#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 4.29 0.33 -0.61 1.10 -1.26 -5.02 121.20 120.03 2kui s ILE 356 Ca 0.00 1.55 -0.14 0.00 -0.51 0.00 0.00 60.65 61.55 2kui s ILE 356 Cb 0.00 -4.02 -0.08 0.00 0.15 0.00 0.00 42.46 38.51 2kui s ILE 356 CO 0.00 -0.16 0.72 -0.89 -2.11 0.00 0.00 174.94 172.50 2kui s THR 357 N 3.55 4.72 -0.45 4.00 2.01 -1.26 -4.96 115.64 123.25 2kui s THR 357 Ca 0.54 0.86 -0.02 0.00 0.31 0.00 0.00 61.69 63.38 2kui s THR 357 Cb -0.21 -3.63 0.24 0.00 0.01 0.00 0.00 72.50 68.91 2kui s THR 357 CO 0.15 -0.22 2.19 0.54 -0.69 0.00 0.00 174.62 176.59 2kui n ARG 358 N -0.48 2.17 -2.59 4.92 5.12 -1.26 -4.91 116.66 119.63 2kui n ARG 358 Ca 0.03 -2.21 -0.35 0.00 -1.93 0.00 0.00 57.85 53.40 2kui n ARG 358 Cb 0.53 -1.91 -0.04 0.00 -1.16 0.00 0.00 32.46 29.88 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 -0.27 6.62 0.16 0.55 1.01 -1.26 -4.71 116.67 118.77 2kui s ASP 359 Ca 0.45 1.93 0.11 0.00 0.71 0.00 0.00 52.55 55.76 2kui s ASP 359 Cb 0.34 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.66 2kui s ASP 359 CO -0.08 -0.59 -0.25 0.68 0.21 0.00 0.00 175.17 175.15 2kui s VAL 360 N -1.87 2.37 -0.08 -1.27 -7.23 0.85 -4.79 120.40 108.38 2kui s VAL 360 Ca 0.62 -1.85 -0.14 0.00 -1.81 0.00 0.00 61.98 58.81 2kui s VAL 360 Cb -0.18 -2.09 -0.05 0.00 0.56 0.00 0.00 36.38 34.63 2kui s VAL 360 CO 0.22 0.00 0.34 -1.58 -0.31 0.00 0.00 175.10 173.77 2kui s GLN 361 N -2.34 3.99 -0.15 4.82 0.74 -1.26 -0.23 119.66 125.23 2kui s GLN 361 Ca 0.17 0.23 -0.12 0.00 0.05 0.00 0.00 55.36 55.70 2kui s GLN 361 Cb -0.09 -3.30 -0.05 0.00 1.10 0.00 0.00 33.01 30.67 2kui s GLN 361 CO 0.08 0.51 0.24 0.08 -0.55 0.00 0.00 175.29 175.65 2kui s VAL 362 N -0.41 5.34 0.22 1.34 1.01 0.09 -4.99 120.40 123.00 2kui s VAL 362 Ca 0.20 0.44 -0.30 0.00 0.00 0.00 0.00 61.98 62.32 2kui s VAL 362 Cb -0.15 -3.57 -0.10 0.00 0.00 0.00 0.00 36.38 32.57 2kui s VAL 362 CO 0.09 0.44 1.42 -2.84 0.00 0.00 0.00 175.10 174.21 2kui s PRO 363 N 0.14 4.30 -0.04 2.72 0.02 -1.26 -4.18 135.00 136.68 2kui s PRO 363 Ca 0.15 2.23 -0.04 0.00 0.02 0.00 0.00 61.00 63.36 2kui s PRO 363 Cb -0.13 -3.14 -0.04 0.00 0.02 0.00 0.00 34.50 31.21 2kui s PRO 363 CO 0.03 -0.40 0.16 0.16 -0.33 0.00 0.00 177.00 176.62 2kui s ASP 364 N 0.48 6.30 -0.17 2.53 1.47 -1.26 -4.94 116.67 121.08 2kui s ASP 364 Ca 0.60 0.36 0.14 0.00 1.18 0.00 0.00 52.55 54.83 2kui s ASP 364 Cb -0.40 -1.98 0.39 0.00 -0.34 0.00 0.00 42.92 40.59 2kui s ASP 364 CO 0.40 0.31 1.20 0.52 0.68 0.00 0.00 175.17 178.27 2kui n VAL 365 N 1.29 1.82 -1.81 2.11 0.31 -1.26 -5.06 118.33 115.73 2kui n VAL 365 Ca -0.14 -2.73 -0.39 0.00 -0.01 0.00 0.00 64.34 61.07 2kui n VAL 365 Cb 0.53 -0.06 0.02 0.00 -0.91 0.00 0.00 33.84 33.42 2kui n VAL 365 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2kui s ARG 366 N -2.68 3.54 0.00 5.55 1.70 -1.26 -2.98 118.95 122.81 2kui s ARG 366 Ca 0.36 2.34 0.00 0.00 -0.47 0.00 0.00 55.73 57.96 2kui s ARG 366 Cb 0.35 -2.54 0.00 0.00 -0.57 0.00 0.00 34.95 32.19 2kui s ARG 366 CO -0.07 -0.91 0.00 0.41 -1.08 0.00 0.00 175.30 173.66 2kui n GLY 367 N 0.62 1.43 0.00 3.88 0.00 0.14 -4.95 105.19 106.31 2kui n GLY 367 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.69 0.00 -3.57 1.61 6.02 -1.16 -4.93 117.38 113.66 2kui n GLN 368 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.88 2kui n GLN 368 Cb 0.00 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.23 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 -0.48 -0.36 0.34 1.08 1.04 -1.26 -4.31 113.70 109.75 2kui s SER 369 Ca 0.00 -0.22 0.04 0.00 0.48 0.00 0.00 55.95 56.25 2kui s SER 369 Cb 0.00 0.54 0.61 0.00 0.10 0.00 0.00 66.02 67.26 2kui s SER 369 CO 0.00 -0.93 1.89 0.77 0.98 0.00 0.00 173.24 175.95 2kui h SER 370 N 2.21 0.52 -0.32 7.02 4.64 -1.83 -1.51 113.55 124.28 2kui h SER 370 Ca -0.33 -0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 60.89 2kui h SER 370 Cb 1.28 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 2kui h SER 370 CO 0.42 0.56 0.16 0.00 -0.87 0.00 0.00 176.83 177.10 2kui h ALA 371 N 1.51 0.41 -0.62 5.18 0.00 -1.95 0.31 119.26 124.11 2kui h ALA 371 Ca 0.12 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2kui h ALA 371 Cb 0.28 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2kui h ALA 371 CO 0.00 -0.04 0.20 -0.44 0.00 0.00 0.00 179.25 178.97 2kui h ASP 372 N 0.39 0.89 -0.21 0.00 3.32 -1.88 0.17 116.42 119.10 2kui h ASP 372 Ca 0.11 -0.20 -0.06 0.00 0.02 0.00 0.00 57.03 56.90 2kui h ASP 372 Cb 0.10 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 2kui h ASP 372 CO -0.02 0.86 -0.10 0.00 -1.72 0.00 0.00 179.24 178.26 2kui h ALA 373 N 1.07 0.30 -0.35 3.45 0.00 -0.92 -2.30 119.26 120.50 2kui h ALA 373 Ca 0.20 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2kui h ALA 373 Cb 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2kui h ALA 373 CO -0.01 0.14 0.02 0.82 0.00 0.00 0.00 179.25 180.22 2kui h ILE 374 N 0.15 1.25 -0.64 0.00 2.04 -0.29 -2.56 117.51 117.47 2kui h ILE 374 Ca 0.05 -0.93 0.02 0.00 1.00 0.00 0.00 64.86 65.00 2kui h ILE 374 Cb 0.59 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 37.80 2kui h ILE 374 CO 0.03 0.31 0.40 0.00 0.00 0.00 0.00 178.15 178.89 2kui h ALA 375 N 0.88 0.83 -0.11 1.87 0.00 -0.63 0.31 119.26 122.40 2kui h ALA 375 Ca 0.10 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2kui h ALA 375 Cb 0.43 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2kui h ALA 375 CO 0.01 0.16 0.03 1.15 0.00 0.00 0.00 179.25 180.61 2kui h THR 376 N 0.79 1.19 -0.54 0.00 2.02 -1.36 -1.12 112.91 113.89 2kui h THR 376 Ca 0.25 -0.57 -0.08 0.00 0.77 0.00 0.00 66.41 66.78 2kui h THR 376 Cb -0.00 1.