.29 -0.60 3.66 0.00 -1.26 -4.97 120.51 126.86 2kui n ALA 595 Ca 0.03 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.70 2kui n ALA 595 Cb 0.48 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 19.60 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 0.07 -0.18 0.27 0.00 0.00 -1.26 -4.70 105.19 99.38 2kui n GLY 596 Ca -0.03 -0.46 -0.01 0.00 0.00 0.00 0.00 46.02 45.52 2kui n GLY 596 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2kui h GLY 597 N 0.00 1.03 1.86 -0.02 0.00 -1.83 0.17 103.07 104.27 2kui h GLY 597 Ca 0.00 -0.26 0.02 0.00 0.00 0.00 0.00 47.33 47.09 2kui h GLY 597 CO 0.00 0.14 0.05 1.76 0.00 0.00 0.00 176.54 178.49 2kui h SER 598 N 0.68 0.00 0.00 0.19 0.02 -1.90 0.16 113.55 112.70 2kui h SER 598 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2kui h SER 598 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2kui h SER 598 CO -0.21 0.00 -0.92 0.00 -1.14 0.00 0.00 176.83 174.57 2kui n GLN 599 N -4.33 1.89 -0.47 3.45 1.13 -0.63 -4.59 117.38 113.84 2kui n GLN 599 Ca -0.01 -0.03 0.05 0.00 -1.94 0.00 0.00 57.00 55.06 2kui n GLN 599 Cb 0.16 -1.21 0.08 0.00 0.11 0.00 0.00 30.24 29.38 2kui n GLN 599 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2kui n HIS 600 N -1.50 0.00 -0.12 1.08 8.25 0.50 -4.78 115.22 118.65 2kui n HIS 600 Ca 0.01 -0.58 0.00 0.00 -0.26 0.00 0.00 57.72 56.89 2kui n HIS 600 Cb 0.26 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.25 2kui n HIS 600 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2kui n ASN 601 N -0.58 4.16 -4.46 0.41 0.23 0.51 0.36 115.26 115.90 2kui n ASN 601 Ca 0.09 -2.11 -0.22 0.00 -0.53 0.00 0.00 54.58 51.80 2kui n ASN 601 Cb 0.73 -0.85 -0.10 0.00 -2.08 0.00 0.00 39.78 37.47 2kui n ASN 601 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2kui s ARG 602 N 0.23 1.63 0.17 -3.83 1.70 -1.26 0.43 118.95 118.01 2kui s ARG 602 Ca 0.00 -1.85 -0.32 0.00 -0.47 0.00 0.00 55.73 53.09 2kui s ARG 602 Cb 0.00 -1.16 -0.10 0.00 -0.57 0.00 0.00 34.95 33.12 2kui s ARG 602 CO 0.00 -0.02 1.60 0.08 -1.08 0.00 0.00 175.30 175.88 2kui s VAL 603 N -3.03 2.51 -0.21 4.99 1.01 -0.66 -4.25 120.40 120.76 2kui s VAL 603 Ca 0.32 0.36 -0.10 0.00 0.00 0.00 0.00 61.98 62.55 2kui s VAL 603 Cb 0.05 -3.23 -0.19 0.00 0.00 0.00 0.00 36.38 33.02 2kui s VAL 603 CO 0.14 0.03 0.02 1.33 0.00 0.00 0.00 175.10 176.61 2kui n VAL 604 N 4.00 1.59 -4.28 2.92 0.24 -0.69 -3.66 118.33 118.45 2kui n VAL 604 Ca 0.14 -0.41 -0.19 0.00 -2.04 0.00 0.00 64.34 61.85 2kui n VAL 604 Cb 0.38 -1.78 -0.13 0.00 -1.47 0.00 0.00 33.84 30.84 2kui n VAL 604 CO 0.00 0.00 0.00 -0.72 -2.14 0.00 0.00 176.83 173.97 2kui s TYR 605 N -2.49 1.13 -0.10 6.34 1.13 -1.26 -4.92 117.35 117.18 2kui s TYR 605 Ca -0.31 -0.37 0.04 0.00 -1.41 0.00 0.00 57.07 55.02 2kui s TYR 605 Cb 0.09 -0.67 0.00 0.00 -1.10 0.00 0.00 41.96 40.28 2kui s TYR 605 CO 0.62 0.03 -0.23 -1.14 -2.51 0.00 0.00 175.55 172.31 2kui s GLN 606 N -1.23 2.97 0.00 -3.49 -0.44 -1.26 -4.35 119.66 111.85 2kui s GLN 606 Ca -0.00 -0.85 0.00 0.00 -2.50 0.00 0.00 55.36 52.01 2kui s GLN 606 Cb -0.08 -2.27 0.00 0.00 -1.64 0.00 0.00 33.01 29.02 2kui s GLN 606 CO 0.01 0.15 0.00 -1.71 0.50 0.00 0.00 175.29 174.24 2kui n ASN 607 N 3.61 0.00 -4.63 6.67 5.15 -1.19 -4.80 115.26 120.07 2kui n ASN 607 Ca -0.19 0.31 -0.43 0.00 -0.60 0.00 0.00 54.58 53.67 2kui n ASN 607 Cb 0.53 -0.41 -0.02 0.00 -0.53 0.00 0.00 39.78 39.34 2kui n ASN 607 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 2kui s PRO 608 N -0.82 3.91 0.28 1.20 0.02 -1.26 -4.96 135.00 133.35 2kui s PRO 608 Ca 0.00 1.21 -0.30 0.00 0.02 0.00 0.00 61.00 61.93 2kui s PRO 608 Cb 0.00 -3.88 -0.11 0.00 0.02 0.00 0.00 34.50 30.54 2kui s PRO 608 CO 0.00 -1.13 1.50 -2.14 -0.33 0.00 0.00 177.00 174.89 2kui s PRO 609 N 4.18 4.21 0.30 5.54 0.02 -1.26 -4.96 135.00 143.02 2kui s PRO 609 Ca 0.56 2.42 -0.29 0.00 0.02 0.00 0.00 61.00 63.70 2kui s PRO 609 Cb -0.16 -3.07 -0.10 0.00 0.02 0.00 0.00 34.50 31.19 2kui s PRO 609 CO 0.23 -0.50 1.30 0.00 -0.33 0.00 0.00 177.00 177.71 2kui s ALA 610 N -0.12 3.51 0.00 -1.55 0.00 -1.26 -2.00 121.76 120.33 2kui s ALA 610 Ca 0.60 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.77 2kui s ALA 610 Cb -0.44 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.20 2kui s ALA 610 CO 0.47 -0.59 0.00 0.41 0.00 0.00 0.00 175.76 176.05 2kui n GLY 611 N 1.20 3.24 3.97 0.00 0.00 0.23 -4.96 105.19 108.88 2kui n GLY 611 Ca 0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 2kui n GLY 611 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kui s THR 612 N -2.44 4.59 -0.24 2.61 2.01 -0.85 -4.75 115.64 116.57 2kui s THR 612 Ca 0.00 -0.88 -0.29 0.00 0.31 0.00 0.00 61.69 60.83 2kui s THR 612 Cb 0.00 -3.62 -0.01 0.00 0.01 0.00 0.00 72.50 68.88 2kui s THR 612 CO 0.00 -0.28 1.35 -0.83 -0.69 0.00 0.00 174.62 174.17 2kui s GLY 613 N -4.10 1.43 -0.02 4.40 0.00 -1.26 -2.54 107.32 105.24 2kui s GLY 613 Ca 0.41 0.28 -0.01 0.00 0.00 0.00 0.00 44.72 45.41 2kui s GLY 613 CO 0.32 2.65 0.06 -1.34 0.00 0.00 0.00 173.10 174.79 2kui s VAL 614 N 4.27 4.64 0.52 1.40 -7.23 0.89 -4.75 120.40 120.14 2kui s VAL 614 Ca 0.59 -0.39 -0.19 0.00 -1.81 0.00 0.00 61.98 60.17 2kui s VAL 614 Cb -0.20 -3.09 -0.10 0.00 0.56 0.00 0.00 36.38 33.55 2kui s VAL 614 CO 0.22 0.39 0.54 -0.46 -0.31 0.00 0.00 175.10 175.49 2kui n ASN 615 N 1.35 -0.93 0.20 4.85 0.23 -1.26 -0.17 115.26 119.53 2kui n ASN 615 Ca -0.14 0.79 0.18 0.00 -0.53 0.00 0.00 54.58 54.88 2kui n ASN 615 Cb 0.53 -1.16 0.83 0.00 -2.08 0.00 0.00 39.78 37.90 2kui n ASN 615 CO 0.00 