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 2kui h THR 376 CO -0.09 0.17 0.03 -0.07 0.37 0.00 0.00 175.52 175.93 2kui h LEU 377 N -0.01 0.86 -0.72 2.58 4.07 -1.09 -2.13 115.31 118.86 2kui h LEU 377 Ca 0.04 -0.21 -0.01 0.00 0.08 0.00 0.00 57.88 57.78 2kui h LEU 377 Cb 0.23 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 2kui h LEU 377 CO -0.00 0.90 0.42 -0.61 -1.08 0.00 0.00 178.44 178.07 2kui h GLN 378 N 0.83 0.98 0.00 1.13 5.75 -0.22 0.10 115.11 123.69 2kui h GLN 378 Ca 0.16 -0.10 -0.06 0.00 -0.15 0.00 0.00 58.65 58.51 2kui h GLN 378 Cb 0.45 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.79 2kui h GLN 378 CO 0.02 0.71 -0.26 -0.91 -2.65 0.00 0.00 178.83 175.73 2kui h ASN 379 N 0.98 0.00 1.00 -0.69 2.35 -0.81 -1.99 115.58 116.42 2kui h ASN 379 Ca 0.26 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.01 2kui h ASN 379 Cb -0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.36 2kui h ASN 379 CO -0.05 0.26 -0.45 0.54 -1.65 0.00 0.00 177.43 176.09 2kui n ARG 380 N -4.01 0.26 -0.47 0.81 5.12 -0.63 -4.94 116.66 112.79 2kui n ARG 380 Ca -0.02 0.11 0.00 0.00 -1.93 0.00 0.00 57.85 56.01 2kui n ARG 380 Cb 0.33 -1.70 0.00 0.00 -1.16 0.00 0.00 32.46 29.93 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 1.35 0.73 3.85 -0.13 0.00 0.11 -4.93 105.19 106.16 2kui n GLY 381 Ca 0.04 -0.32 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 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 3.37 -0.18 1.61 0.08 0.12 -4.68 117.98 116.30 2kui s PHE 382 Ca 0.00 1.27 -0.09 0.00 0.12 0.00 0.00 56.93 58.23 2kui s PHE 382 Cb 0.00 -2.86 -0.05 0.00 -0.57 0.00 0.00 43.02 39.54 2kui s PHE 382 CO 0.00 -1.02 0.12 0.15 -0.10 0.00 0.00 175.22 174.37 2kui s LYS 383 N -5.17 3.96 0.20 0.44 -0.14 -0.54 -4.49 119.74 113.99 2kui s LYS 383 Ca 0.57 -0.22 0.11 0.00 -1.36 0.00 0.00 55.97 55.06 2kui s LYS 383 Cb -0.12 -3.32 -0.04 0.00 -1.68 0.00 0.00 37.83 32.66 2kui s LYS 383 CO 0.54 0.41 -0.18 0.96 -0.76 0.00 0.00 175.35 176.32 2kui s ILE 384 N 0.03 2.66 -0.05 2.17 -0.00 -1.26 -1.25 121.20 123.50 2kui s ILE 384 Ca 0.09 -1.93 0.05 0.00 -0.00 0.00 0.00 60.65 58.85 2kui s ILE 384 Cb -0.11 -2.30 -0.00 0.00 -0.00 0.00 0.00 42.46 40.04 2kui s ILE 384 CO -0.00 -0.14 -0.18 -0.60 -0.00 0.00 0.00 174.94 174.01 2kui s ARG 385 N -2.80 1.92 -0.20 0.37 3.52 0.21 -4.84 118.95 117.12 2kui s ARG 385 Ca 0.23 -0.66 0.01 0.00 -0.13 0.00 0.00 55.73 55.18 2kui s ARG 385 Cb -0.08 -1.65 0.03 0.00 -1.56 0.00 0.00 34.95 31.68 2kui s ARG 385 CO 0.12 0.26 -0.16 0.99 -0.81 0.00 0.00 175.30 175.71 2kui s THR 386 N 0.01 2.24 -0.14 4.11 2.01 -1.26 0.06 115.64 122.67 2kui s THR 386 Ca -0.04 -1.06 0.01 0.00 0.31 0.00 0.00 61.69 60.91 2kui s THR 386 Cb -0.12 -2.04 -0.01 0.00 0.01 0.00 0.00 72.50 70.34 2kui s THR 386 CO 0.02 0.39 -0.16 -0.22 -0.69 0.00 0.00 174.62 173.97 2kui s LEU 387 N 1.27 2.51 0.07 4.42 1.98 0.54 -4.95 118.68 124.52 2kui s LEU 387 Ca 0.02 -0.43 0.07 0.00 -2.89 0.00 0.00 54.13 50.89 2kui s LEU 387 Cb -0.15 -1.56 -0.04 0.00 0.66 0.00 0.00 46.19 45.11 2kui s LEU 387 CO -0.10 0.12 -0.13 0.00 -1.89 0.00 0.00 176.35 174.35 2kui s GLN 388 N 0.60 2.12 -0.01 1.98 0.00 -1.26 -0.45 119.66 122.63 2kui s GLN 388 Ca -0.09 -0.99 0.01 0.00 -0.00 0.00 0.00 55.36 54.29 2kui s GLN 388 Cb -0.16 -2.27 0.00 0.00 0.00 0.00 0.00 33.01 30.59 2kui s GLN 388 CO 0.03 0.53 -0.04 0.15 0.00 0.00 0.00 175.29 175.96 2kui s LYS 389 N -1.83 0.41 0.48 9.60 1.02 -0.33 -4.93 119.74 124.17 2kui s LYS 389 Ca 0.18 -0.13 -0.21 0.00 0.02 0.00 0.00 55.97 55.83 2kui s LYS 389 Cb -0.11 -0.43 -0.08 0.00 -0.52 0.00 0.00 37.83 36.69 2kui s LYS 389 CO 0.09 0.05 1.09 -1.25 -0.92 0.00 0.00 175.35 174.41 2kui s PRO 390 N 0.15 3.73 -0.10 -1.68 0.04 -1.26 -1.05 135.00 134.83 2kui s PRO 390 Ca -0.01 1.53 -0.29 0.00 0.04 0.00 0.00 61.00 62.26 2kui s PRO 390 Cb -0.05 -2.20 -0.06 0.00 0.04 0.00 0.00 34.50 32.23 2kui s PRO 390 CO -0.00 -0.52 2.02 0.34 0.04 0.00 0.00 177.00 178.87 2kui s ASP 391 N -1.75 6.04 -0.40 6.66 2.15 0.32 -4.66 116.67 125.04 2kui s ASP 391 Ca 0.67 2.21 0.09 0.00 0.43 0.00 0.00 52.55 55.95 2kui s ASP 391 Cb -0.21 -2.52 0.29 0.00 -0.30 0.00 0.00 42.92 40.17 2kui s ASP 391 CO 0.26 -1.44 0.68 -1.54 -0.17 0.00 0.00 175.17 172.95 2kui n SER 392 N 9.32 -0.14 -0.29 -0.34 3.41 -1.26 -1.30 113.62 123.03 2kui n SER 392 Ca 0.24 -2.94 0.00 0.00 -0.26 0.00 0.00 58.87 55.90 2kui n SER 392 Cb 0.43 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 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 0.98 0.00 -4.36 6.66 -1.04 -1.26 -5.09 114.28 110.16 2kui n THR 393 Ca 0.20 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.91 2kui n THR 393 Cb 0.60 -0.89 -0.12 0.00 -1.82 0.00 0.00 70.33 68.10 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 -2.57 2.70 1.14 12.58 -4.36 -1.26 -5.14 121.20 124.29 2kui s ILE 394 Ca 0.00 -1.53 -0.19 0.00 -0.26 0.00 0.00 60.65 58.67 2kui s ILE 394 Cb 0.00 -2.22 0.27 0.00 1.25 0.00 0.00 42.46 41.76 2kui s ILE 394 CO 0.00 0.12 1.18 -2.16 0.24 0.00 0.00 174.94 174.32 2kui s PRO 395 N -2.05 -0.75 0.96 0.37 0.04 -1.26 -4.96 135.00 127.34 2kui s PRO 395 Ca 0.17 -0.22 -0.12 0.00 0.04 0.00 0.00 61.00 60.87 2kui s PRO 395 Cb -0.10 -1.67 0.10 0.00 0.04 0.00 0.00 34.50 32.87 2kui s PRO 395 CO 0.09 -3.37 0.72 -2.30 0.04 0.00 0.00 177.00 172.17 2kui n PRO 396 N -4.49 -0.57 0.00 0.56 -0.02 -1.26 -4.60 135.00 124.62 2kui n PRO 396 Ca 0.14 -0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 2kui n PRO 396 Cb 0.60 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 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 -2.75 0.00 -4.56 2.55 5.75 -1.26 -4.61 116.55 111.66 2kui n ASP 397 Ca 0.08 0.38 -0.29 0.00 -0.01 0.00 0.00 54.79 54.95 2kui n ASP 397 Cb 0.53 -0.38 0.16 0.00 -1.03 0.00 0.00 41.12 40.41 2kui n ASP 397 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 2kui s HIS 398 N -2.74 2.07 -0.29 2.11 3.76 -1.26 -4.07 115.29 114.86 2kui s HIS 398 Ca 0.00 0.75 -0.14 0.00 -0.15 0.00 0.00 55.06 55.52 2kui s HIS 398 Cb 0.00 -3.47 -0.03 0.00 1.11 0.00 0.00 32.58 30.19 2kui s HIS 398 CO 0.00 -2.68 0.32 0.14 -0.85 0.00 0.00 174.74 171.67 2kui s VAL 399 N -3.28 5.21 -0.13 -0.90 -7.23 -1.26 -4.65 120.40 108.16 2kui s VAL 399 Ca 0.66 0.31 0.12 0.00 -1.81 0.00 0.00 61.98 61.26 2kui s VAL 399 Cb -0.13 -3.68 -0.24 0.00 0.56 0.00 0.00 36.38 32.89 2kui s VAL 399 CO 0.54 0.11 0.32 -0.38 -0.31 0.00 0.00 175.10 175.38 2kui n ILE 400 N 5.13 1.53 -4.09 -0.62 -0.00 -1.26 0.26 119.36 120.32 2kui n ILE 400 Ca -0.10 -0.78 -0.11 0.00 -0.00 0.00 0.00 62.75 61.76 2kui n ILE 400 Cb 0.51 -0.93 -0.07 0.00 -0.00 0.00 0.00 39.64 39.15 2kui n ILE 400 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 2kui s GLY 401 N -5.44 0.98 0.35 7.39 0.00 -1.26 -4.01 107.32 105.33 2kui s GLY 401 Ca -0.12 -1.26 0.03 0.00 0.00 0.00 0.00 44.72 43.37 2kui s GLY 401 CO 0.80 -0.96 0.11 -1.30 0.00 0.00 0.00 173.10 171.74 2kui n THR 402 N -0.36 0.00 -3.83 0.90 -2.24 -1.26 -4.88 114.28 102.61 2kui n THR 402 Ca 0.00 -1.97 -0.36 0.00 -2.27 0.00 0.00 64.05 59.45 2kui n THR 402 Cb 0.63 0.67 -0.07 0.00 -2.10 0.00 0.00 70.33 69.46 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 -3.10 6.29 0.15 3.42 2.15 -1.26 -4.97 116.67 119.35 2kui s ASP 403 Ca 0.15 0.37 0.08 0.00 0.43 0.00 0.00 52.55 53.57 2kui s ASP 403 Cb 0.01 -2.07 0.41 0.00 -0.30 0.00 0.00 42.92 40.97 2kui s ASP 403 CO 0.11 0.32 1.15 -0.81 -0.17 0.00 0.00 175.17 175.76 2kui n PRO 404 N 2.60 0.05 -0.22 4.34 -0.04 -1.26 -2.01 135.00 138.46 2kui n PRO 404 Ca -0.18 0.48 0.14 0.00 -0.04 0.00 0.00 63.50 63.90 2kui n PRO 404 Cb 0.54 -1.80 0.45 0.00 -0.04 0.00 0.00 33.50 32.65 2kui n PRO 404 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kui h ALA 405 N 1.55 2.00 -0.23 0.55 0.00 -1.93 0.57 119.26 121.77 2kui h ALA 405 Ca 0.00 0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 2kui h ALA 405 Cb 0.27 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2kui h ALA 405 CO 0.00 -0.24 -0.64 0.00 0.00 0.00 0.00 179.25 178.38 2kui h ALA 406 N 1.62 0.43 -0.04 0.00 0.00 -1.70 -2.91 119.26 116.67 2kui h ALA 406 Ca 0.42 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2kui h ALA 406 Cb 0.84 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2kui h ALA 406 CO -0.16 0.69 0.00 0.09 0.00 0.00 0.00 179.25 179.86 2kui n ASN 407 N -3.97 0.58 -4.84 0.00 5.03 -0.33 -0.73 115.26 111.00 2kui n ASN 407 Ca -0.05 -1.37 -0.33 0.00 0.87 0.00 0.00 54.58 53.70 2kui n ASN 407 Cb 0.67 -0.02 -0.06 0.00 -1.02 0.00 0.00 39.78 39.35 2kui n ASN 407 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2kui s THR 408 N -1.96 5.08 -0.34 3.41 2.01 0.04 -4.93 115.64 118.95 2kui s THR 408 Ca 0.36 -0.29 -0.29 0.00 0.31 0.00 0.00 61.69 61.78 2kui s THR 408 Cb 0.18 -3.36 0.00 0.00 0.01 0.00 0.00 72.50 69.33 2kui s THR 408 CO 0.29 0.33 1.37 -0.44 -0.69 0.00 0.00 174.62 175.48 2kui s SER 409 N -1.85 6.51 0.41 3.53 0.01 -1.26 -4.12 113.70 116.93 2kui s SER 409 Ca 0.25 1.09 0.07 0.00 1.31 0.00 0.00 55.95 58.67 2kui s SER 409 Cb -0.12 -2.54 -0.07 0.00 0.21 0.00 0.00 66.02 63.49 2kui s SER 409 CO 0.17 -1.24 0.04 0.68 0.41 0.00 0.00 173.24 173.30 2kui s VAL 410 N 4.86 2.03 0.60 3.43 -7.23 0.68 -4.68 120.40 120.10 2kui s VAL 410 Ca 0.59 -1.95 -0.18 0.00 -1.81 0.00 0.00 61.98 58.64 2kui s VAL 410 Cb -0.16 -2.98 -0.03 0.00 0.56 0.00 0.00 36.38 33.77 2kui s VAL 410 CO 0.27 0.00 1.13 -0.55 -0.31 0.00 0.00 175.10 175.64 2kui s SER 411 N -3.75 5.40 -0.29 4.85 0.15 -1.26 -0.10 113.70 118.70 2kui s SER 411 Ca 0.35 2.13 -0.28 0.00 0.70 0.00 0.00 55.95 58.85 2kui s SER 411 Cb 0.09 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 61.79 2kui s SER 411 CO 0.18 -1.44 2.03 0.00 1.20 0.00 0.00 173.24 175.21 2kui s ALA 412 N -1.98 2.74 0.00 5.45 0.00 -1.26 -2.93 121.76 123.78 2kui s ALA 412 Ca 0.71 0.49 0.00 0.00 0.00 0.00 0.00 51.96 53.16 2kui s ALA 412 Cb -0.23 -4.06 0.00 0.00 0.00 0.00 0.00 23.12 18.83 2kui s ALA 412 CO 0.34 -2.80 0.00 0.41 0.00 0.00 0.00 175.76 173.70 2kui n GLY 413 N 5.62 0.77 1.69 0.00 0.00 -1.26 -5.05 105.19 106.96 2kui n GLY 413 Ca 0.27 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.19 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 0.57 -4.53 1.61 -0.08 -1.15 -4.49 116.55 108.47 2kui n ASP 414 Ca 0.00 -1.49 -0.34 0.00 -1.51 0.00 0.00 54.79 51.46 2kui n ASP 414 Cb 0.00 -0.29 -0.12 0.00 2.34 0.00 0.00 41.12 43.06 2kui n ASP 414 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2kui s GLU 415 N -3.59 3.42 -0.24 -0.67 2.02 -1.25 -1.47 118.70 116.93 2kui s GLU 415 Ca 0.29 -0.51 0.01 0.00 0.02 0.00 0.00 54.97 54.78 2kui s GLU 415 Cb -0.02 -2.83 0.04 0.00 0.10 0.00 0.00 34.13 31.42 2kui s GLU 415 CO 0.19 0.38 -0.12 0.42 0.02 0.00 0.00 175.26 176.15 2kui s ILE 416 N -0.01 2.32 -0.08 -1.63 -1.09 -0.38 -4.96 121.20 115.38 2kui s ILE 416 Ca 0.01 -1.31 -0.20 0.00 -2.23 0.00 0.00 60.65 56.92 2kui s ILE 416 Cb -0.13 -2.22 -0.04 0.00 -1.58 0.00 0.00 42.46 38.48 2kui s ILE 416 CO 0.03 0.17 0.57 0.28 -1.23 0.00 0.00 174.94 174.76 2kui s THR 417 N 1.21 5.09 -0.08 2.92 -1.32 -1.26 -0.62 115.64 121.57 2kui s THR 417 Ca -0.03 1.16 0.03 0.00 -1.21 0.00 0.00 61.69 61.64 2kui s THR 417 Cb -0.17 -3.91 -0.02 0.00 -1.51 0.00 0.00 72.50 66.89 2kui s THR 417 CO -0.07 0.33 -0.16 0.54 -2.21 0.00 0.00 174.62 173.04 2kui s VAL 418 N 0.49 2.82 -0.33 5.08 0.11 0.11 -4.75 120.40 123.93 2kui s VAL 418 Ca 0.31 -0.78 -0.14 0.00 -2.93 0.00 0.00 61.98 58.43 2kui s VAL 418 Cb -0.17 -2.12 -0.02 0.00 -1.53 0.00 0.00 36.38 32.55 2kui s VAL 418 CO 0.14 0.56 0.33 0.21 -3.33 0.00 0.00 175.10 173.01 2kui s ASN 419 N -0.19 6.15 -0.14 3.54 3.04 -1.25 -0.34 114.94 125.75 2kui s ASN 419 Ca -0.01 -0.21 -0.06 0.00 0.04 0.00 0.00 52.86 52.62 2kui s ASN 419 Cb -0.13 -2.18 -0.04 0.00 -1.54 0.00 0.00 41.25 37.35 2kui s ASN 419 CO 0.03 -0.29 0.09 -0.69 -3.04 0.00 0.00 177.10 173.20 2kui s VAL 420 N 1.95 5.05 -0.15 -5.21 1.01 0.40 -4.90 120.40 118.56 2kui s VAL 420 Ca 0.11 0.05 -0.09 0.00 0.00 0.00 0.00 61.98 62.04 2kui s VAL 420 Cb -0.17 -3.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.95 2kui s VAL 420 CO 0.11 0.55 0.17 -0.44 0.00 0.00 0.00 175.10 175.50 2kui s SER 421 N -0.44 6.36 0.25 3.32 0.01 -1.26 -1.19 113.70 120.75 2kui s SER 421 Ca 0.11 0.42 0.07 0.00 1.31 0.00 0.00 55.95 57.85 2kui s SER 421 Cb -0.12 -2.10 -0.04 0.00 0.21 0.00 0.00 66.02 63.97 2kui s SER 421 CO 0.02 0.28 0.19 0.42 0.41 0.00 0.00 173.24 174.56 2kui s THR 422 N -0.33 4.42 0.98 1.44 -4.23 -0.22 -4.31 115.64 113.40 2kui s THR 422 Ca 0.13 -1.41 -0.16 0.00 -1.18 0.00 0.00 61.69 59.07 2kui s THR 422 Cb -0.12 -3.39 -0.09 0.00 1.34 0.00 0.00 72.50 70.24 2kui s THR 422 CO 0.02 -0.35 -0.41 0.61 -0.54 0.00 0.00 174.62 173.95 2kui n GLY 423 N -1.18 -3.80 3.55 3.99 0.00 -1.26 -0.52 105.19 105.97 2kui n GLY 423 Ca -0.08 -0.78 -0.38 0.00 0.00 0.00 0.00 46.02 44.78 2kui n GLY 423 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2kui n PRO 424 N 1.13 0.71 -2.29 1.61 -0.02 -1.26 -1.49 135.00 133.40 2kui n PRO 424 Ca 0.01 0.28 -0.42 0.00 -2.02 0.00 0.00 63.50 61.35 2kui n PRO 424 Cb 0.55 -1.96 -0.03 0.00 -0.02 0.00 0.00 33.50 32.04 2kui n PRO 424 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2kui s GLU 425 N -2.48 4.34 0.08 -0.52 2.02 -0.42 -4.65 118.70 117.07 2kui s GLU 425 Ca 0.73 1.91 0.01 0.00 0.02 0.00 0.00 54.97 57.64 2kui s GLU 425 Cb -0.43 -3.42 -0.04 0.00 0.10 0.00 0.00 34.13 30.34 2kui s GLU 425 CO 0.50 -0.44 -0.06 -0.65 0.02 0.00 0.00 175.26 174.63 2kui s GLN 426 N 1.67 0.74 0.08 1.61 -0.21 -1.26 -3.78 119.66 118.50 2kui s GLN 426 Ca 0.62 -1.22 0.09 0.00 0.02 0.00 0.00 55.36 54.87 2kui s GLN 426 Cb -0.32 -0.12 -0.03 0.00 1.00 0.00 0.00 33.01 33.54 2kui s GLN 426 CO 0.28 -0.03 -0.24 1.03 -2.12 0.00 0.00 175.29 174.21 2kui s ARG 427 N -3.51 1.43 0.07 2.91 1.81 0.56 -4.90 118.95 117.32 2kui s ARG 427 Ca 0.07 -1.15 -0.20 0.00 -1.72 0.00 0.00 55.73 52.74 2kui s ARG 427 Cb 0.04 -1.70 -0.07 0.00 -0.45 0.00 0.00 34.95 32.77 2kui s ARG 427 CO -0.05 0.42 0.59 -1.21 -0.68 0.00 0.00 175.30 174.37 2kui s GLU 428 N -1.61 4.26 -0.26 3.54 2.02 -1.26 0.20 118.70 125.59 2kui s GLU 428 Ca 0.10 0.78 -0.29 0.00 0.02 0.00 