0.00 0.00 0.08 -0.93 0.00 0.00 177.26 176.41 2kui h ARG 616 N 0.45 0.00 0.30 -3.83 0.11 -1.21 0.42 114.38 110.62 2kui h ARG 616 Ca -0.44 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.62 2kui h ARG 616 Cb 1.40 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.48 2kui h ARG 616 CO 0.49 0.00 -0.15 0.22 0.10 0.00 0.00 179.97 180.63 2kui h ASP 617 N 0.00 -0.35 0.00 0.08 3.58 -1.88 -3.45 116.42 114.40 2kui h ASP 617 Ca 0.10 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.51 2kui h ASP 617 Cb 0.65 0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.79 2kui h ASP 617 CO -0.00 -0.18 0.00 0.61 -2.88 0.00 0.00 179.24 176.79 2kui n GLY 618 N -1.06 0.89 3.66 -0.78 0.00 0.14 -0.90 105.19 107.15 2kui n GLY 618 Ca -0.10 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 2kui n GLY 618 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2kui s ILE 619 N -2.00 3.77 -0.12 -0.61 -1.16 -1.26 -4.54 121.20 115.27 2kui s ILE 619 Ca 0.00 0.93 0.01 0.00 -0.51 0.00 0.00 60.65 61.08 2kui s ILE 619 Cb 0.00 -3.60 -0.01 0.00 0.61 0.00 0.00 42.46 39.46 2kui s ILE 619 CO 0.00 -0.09 -0.15 -0.51 -2.81 0.00 0.00 174.94 171.38 2kui s ILE 620 N 3.91 2.85 -0.30 2.00 -1.16 -1.26 -4.81 121.20 122.44 2kui s ILE 620 Ca 0.68 -0.74 -0.13 0.00 -0.51 0.00 0.00 60.65 59.95 2kui s ILE 620 Cb -0.30 -2.18 -0.03 0.00 0.61 0.00 0.00 42.46 40.56 2kui s ILE 620 CO 0.26 0.53 0.29 -0.89 -2.81 0.00 0.00 174.94 172.31 2kui s THR 621 N 0.31 5.24 0.06 4.00 2.01 -1.26 -4.11 115.64 121.88 2kui s THR 621 Ca -0.12 0.17 -0.00 0.00 0.31 0.00 0.00 61.69 62.05 2kui s THR 621 Cb -0.16 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 2kui s THR 621 CO 0.06 0.10 -0.04 -1.48 -0.69 0.00 0.00 174.62 172.57 2kui s LEU 622 N 1.89 2.44 0.02 4.42 2.34 -1.26 -3.16 118.68 125.36 2kui s LEU 622 Ca 0.10 -0.89 0.05 0.00 0.06 0.00 0.00 54.13 53.45 2kui s LEU 622 Cb -0.16 0.10 -0.02 0.00 -0.56 0.00 0.00 46.19 45.55 2kui s LEU 622 CO 0.11 -0.49 -0.14 -0.13 -1.06 0.00 0.00 176.35 174.63 2kui s ARG 623 N -3.34 1.03 0.13 1.48 3.00 -1.26 -4.85 118.95 115.14 2kui s ARG 623 Ca 0.03 -0.64 -0.02 0.00 0.00 0.00 0.00 55.73 55.10 2kui s ARG 623 Cb 0.03 -1.02 -0.03 0.00 0.00 0.00 0.00 34.95 33.93 2kui s ARG 623 CO -0.07 0.27 0.09 -0.59 0.00 0.00 0.00 175.30 175.00 2kui s PHE 624 N -0.60 0.78 0.31 -0.53 -0.71 -1.26 -1.71 117.98 114.26 2kui s PHE 624 Ca 0.03 -1.16 -0.29 0.00 -1.04 0.00 0.00 56.93 54.48 2kui s PHE 624 Cb -0.07 -0.41 -0.10 0.00 -1.21 0.00 0.00 43.02 41.23 2kui s PHE 624 CO 0.00 -0.55 1.34 0.20 -1.34 0.00 0.00 175.22 174.87 2kui s GLY 625 N -3.03 2.84 0.00 1.99 0.00 0.16 -2.56 107.32 106.72 2kui s GLY 625 Ca 0.23 1.28 0.30 0.00 0.00 0.00 0.00 44.72 46.52 2kui s GLY 625 CO 0.01 2.00 1.98 -0.18 0.00 0.00 0.00 173.10 176.92