0.00 54.97 55.58 2kui s GLU 428 Cb -0.10 -3.26 0.01 0.00 0.10 0.00 0.00 34.13 30.89 2kui s GLU 428 CO 0.04 0.59 1.03 0.42 0.02 0.00 0.00 175.26 177.35 2kui s ILE 429 N -0.95 4.65 0.62 -1.63 1.01 -1.09 -4.93 121.20 118.87 2kui s ILE 429 Ca 0.30 1.91 -0.16 0.00 0.00 0.00 0.00 60.65 62.70 2kui s ILE 429 Cb -0.20 -4.32 -0.02 0.00 0.01 0.00 0.00 42.46 37.93 2kui s ILE 429 CO 0.19 -0.26 1.10 -2.16 0.00 0.00 0.00 174.94 173.82 2kui s PRO 430 N 3.29 3.04 -1.01 2.79 0.04 -1.26 -4.46 135.00 137.44 2kui s PRO 430 Ca 0.44 1.37 -0.23 0.00 0.04 0.00 0.00 61.00 62.61 2kui s PRO 430 Cb -0.14 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.44 2kui s PRO 430 CO 0.09 -1.06 1.59 0.34 0.04 0.00 0.00 177.00 178.00 2kui s ASP 431 N -2.51 6.17 -0.12 6.66 2.15 -1.26 -4.93 116.67 122.83 2kui s ASP 431 Ca 0.67 -1.31 -0.17 0.00 0.43 0.00 0.00 52.55 52.17 2kui s ASP 431 Cb -0.20 -2.57 -0.04 0.00 -0.30 0.00 0.00 42.92 39.81 2kui s ASP 431 CO 0.38 -1.81 0.42 -0.69 -0.17 0.00 0.00 175.17 173.29 2kui s VAL 432 N 6.26 5.20 0.65 1.11 1.01 -1.26 -5.05 120.40 128.31 2kui s VAL 432 Ca 0.52 0.83 -0.17 0.00 0.00 0.00 0.00 61.98 63.16 2kui s VAL 432 Cb -0.01 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.61 2kui s VAL 432 CO -0.07 0.37 1.20 -0.44 0.00 0.00 0.00 175.10 176.17 2kui s SER 433 N 0.38 4.81 0.43 3.32 0.01 -1.26 -4.90 113.70 116.49 2kui s SER 433 Ca 0.23 2.35 0.09 0.00 1.31 0.00 0.00 55.95 59.93 2kui s SER 433 Cb -0.15 -2.59 0.93 0.00 0.21 0.00 0.00 66.02 64.43 2kui s SER 433 CO 0.09 -1.85 2.07 0.71 0.41 0.00 0.00 173.24 174.67 2kui h THR 434 N 0.38 1.08 0.00 1.44 1.35 -1.97 0.22 112.91 115.41 2kui h THR 434 Ca -0.49 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.21 2kui h THR 434 Cb 1.29 0.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.29 2kui h THR 434 CO 0.53 0.08 -0.09 0.00 -0.25 0.00 0.00 175.52 175.80 2kui n LEU 435 N -4.48 0.26 -2.16 3.87 -0.00 -1.26 -0.52 117.00 112.70 2kui n LEU 435 Ca 0.03 0.45 -0.26 0.00 -0.00 0.00 0.00 56.01 56.22 2kui n LEU 435 Cb 0.08 -0.42 0.12 0.00 -0.00 0.00 0.00 43.42 43.21 2kui n LEU 435 CO 0.35 -0.03 1.29 0.41 -0.00 0.00 0.00 177.39 179.42 2kui n THR 436 N -1.69 3.19 -0.34 1.47 -1.04 0.07 -4.65 114.28 111.28 2kui n THR 436 Ca 0.06 -2.13 0.14 0.00 -2.04 0.00 0.00 64.05 60.08 2kui n THR 436 Cb 0.36 -0.81 0.35 0.00 -1.82 0.00 0.00 70.33 68.41 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 1.32 1.00 -0.63 -1.42 3.20 -1.65 0.13 116.97 118.93 2kui h TYR 437 Ca 0.56 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.43 2kui h TYR 437 Cb 1.89 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 39.83 2kui h TYR 437 CO 1.38 0.23 0.26 0.00 -1.64 0.00 0.00 178.16 178.39 2kui h ALA 438 N 1.64 0.82 -0.13 1.82 0.00 -1.93 -1.53 119.26 119.94 2kui h ALA 438 Ca 0.56 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 55.17 2kui h ALA 438 Cb 0.93 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2kui h ALA 438 CO -0.35 0.42 -0.51 1.49 0.00 0.00 0.00 179.25 180.31 2kui h GLU 439 N 0.88 0.36 -0.01 0.00 4.81 -1.55 -2.87 114.58 116.20 2kui h GLU 439 Ca 0.21 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2kui h GLU 439 Cb 0.19 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 2kui h GLU 439 CO -0.02 0.79 -0.02 0.00 -0.73 0.00 0.00 179.01 179.03 2kui h ALA 440 N 1.18 -0.01 -0.73 2.92 0.00 -0.28 0.27 119.26 122.61 2kui h ALA 440 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2kui h ALA 440 Cb 0.99 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 2kui h ALA 440 CO 0.09 -0.51 0.32 -0.39 0.00 0.00 0.00 179.25 178.76 2kui h VAL 441 N -0.02 1.24 -0.18 0.00 -1.51 -1.27 -0.29 116.25 114.22 2kui h VAL 441 Ca 0.01 -0.71 -0.10 0.00 -1.23 0.00 0.00 66.70 64.67 2kui h VAL 441 Cb 0.04 0.33 -0.01 0.00 -2.13 0.00 0.00 31.29 29.51 2kui h VAL 441 CO -0.02 0.29 -0.33 0.07 -1.23 0.00 0.00 177.57 176.35 2kui h LYS 442 N 1.05 0.36 -0.64 5.19 5.09 -1.25 -2.42 116.57 123.94 2kui h LYS 442 Ca 0.25 -0.15 -0.01 0.00 0.09 0.00 0.00 60.65 60.83 2kui h LYS 442 Cb 0.15 -0.01 -0.03 0.00 0.10 0.00 0.00 32.23 32.43 2kui h LYS 442 CO -0.03 0.65 0.35 0.87 -2.09 0.00 0.00 179.45 179.20 2kui h LYS 443 N 0.31 0.89 -0.24 0.07 1.79 0.75 -0.47 116.57 119.67 2kui h LYS 443 Ca 0.04 -0.11 -0.05 0.00 -2.18 0.00 0.00 60.65 58.36 2kui h LYS 443 Cb 0.73 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 31.19 2kui h LYS 443 CO 0.06 0.68 -0.05 -0.07 -1.08 0.00 0.00 179.45 178.98 2kui h LEU 444 N 0.87 0.35 -0.40 2.94 -0.00 -0.91 -0.59 115.31 117.57 2kui h LEU 444 Ca 0.22 -0.06 -0.05 0.00 -0.00 0.00 0.00 57.88 57.99 2kui h LEU 444 Cb 0.04 -0.09 -0.02 0.00 -0.00 0.00 0.00 40.66 40.60 2kui h LEU 444 CO -0.04 0.45 0.05 0.74 -0.00 0.00 0.00 178.44 179.64 2kui h THR 445 N 0.36 1.25 0.00 0.22 2.02 -0.88 -0.08 112.91 115.79 2kui h THR 445 Ca 0.08 -0.90 -0.02 0.00 0.77 0.00 0.00 66.41 66.34 2kui h THR 445 Cb 0.32 1.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.78 2kui h THR 445 CO 0.01 0.31 -0.11 0.00 0.37 0.00 0.00 175.52 176.10 2kui h ALA 446 N 0.91 1.04 0.00 6.16 0.00 -0.57 -2.66 119.26 124.16 2kui h ALA 446 Ca 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2kui h ALA 446 Cb 0.39 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2kui h ALA 446 CO 0.01 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.40 2kui n ALA 447 N -2.17 2.57 0.00 0.00 0.00 -0.28 -4.93 120.51 115.70 2kui n ALA 447 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2kui n ALA 447 Cb 0.34 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2kui n ALA 447 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 448 N 0.70 1.92 0.39 0.00 0.00 -1.00 -4.70 105.19 102.51 2kui n GLY 448 Ca 0.11 -0.63 -0.10 0.00 0.00 0.00 0.00 46.02 45.39 2kui n GLY 448 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2kui h PHE 449 N 0.00 -1.23 -1.88 1.61 -0.00 -1.72 -3.46 116.94 110.26 2kui h PHE 449 Ca 0.00 0.06 -0.38 0.00 -0.00 0.00 0.00 57.97 57.65 2kui h PHE 449 Cb 0.00 0.59 -0.08 0.00 -0.00 0.00 0.00 35.95 36.46 2kui h PHE 449 CO 0.00 -0.45 -0.43 0.41 -0.00 0.00 0.00 178.31 177.85 2kui n GLY 450 N -1.42 0.62 3.45 6.09 0.00 -0.07 -4.93 105.19 108.92 2kui n GLY 450 Ca -0.01 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 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 -4.33 3.02 0.03 1.61 1.81 -1.26 -4.73 118.95 115.09 2kui s ARG 451 Ca 0.00 -0.98 0.00 0.00 -1.72 0.00 0.00 55.73 53.04 2kui s ARG 451 Cb 0.00 -3.90 -0.02 0.00 -0.45 0.00 0.00 34.95 30.58 2kui s ARG 451 CO 0.00 -0.69 -0.04 -0.59 -0.68 0.00 0.00 175.30 173.30 2kui s PHE 452 N 1.66 0.38 -0.05 -0.53 -0.12 -1.25 -0.63 117.98 117.44 2kui s PHE 452 Ca 0.05 -0.59 0.02 0.00 -0.05 0.00 0.00 56.93 56.35 2kui s PHE 452 Cb -0.19 -0.26 0.02 0.00 -0.63 0.00 0.00 43.02 41.96 2kui s PHE 452 CO 0.09 -0.19 -0.09 0.15 -0.05 0.00 0.00 175.22 175.14 2kui s LYS 453 N -1.81 1.30 -0.24 1.99 -0.14 0.44 -4.90 119.74 116.38 2kui s LYS 453 Ca -0.12 -0.28 -0.13 0.00 -1.36 0.00 0.00 55.97 54.08 2kui s LYS 453 Cb -0.08 -1.14 -0.04 0.00 -1.68 0.00 0.00 37.83 34.89 2kui s LYS 453 CO -0.02 -0.01 0.27 -1.14 -0.76 0.00 0.00 175.35 173.69 2kui s GLN 454 N 0.74 4.06 -0.07 1.68 0.74 -1.26 -0.04 119.66 125.51 2kui s GLN 454 Ca -0.13 -0.09 0.04 0.00 0.05 0.00 0.00 55.36 55.23 2kui s GLN 454 Cb -0.15 -3.58 -0.02 0.00 1.10 0.00 0.00 33.01 30.36 2kui s GLN 454 CO 0.02 -0.08 -0.20 0.00 -0.55 0.00 0.00 175.29 174.49 2kui s ALA 455 N 1.46 2.39 -0.06 1.58 0.00 0.57 -4.97 121.76 122.73 2kui s ALA 455 Ca 0.12 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 51.10 2kui s ALA 455 Cb -0.15 -0.86 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 2kui s ALA 455 CO 0.08 0.42 -0.11 -0.80 0.00 0.00 0.00 175.76 175.34 2kui s ASN 456 N -0.21 4.27 -0.03 0.00 -0.87 -1.26 -0.19 114.94 116.65 2kui s ASN 456 Ca -0.01 -0.13 -0.02 0.00 -1.57 0.00 0.00 52.86 51.12 2kui s ASN 456 Cb -0.13 -1.01 0.02 0.00 -0.02 0.00 0.00 41.25 40.10 2kui s ASN 456 CO 0.03 0.34 0.08 -0.55 -2.57 0.00 0.00 177.10 174.43 2kui s SER 457 N -0.70 -0.06 0.17 -1.22 0.15 -0.50 -4.93 113.70 106.62 2kui s SER 457 Ca 0.11 0.16 -0.31 0.00 0.70 0.00 0.00 55.95 56.60 2kui s SER 457 Cb -0.11 0.12 -0.10 0.00 -1.71 0.00 0.00 66.02 64.22 2kui s SER 457 CO 0.01 -0.07 1.49 -2.16 1.20 0.00 0.00 173.24 173.71 2kui s PRO 458 N 0.44 4.26 0.29 5.44 0.04 -1.18 -0.51 135.00 143.78 2kui s PRO 458 Ca -0.03 2.27 -0.04 0.00 0.04 0.00 0.00 61.00 63.23 2kui s PRO 458 Cb -0.05 -3.17 -0.01 0.00 0.04 0.00 0.00 34.50 31.32 2kui s PRO 458 CO -0.02 -0.51 0.41 -1.12 0.04 0.00 0.00 177.00 175.80 2kui s SER 459 N 0.92 0.56 0.38 6.66 0.01 -1.24 -4.87 113.70 116.13 2kui s SER 459 Ca 0.66 -1.34 -0.25 0.00 1.31 0.00 0.00 55.95 56.33 2kui s SER 459 Cb -0.42 0.59 -0.12 0.00 0.21 0.00 0.00 66.02 66.29 2kui s SER 459 CO 0.34 -1.17 0.92 1.07 0.41 0.00 0.00 173.24 174.81 2kui n THR 460 N -0.47 2.20 -0.14 1.44 5.66 -1.26 -4.63 114.28 117.07 2kui n THR 460 Ca 0.01 -0.50 0.27 0.00 -3.05 0.00 0.00 64.05 60.78 2kui n THR 460 Cb 0.62 -0.99 0.72 0.00 -1.55 0.00 0.00 70.33 69.14 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 1.52 0.00 -0.24 1.09 0.13 -1.96 0.15 132.00 132.70 2kui h PRO 461 Ca -0.42 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.59 2kui h PRO 461 Cb 1.35 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.47 2kui h PRO 461 CO 0.57 0.00 -0.34 1.05 -0.23 0.00 0.00 178.00 179.05 2kui h GLU 462 N 0.00 0.50 -0.00 0.86 4.11 -2.03 -3.14 114.58 114.88 2kui h GLU 462 Ca 0.39 -0.23 0.00 0.00 0.07 0.00 0.00 59.36 59.59 2kui h GLU 462 Cb 1.60 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.83 2kui h GLU 462 CO -0.00 0.78 -0.74 1.28 0.07 0.00 0.00 179.01 180.40 2kui n LEU 463 N -4.07 0.95 -4.70 3.06 7.99 0.42 -4.86 117.00 115.79 2kui n LEU 463 Ca -0.01 -0.35 -0.42 0.00 -0.01 0.00 0.00 56.01 55.22 2kui n LEU 463 Cb 0.47 -0.09 -0.03 0.00 -0.11 0.00 0.00 43.42 43.66 2kui n LEU 463 CO 0.43 0.22 1.43 -0.69 -1.51 0.00 0.00 177.39 177.27 2kui s VAL 464 N -2.91 2.35 0.00 4.08 1.01 -0.48 -0.86 120.40 123.59 2kui s VAL 464 Ca 0.11 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.14 2kui s VAL 464 Cb 0.17 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.52 2kui s VAL 464 CO 0.76 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.47 2kui n GLY 465 N 4.13 0.69 3.37 4.51 0.00 0.15 -4.97 105.19 113.07 2kui n GLY 465 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 2kui n GLY 465 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kui s LYS 466 N -0.70 1.39 0.28 1.61 3.01 -0.04 -4.67 119.74 120.62 2kui s LYS 466 Ca 0.00 -1.47 -0.29 0.00 -1.01 0.00 0.00 55.97 53.19 2kui s LYS 466 Cb 0.00 -1.54 -0.10 0.00 -1.01 0.00 0.00 37.83 35.18 2kui s LYS 466 CO 0.00 0.32 1.30 0.08 0.51 0.00 0.00 175.35 177.56 2kui s VAL 467 N -1.95 2.95 -0.15 3.17 1.01 0.32 -0.54 120.40 125.22 2kui s VAL 467 Ca 0.18 0.88 0.18 0.00 0.00 0.00 0.00 61.98 63.22 2kui s VAL 467 Cb -0.06 -3.56 -0.25 0.00 0.00 0.00 0.00 36.38 32.50 2kui s VAL 467 CO 0.08 0.18 0.27 -0.38 0.00 0.00 0.00 175.10 175.26 2kui n ILE 468 N 1.56 1.18 0.00 2.22 2.08 0.13 -4.80 119.36 121.73 2kui n ILE 468 Ca 0.02 -0.78 0.00 0.00 0.56 0.00 0.00 62.75 62.55 2kui n ILE 468 Cb 0.42 -0.48 0.00 0.00 -0.75 0.00 0.00 39.64 38.83 2kui n ILE 468 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2kui n GLY 469 N 1.62 1.76 3.42 7.39 0.00 -1.17 -5.02 105.19 113.18 2kui n GLY 469 Ca -0.24 -0.87 -0.31 0.00 0.00 0.00 0.00 46.02 44.59 2kui n GLY 469 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2kui s THR 470 N -2.00 2.62 -0.03 2.61 -1.32 -1.26 -1.55 115.64 114.71 2kui s THR 470 Ca 0.00 -1.09 -0.24 0.00 -1.21 0.00 0.00 61.69 59.15 2kui s THR 470 Cb 0.00 -2.04 -0.17 0.00 -1.51 0.00 0.00 72.50 68.78 2kui s THR 470 CO 0.00 0.45 1.07 -1.13 -2.21 0.00 0.00 174.62 172.80 2kui h ASN 471 N 4.95 -0.17 -3.37 8.08 -0.00 -1.63 -3.42 115.58 120.01 2kui h ASN 471 Ca -0.46 -0.36 -0.53 0.00 -0.00 0.00 0.00 56.30 54.95 2kui h ASN 471 Cb 1.15 0.04 0.05 0.00 -0.00 0.00 0.00 38.32 39.56 2kui h ASN 471 CO 0.48 0.33 0.75 -2.84 -0.00 0.00 0.00 177.43 176.14 2kui s PRO 472 N -3.93 4.28 0.14 6.67 0.02 -1.26 -4.92 135.00 136.00 2kui s PRO 472 Ca -0.14 2.27 -0.31 0.00 0.02 0.00 0.00 61.00 62.83 2kui s PRO 472 Cb 0.01 -3.12 -0.10 0.00 0.02 0.00 0.00 34.50 31.31 2kui s PRO 472 CO 0.55 -0.40 1.69 -2.14 -0.33 0.00 0.00 177.00 176.37 2kui s PRO 473 N -0.29 4.17 0.00 5.54 0.02 -1.26 -4.86 135.00 138.31 2kui s PRO 473 Ca 0.59 2.47 0.14 0.00 0.02 0.00 0.00 61.00 64.23 2kui s PRO 473 Cb -0.41 -3.36 0.85 0.00 0.02 0.00 0.00 34.50 31.61 2kui s PRO 473 CO 0.42 -0.73 1.29 0.00 -0.33 0.00 0.00 177.00 177.65 2kui n ALA 474 N 4.80 2.16 0.39 -1.55 0.00 -1.26 -1.72 120.51 123.32 2kui n ALA 474 Ca 0.16 -0.09 0.06 0.00 0.00 0.00 0.00 53.44 53.57 2kui n ALA 474 Cb 0.38 -1.23 -0.07 0.00 0.00 0.00 0.00 19.45 18.52 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 -0.89 1.05 -4.98 0.00 3.02 -1.26 -4.34 115.26 107.86 2kui n ASN 475 Ca 0.11 -0.55 -0.19 0.00 -0.03 0.00 0.00 54.58 53.92 2kui n ASN 475 Cb 0.05 1.16 0.01 0.00 -0.61 0.00 0.00 39.78 40.40 2kui n ASN 475 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2kui s GLN 476 N -2.33 2.58 -0.26 3.52 -1.52 -0.70 -4.78 119.66 116.17 2kui s GLN 476 Ca 0.02 -1.48 -0.18 0.00 -1.95 0.00 0.00 55.36 51.77 2kui s GLN 476 Cb 0.09 -2.59 -0.02 0.00 -0.22 0.00 0.00 33.01 30.26 2kui s GLN 476 CO 0.49 -0.44 0.54 0.99 -0.25 0.00 0.00 175.29 176.62 2kui s THR 477 N -2.50 5.05 -0.00 -0.19 2.01 -1.26 -2.67 115.64 116.07 2kui s THR 477 Ca 0.54 0.94 -0.01 0.00 0.31 0.00 0.00 61.69 63.46 2kui s THR 477 Cb -0.07 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.55 2kui s THR 477 CO 0.33 0.07 0.13 -0.94 -0.69 0.00 0.00 174.62 173.51 2kui s SER 478 N 1.53 5.98 0.50 3.53 1.04 0.13 -4.85 113.70 121.57 2kui s SER 478 Ca 0.22 0.23 -0.16 0.00 0.48 0.00 0.00 55.95 56.72 2kui s SER 478 Cb -0.16 -1.79 -0.08 0.00 0.10 0.00 0.00 66.02 64.09 2kui s SER 478 CO 0.09 0.26 0.97 0.00 0.98 0.00 0.00 173.24 175.54 2kui s ALA 479 N -1.26 3.08 -1.38 5.32 0.00 -1.26 -0.32 121.76 125.94 2kui s ALA 479 Ca 0.25 0.17 0.21 0.00 0.00 0.00 0.00 51.96 52.60 2kui s ALA 479 Cb -0.12 -3.10 1.05 0.00 0.00 0.00 0.00 23.12 20.95 2kui s ALA 479 CO 0.16 -0.20 1.68 -0.89 0.00 0.00 0.00 175.76 176.51 2kui n ILE 480 N -1.50 0.37 0.15 0.00 2.08 -1.25 -1.55 119.36 117.66 2kui n ILE 480 Ca 0.06 0.09 0.07 0.00 0.56 0.00 0.00 62.75 63.53 2kui n ILE 480 Cb 0.54 -0.74 0.13 0.00 -0.75 0.00 0.00 39.64 38.82 2kui n ILE 480 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 2kui n THR 481 N -1.31 0.54 -3.77 1.39 -2.24 -1.26 -3.99 114.28 103.64 2kui n THR 481 Ca 0.09 -0.77 -0.31 0.00 -2.27 0.00 0.00 64.05 60.80 2kui n THR 481 Cb 0.18 0.86 -0.04 0.00 -2.10 0.00 0.00 70.33 69.23 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 -1.07 6.43 -0.19 3.42 2.47 -0.60 -5.09 114.94 120.31 2kui s ASN 482 Ca 0.23 0.45 -0.05 0.00 0.42 0.00 0.00 52.86 53.91 2kui s ASN 482 Cb 0.13 -2.03 -0.03 0.00 -1.45 0.00 0.00 41.25 37.88 2kui s ASN 482 CO 0.19 0.08 -0.00 -0.69 -3.72 0.00 0.00 177.10 172.96 2kui s VAL 483 N -1.63 4.03 -0.27 -5.21 1.01 -1.26 -4.52 120.40 112.54 2kui s VAL 483 Ca 0.38 -0.29 -0.10 0.00 0.00 0.00 0.00 61.98 61.97 2kui s VAL 483 Cb -0.12 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.40 2kui s VAL 483 CO 0.26 0.45 0.17 -0.69 0.00 0.00 0.00 175.10 175.29 2kui s VAL 484 N 0.79 5.14 -0.21 2.92 1.01 0.20 -4.82 120.40 125.44 2kui s VAL 484 Ca 0.00 0.11 -0.07 0.00 0.00 0.00 0.00 61.98 62.03 2kui s VAL 484 Cb -0.14 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 2kui s VAL 484 CO 0.02 0.27 0.06 -0.51 0.00 0.00 0.00 175.10 174.94 2kui s ILE 485 N 1.73 4.55 -0.11 2.22 -1.16 -1.26 -0.42 121.20 126.75 2kui s ILE 485 Ca 0.07 -0.11 0.03 0.00 -0.51 0.00 0.00 60.65 60.13 2kui s ILE 485 Cb -0.16 -3.07 0.00 0.00 0.61 0.00 0.00 42.46 39.84 2kui s ILE 485 CO 0.10 0.41 -0.23 -0.63 -2.81 0.00 0.00 174.94 171.78 2kui s ILE 486 N 0.87 2.00 -0.21 2.00 1.01 0.94 -1.41 121.20 126.40 2kui s ILE 486 Ca 0.03 -0.97 -0.08 0.00 0.00 0.00 0.00 60.65 59.63 2kui s ILE 486 Cb -0.14 -1.75 -0.04 0.00 0.01 0.00 0.00 42.46 40.55 2kui s ILE 486 CO 0.02 0.54 0.08 -0.51 0.00 0.00 0.00 174.94 175.08 2kui s ILE 487 N 0.52 4.78 -0.03 2.92 2.07 -0.60 -0.31 121.20 130.55 2kui s ILE 487 Ca -0.15 -0.03 0.07 0.00 -1.41 0.00 0.00 60.65 59.13 2kui s ILE 487 Cb -0.17 -3.18 -0.02 0.00 0.13 0.00 0.00 42.46 39.22 2kui s ILE 487 CO 0.05 0.41 -0.24 0.54 -1.91 0.00 0.00 174.94 173.80 2kui s VAL 488 N 0.76 2.22 -0.02 4.00 0.11 0.73 0.17 120.40 128.37 2kui s VAL 488 Ca 0.04 -1.04 -0.30 0.00 -2.93 0.00 0.00 61.98 57.75 2kui s VAL 488 Cb -0.13 -1.79 -0.03 0.00 -1.53 0.00 0.00 36.38 32.89 2kui s VAL 488 CO 0.02 0.58 1.11 -0.83 -3.33 0.00 0.00 175.10 172.65 2kui s GLY 489 N -0.54 2.42 0.08 6.54 0.00 0.30 -1.41 107.32 114.72 2kui s GLY 489 Ca 0.08 0.61 -0.05 0.00 0.00 0.00 0.00 44.72 45.36 2kui s GLY 489 CO 0.00 1.99 0.09 -0.45 0.00 0.00 0.00 173.10 174.73 2kui s SER 490 N 1.19 0.29 0.00 1.64 0.15 0.33 0.30 113.70 117.61 2kui s SER 490 Ca 0.54 -0.85 0.00 0.00 0.70 0.00 0.00 55.95 56.34 2kui s SER 490 Cb -0.24 0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.35 2kui s SER 490 CO 0.24 -0.68 0.00 0.61 1.20 0.00 0.00 173.24 174.61 2kui n GLY 491 N 0.01 -0.41 3.62 9.45 0.00 -1.26 -3.11 105.19 113.49 2kui n GLY 491 Ca -0.14 0.36 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 2kui n GLY 491 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2kui s PRO 492 N 0.00 3.85 -0.28 1.61 0.05 -1.26 -4.85 135.00 134.12 2kui s PRO 492 Ca 0.00 0.86 0.08 0.00 0.05 0.00 0.00 61.00 61.99 2kui s PRO 492 Cb 0.00 -3.86 0.64 0.00 0.05 0.00 0.00 34.50 31.33 2kui s PRO 492 CO 0.00 -1.20 1.64 0.00 0.05 0.00 0.00 177.00 177.49 2kui n ALA 493 N 7.57 4.29 -2.46 8.56 0.00 -1.26 -4.87 120.51 132.34 2kui n ALA 493 Ca 0.13 -1.96 -0.29 0.00 0.00 0.00 0.00 53.44 51.31 2kui n ALA 493 Cb 0.48 -1.22 -0.12 0.00 0.00 0.00 0.00 19.45 18.59 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 -2.60 2.71 0.03 0.00 -4.23 -1.26 -1.50 115.64 108.78 2kui s THR 494 Ca 0.47 -1.51 0.02 0.00 -1.18 0.00 0.00 61.69 59.48 2kui s THR 494 Cb 0.37 -2.22 -0.02 0.00 1.34 0.00 0.00 72.50 71.98 2kui s THR 494 CO 0.12 0.13 -0.06 -0.54 -0.54 0.00 0.00 174.62 173.73 2kui s LYS 495 N -2.02 0.44 -0.01 3.99 1.02 0.26 -4.88 119.74 118.54 2kui s LYS 495 Ca 0.17 -0.59 -0.29 0.00 0.02 0.00 0.00 55.97 55.28 2kui s LYS 495 Cb -0.10 -0.22 -0.03 0.00 -0.52 0.00 0.00 37.83 36.96 2kui s LYS 495 CO 0.09 0.04 0.95 0.16 -0.92 0.00 0.00 175.35 175.66 2kui s ASP 496 N -1.22 7.33 -0.05 2.83 -4.77 -1.26 -1.33 116.67 118.20 2kui s ASP 496 Ca -0.09 1.61 -0.23 0.00 -3.30 0.00 0.00 52.55 50.55 2kui s ASP 496 Cb -0.08 -2.55 -0.04 0.00 -1.09 0.00 0.00 42.92 39.15 2kui s ASP 496 CO 0.00 -0.25 0.67 0.27 0.70 0.00 0.00 175.17 176.56 2kui s ILE 497 N 1.00 5.00 0.23 2.11 -4.36 -0.00 -4.92 121.20 120.26 2kui s ILE 497 Ca 0.50 1.39 -0.03 0.00 -0.26 0.00 0.00 60.65 62.25 2kui s ILE 497 Cb -0.21 -4.01 0.05 0.00 1.25 0.00 0.00 42.46 39.54 2kui s ILE 497 CO 0.27 0.30 0.31 -0.81 0.24 0.00 0.00 174.94 175.24 2kui n PRO 498 N 3.49 -0.22 -2.93 0.37 -0.04 -1.26 0.23 135.00 134.64 2kui n PRO 498 Ca -0.03 -0.51 -0.33 0.00 -0.04 0.00 0.00 63.50 62.59 2kui n PRO 498 Cb 0.51 -0.31 -0.07 0.00 -0.04 0.00 0.00 33.50 33.60 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 -2.14 6.92 -0.40 3.54 1.47 -1.26 -4.62 116.67 120.17 2kui s ASP 499 Ca 0.18 1.56 0.03 0.00 1.18 0.00 0.00 52.55 55.50 2kui s ASP 499 Cb -0.01 -2.49 0.16 0.00 -0.34 0.00 0.00 42.92 40.25 2kui s ASP 499 CO 0.12 -0.28 0.38 0.54 0.68 0.00 0.00 175.17 176.61 2kui s VAL 500 N -2.06 -0.13 -0.15 2.11 0.11 -1.26 -5.09 120.40 113.93 2kui s VAL 500 Ca 0.58 -1.61 -0.08 0.00 -2.93 0.00 0.00 61.98 57.94 2kui s VAL 500 Cb -0.10 -0.84 0.06 0.00 -1.53 0.00 0.00 36.38 33.96 2kui s VAL 500 CO 0.15 -0.79 0.35 0.00 -3.33 0.00 0.00 175.10 171.49 2kui s ALA 501 N 0.89 -0.89 0.00 1.54 0.00 -1.26 -3.45 121.76 118.59 2kui s ALA 501 Ca 0.23 1.34 0.00 0.00 0.00 0.00 0.00 51.96 53.53 2kui s ALA 501 Cb -0.09 -0.88 0.00 0.00 0.00 0.00 0.00 23.12 22.14 2kui s ALA 501 CO -0.07 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 175.79 2kui n GLY 502 N 4.42 1.93 3.99 0.00 0.00 -0.34 -4.96 105.19 110.23 2kui n GLY 502 Ca -0.22 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.59 2kui n GLY 502 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2kui s GLN 503 N 0.00 2.35 0.43 1.61 0.00 -1.26 -4.87 119.66 117.91 2kui s GLN 503 Ca 0.00 -1.70 -0.06 0.00 -0.00 0.00 0.00 55.36 53.60 2kui s GLN 503 Cb 0.00 -2.50 -0.05 0.00 0.00 0.00 0.00 33.01 30.46 2kui s GLN 503 CO 0.00 -0.71 0.74 -0.08 0.00 0.00 0.00 175.29 175.24 2kui s THR 504 N -2.66 4.90 0.29 3.63 -1.32 -1.26 -0.45 115.64 118.77 2kui s THR 504 Ca 0.53 0.27 0.03 0.00 -1.21 0.00 0.00 61.69 61.31 2kui s THR 504 Cb -0.05 -3.81 0.28 0.00 -1.51 0.00 0.00 72.50 67.40 2kui s THR 504 CO 0.33 -0.68 1.75 1.62 -2.21 0.00 0.00 174.62 175.43 2kui h VAL 505 N 0.63 0.65 -0.76 5.08 3.04 -0.91 0.40 116.25 124.38 2kui h VAL 505 Ca -0.47 -0.21 -0.02 0.00 -1.01 0.00 0.00 66.70 64.99 2kui h VAL 505 Cb 1.20 -0.02 -0.04 0.00 -2.01 0.00 0.00 31.29 30.43 2kui h VAL 505 CO 0.63 0.11 0.41 -0.78 -1.01 0.00 0.00 177.57 176.93 2kui h ASP 506 N 0.61 0.96 -0.23 3.17 3.58 -1.93 0.21 116.42 122.79 2kui h ASP 506 Ca 0.54 -0.10 -0.14 0.00 0.42 0.00 0.00 57.03 57.74 2kui h ASP 506 Cb 0.87 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.68 2kui h ASP 506 CO -0.42 0.79 -0.41 0.58 -2.88 0.00 0.00 179.24 176.90 2kui h VAL 507 N 1.06 1.31 -0.74 2.25 2.07 -1.57 -2.42 116.25 118.21 2kui h VAL 507 Ca 0.27 -1.62 0.00 0.00 0.82 0.00 0.00 66.70 66.17 2kui h VAL 507 Cb 0.05 1.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 2kui h VAL 507 CO -0.04 0.51 0.47 0.00 0.02 0.00 0.00 177.57 178.53 2kui h ALA 508 N 0.63 0.94 -0.40 1.67 0.00 -0.68 -1.35 119.26 120.07 2kui h ALA 508 Ca 0.01 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.87 2kui h ALA 508 Cb 1.01 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2kui h ALA 508 CO 0.09 0.39 0.25 0.37 0.00 0.00 0.00 179.25 180.35 2kui h GLN 509 N 1.01 0.49 -0.56 0.00 4.15 -0.53 -0.53 115.11 119.15 2kui h GLN 509 Ca 0.27 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.66 2kui h GLN 509 Cb -0.08 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.47 2kui h GLN 509 CO -0.05 0.32 0.35 -0.22 -1.93 0.00 0.00 178.83 177.30 2kui h LYS 510 N 0.50 0.75 -0.17 1.69 3.11 -0.93 0.87 116.57 122.40 2kui h LYS 510 Ca 0.15 -0.06 -0.00 0.00 -2.81 0.00 0.00 60.65 57.93 2kui h LYS 510 Cb -0.02 -0.16 -0.01 0.00 -1.00 0.00 0.00 32.23 31.04 2kui h LYS 510 CO -0.06 0.52 0.09 -0.91 -2.81 0.00 0.00 179.45 176.28 2kui h ASN 511 N 0.75 0.22 -0.65 4.20 2.35 -0.64 -1.12 115.58 120.68 2kui h ASN 511 Ca 0.20 -0.10 -0.06 0.00 -0.55 0.00 0.00 56.30 55.79 2kui h ASN 511 Cb -0.05 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.24 2kui h ASN 511 CO -0.04 0.26 0.20 -0.07 -1.65 0.00 0.00 177.43 176.12 2kui h LEU 512 N 0.16 0.98 -0.97 1.61 -0.00 -0.75 -2.49 115.31 113.84 2kui h LEU 512 Ca 0.06 -0.18 -0.04 0.00 -0.00 0.00 0.00 57.88 57.71 2kui h LEU 512 Cb 0.09 -0.26 -0.03 0.00 -0.00 0.00 0.00 40.66 40.47 2kui h LEU 512 CO -0.01 0.92 0.24 0.78 -0.00 0.00 0.00 178.44 180.38 2kui h ASN 513 N 1.01 0.91 -0.48 -0.43 -0.26 -0.52 -1.00 115.58 114.80 2kui h ASN 513 Ca 0.22 -0.14 -0.01 0.00 -0.56 0.00 0.00 56.30 55.81 2kui h ASN 513 Cb 0.31 -0.24 -0.03 0.00 -1.06 0.00 0.00 38.32 37.30 2kui h ASN 513 CO -0.01 0.83 0.27 0.58 -1.06 0.00 0.00 177.43 178.04 2kui h VAL 514 N 0.96 1.16 0.00 2.81 2.07 -0.79 -1.24 116.25 121.22 2kui h VAL 514 Ca 0.22 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2kui h VAL 514 Cb 0.22 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2kui h VAL 514 CO -0.02 0.18 0.00 -1.22 0.02 0.00 0.00 177.57 176.54 2kui n TYR 515 N -4.40 0.00 -0.12 1.57 4.01 -0.58 -4.85 117.16 112.79 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 0.10 -0.23 0.00 0.00 -0.31 0.00 0.00 39.34 38.91 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 1.11 0.68 3.60 2.72 0.00 -0.47 -4.94 105.19 107.89 2kui n GLY 516 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.16 3.13 -0.48 1.61 0.08 -0.49 -4.51 117.98 115.17 2kui s PHE 517 Ca 0.00 0.68 0.07 0.00 0.12 0.00 0.00 56.93 57.81 2kui s PHE 517 Cb 0.00 -3.40 0.21 0.00 -0.57 0.00 0.00 43.02 39.26 2kui s PHE 517 CO 0.00 -0.70 1.16 2.41 -0.10 0.00 0.00 175.22 177.99 2kui n THR 518 N 5.75 1.14 -3.88 0.64 -1.04 -1.20 -3.51 114.28 112.18 2kui n THR 518 Ca 0.04 -1.13 -0.28 0.00 -2.04 0.00 0.00 64.05 60.64 2kui n THR 518 Cb 0.48 0.41 -0.16 0.00 -1.82 0.00 0.00 70.33 69.23 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 -1.23 1.35 0.07 -2.82 1.02 -1.26 -5.10 119.74 111.78 2kui s LYS 519 Ca 0.16 -0.54 0.05 0.00 0.02 0.00 0.00 55.97 55.66 2kui s LYS 519 Cb 0.10 -2.06 -0.03 0.00 -0.52 0.00 0.00 37.83 35.32 2kui s LYS 519 CO 0.09 -0.47 -0.14 -0.59 -0.92 0.00 0.00 175.35 173.32 2kui s PHE 520 N 1.64 1.20 0.06 3.18 -0.12 -1.26 -1.74 117.98 120.94 2kui s PHE 520 Ca -0.00 -0.48 0.07 0.00 -0.05 0.00 0.00 56.93 56.47 2kui s PHE 520 Cb -0.16 -0.67 -0.03 0.00 -0.63 0.00 0.00 43.02 41.53 2kui s PHE 520 CO -0.07 0.06 -0.18 -1.12 -0.05 0.00 0.00 175.22 173.85 2kui s SER 521 N -1.81 2.20 -0.12 1.98 0.01 -0.34 -4.91 113.70 110.71 2kui s SER 521 Ca -0.01 -0.55 0.02 0.00 1.31 0.00 0.00 55.95 56.72 2kui s SER 521 Cb -0.09 -0.15 -0.00 0.00 0.21 0.00 0.00 66.02 65.98 2kui s SER 521 CO 0.02 0.08 -0.20 0.00 0.41 0.00 0.00 173.24 173.55 2kui s GLN 522 N -1.39 3.16 -0.30 12.44 -2.07 -1.26 -0.05 119.66 130.20 2kui s GLN 522 Ca 0.05 -0.81 -0.09 0.00 -1.82 0.00 0.00 55.36 52.69 2kui s GLN 522 Cb -0.09 -2.43 -0.01 0.00 -1.09 0.00 0.00 33.01 29.39 2kui s GLN 522 CO 0.02 0.17 0.13 0.00 -1.32 0.00 0.00 175.29 174.29 2kui s ALA 523 N 0.40 3.22 -0.36 2.60 0.00 0.58 -4.94 121.76 123.27 2kui s ALA 523 Ca -0.15 -1.37 -0.22 0.00 0.00 0.00 0.00 51.96 50.22 2kui s ALA 523 Cb -0.17 -2.30 0.01 0.00 0.00 0.00 0.00 23.12 20.66 2kui s ALA 523 CO 0.07 -0.86 0.72 -1.12 0.00 0.00 0.00 175.76 174.57 2kui s SER 524 N 1.59 6.50 0.38 0.00 0.01 -1.26 -0.18 113.70 120.74 2kui s SER 524 Ca 0.04 0.29 0.07 0.00 1.31 0.00 0.00 55.95 57.66 2kui s SER 524 Cb -0.17 -2.37 -0.07 0.00 0.21 0.00 0.00 66.02 63.62 2kui s SER 524 CO 0.05 -0.66 -0.01 0.68 0.41 0.00 0.00 173.24 173.72 2kui s VAL 525 N 2.91 1.91 0.07 3.43 -7.23 0.70 -4.95 120.40 117.23 2kui s VAL 525 Ca 0.28 -2.04 0.02 0.00 -1.81 0.00 0.00 61.98 58.43 2kui s VAL 525 Cb -0.14 -2.88 -0.04 0.00 0.56 0.00 0.00 36.38 33.88 2kui s VAL 525 CO 0.16 -0.05 0.12 1.51 -0.31 0.00 0.00 175.10 176.52 2kui s ASP 526 N -3.65 5.79 0.34 4.85 -4.77 -1.26 -1.00 116.67 116.98 2kui s ASP 526 Ca 0.34 0.09 -0.04 0.00 -3.30 0.00 0.00 52.55 49.64 2kui s ASP 526 Cb 0.08 -1.64 0.01 0.00 -1.09 0.00 0.00 42.92 40.28 2kui s ASP 526 CO 0.17 0.18 0.51 -0.44 0.70 0.00 0.00 175.17 176.29 2kui s SER 527 N -2.37 0.78 0.06 2.11 0.01 -0.63 -4.75 113.70 108.91 2kui s SER 527 Ca 0.30 -1.43 0.25 0.00 1.31 0.00 0.00 55.95 56.39 2kui s SER 527 Cb -0.12 0.68 0.53 0.00 0.21 0.00 0.00 66.02 67.32 2kui s SER 527 CO 0.23 -1.33 1.45 -2.65 0.41 0.00 0.00 173.24 171.35 2kui n PRO 528 N -0.55 0.14 -3.20 12.44 -0.02 -1.25 -3.90 135.00 138.67 2kui n PRO 528 Ca -0.00 0.05 -0.33 0.00 -2.02 0.00 0.00 63.50 61.19 2kui n PRO 528 Cb 0.61 -1.60 -0.06 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 -3.08 4.02 0.58 -0.52 0.52 -1.26 -4.69 118.95 114.52 2kui s ARG 529 Ca 0.09 0.63 -0.20 0.00 -0.52 0.00 0.00 55.73 55.73 2kui s ARG 529 Cb 0.16 -2.60 -0.05 0.00 0.52 0.00 0.00 34.95 32.97 2kui s ARG 529 CO 0.68 0.26 1.07 -0.35 0.02 0.00 0.00 175.30 176.98 2kui n PRO 530 N -0.00 1.10 -1.82 3.54 -0.04 -1.26 -2.94 135.00 133.58 2kui n PRO 530 Ca 0.01 0.42 -0.41 0.00 -0.04 0.00 0.00 63.50 63.48 2kui n PRO 530 Cb 0.52 -2.26 -0.01 0.00 -0.04 0.00 0.00 33.50 31.71 2kui n PRO 530 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kui s ALA 531 N -1.44 3.65 0.00 0.55 0.00 -1.25 -2.60 121.76 120.67 2kui s ALA 531 Ca 0.74 1.54 0.00 0.00 0.00 0.00 0.00 51.96 54.24 2kui s ALA 531 Cb -0.43 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.08 2kui s ALA 531 CO 0.48 -0.98 0.00 0.41 0.00 0.00 0.00 175.76 175.67 2kui n GLY 532 N 1.39 2.47 3.74 0.00 0.00 -0.84 -4.90 105.19 107.03 2kui n GLY 532 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.55 4.74 -0.23 1.61 2.12 -1.07 -0.20 118.70 125.11 2kui s GLU 533 Ca 0.00 1.44 -0.24 0.00 0.36 0.00 0.00 54.97 56.53 2kui s GLU 533 Cb 0.00 -3.34 -0.01 0.00 0.26 0.00 0.00 34.13 31.04 2kui s GLU 533 CO 0.00 0.33 0.77 0.08 -0.54 0.00 0.00 175.26 175.91 2kui s VAL 534 N -0.44 4.89 -2.32 3.70 1.01 0.41 -0.13 120.40 127.51 2kui s VAL 534 Ca 0.44 1.46 0.26 0.00 0.00 0.00 0.00 61.98 64.14 2kui s VAL 534 Cb -0.24 -4.07 0.35 0.00 0.00 0.00 0.00 36.38 32.41 2kui s VAL 534 CO 0.30 -0.03 1.54 1.07 0.00 0.00 0.00 175.10 177.98 2kui n THR 535 N 5.13 0.00 -0.85 3.92 5.66 0.54 -1.19 114.28 127.48 2kui n THR 535 Ca 0.04 -0.26 0.00 0.00 -3.05 0.00 0.00 64.05 60.78 2kui n THR 535 Cb 0.48 0.73 0.00 0.00 -1.55 0.00 0.00 70.33 69.99 2kui n THR 535 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kui n GLY 536 N 1.28 0.54 3.51 1.09 0.00 -1.17 -4.82 105.19 105.61 2kui n GLY 536 Ca 0.15 -1.75 -0.24 0.00 0.00 0.00 0.00 46.02 44.18 2kui n GLY 536 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 537 N -2.43 2.68 -0.04 2.61 -4.23 -1.26 0.25 115.64 113.21 2kui s THR 537 Ca 0.00 -2.30 -0.25 0.00 -1.18 0.00 0.00 61.69 57.96 2kui s THR 537 Cb 0.00 -2.42 -0.19 0.00 1.34 0.00 0.00 72.50 71.23 2kui s THR 537 CO 0.00 -0.39 1.11 -1.13 -0.54 0.00 0.00 174.62 173.67 2kui h ASN 538 N 2.19 -0.08 -3.54 3.99 -1.24 -1.09 -3.43 115.58 112.38 2kui h ASN 538 Ca -0.41 -0.47 -0.52 0.00 0.71 0.00 0.00 56.30 55.62 2kui h ASN 538 Cb 1.26 0.02 0.02 0.00 0.73 0.00 0.00 38.32 40.35 2kui h ASN 538 CO 0.60 0.45 0.55 -2.84 -1.29 0.00 0.00 177.43 174.91 2kui s PRO 539 N -3.89 4.50 0.65 6.67 0.02 -1.26 -5.01 135.00 136.68 2kui s PRO 539 Ca -0.15 1.89 -0.15 0.00 0.02 0.00 0.00 61.00 62.60 2kui s PRO 539 Cb 0.01 -3.23 -0.01 0.00 0.02 0.00 0.00 34.50 31.30 2kui s PRO 539 CO 0.61 -0.06 1.11 -1.25 -0.33 0.00 0.00 177.00 177.08 2kui s PRO 540 N -0.45 2.85 0.34 5.54 0.04 -1.26 -4.97 135.00 137.08 2kui s PRO 540 Ca 0.52 1.42 -0.29 0.00 0.04 0.00 0.00 61.00 62.68 2kui s PRO 540 Cb -0.33 -1.96 -0.11 0.00 0.04 0.00 0.00 34.50 32.15 2kui s PRO 540 CO 0.38 -1.21 1.51 0.00 0.04 0.00 0.00 177.00 177.72 2kui s ALA 541 N -2.28 3.63 0.00 8.56 0.00 -1.26 -2.51 121.76 127.90 2kui s ALA 541 Ca 0.68 1.55 0.00 0.00 0.00 0.00 0.00 51.96 54.18 2kui s ALA 541 Cb -0.21 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.30 2kui s ALA 541 CO 0.40 -1.00 0.00 0.41 0.00 0.00 0.00 175.76 175.57 2kui n GLY 542 N 1.14 3.04 3.73 0.00 0.00 0.14 -5.00 105.19 108.24 2kui n GLY 542 Ca 0.04 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 -2.66 3.38 -0.19 2.61 2.01 -1.04 -4.59 115.64 115.16 2kui s THR 543 Ca 0.00 1.10 -0.12 0.00 0.31 0.00 0.00 61.69 62.98 2kui s THR 543 Cb 0.00 -3.70 -0.05 0.00 0.01 0.00 0.00 72.50 68.76 2kui s THR 543 CO 0.00 0.15 0.21 0.28 -0.69 0.00 0.00 174.62 174.57 2kui s THR 544 N 0.33 5.35 0.06 -0.82 -1.32 -1.26 -0.82 115.64 117.16 2kui s THR 544 Ca 0.57 0.36 0.02 0.00 -1.21 0.00 0.00 61.69 61.43 2kui s THR 544 Cb -0.35 -3.55 -0.03 0.00 -1.51 0.00 0.00 72.50 67.06 2kui s THR 544 CO 0.36 0.41 -0.07 0.68 -2.21 0.00 0.00 174.62 173.78 2kui s VAL 545 N 0.48 0.55 0.33 5.08 -7.23 -0.44 -4.86 120.40 114.31 2kui s VAL 545 Ca 0.12 -1.44 -0.29 0.00 -1.81 0.00 0.00 61.98 58.56 2kui s VAL 545 Cb -0.12 -1.05 -0.10 0.00 0.56 0.00 0.00 36.38 35.66 2kui s VAL 545 CO 0.01 -0.61 1.39 -2.84 -0.31 0.00 0.00 175.10 172.74 2kui s PRO 546 N -2.57 4.26 0.61 4.82 0.02 -1.26 -0.58 135.00 140.30 2kui s PRO 546 Ca -0.01 2.35 0.38 0.00 0.02 0.00 0.00 61.00 63.74 2kui s PRO 546 Cb -0.03 -3.05 1.95 0.00 0.02 0.00 0.00 34.50 33.40 2kui s PRO 546 CO -0.02 -0.34 2.21 -0.39 -0.33 0.00 0.00 177.00 178.13 2kui h VAL 547 N 3.11 0.10 -0.23 3.83 -1.51 -1.57 -0.28 116.25 119.70 2kui h VAL 547 Ca -0.49 -0.23 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 2kui h VAL 547 Cb 1.23 1.21 0.00 0.00 -2.13 0.00 0.00 31.29 31.59 2kui h VAL 547 CO 0.68 0.02 0.00 -0.67 -1.23 0.00 0.00 177.57 176.36 2kui n ASP 548 N -3.19 2.46 -4.70 4.19 2.03 -1.26 -3.25 116.55 112.83 2kui n ASP 548 Ca -0.02 -1.83 -0.23 0.00 0.52 0.00 0.00 54.79 53.23 2kui n ASP 548 Cb 0.17 -0.15 0.11 0.00 -0.72 0.00 0.00 41.12 40.53 2kui n ASP 548 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2kui s SER 549 N -1.60 4.34 -0.15 1.67 0.01 -0.12 -4.84 113.70 113.01 2kui s SER 549 Ca 0.35 -0.55 -0.05 0.00 1.31 0.00 0.00 55.95 57.01 2kui s SER 549 Cb 0.20 0.23 -0.03 0.00 0.21 0.00 0.00 66.02 66.63 2kui s SER 549 CO 0.29 -1.88 0.00 -0.69 0.41 0.00 0.00 173.24 171.37 2kui s VAL 550 N -3.10 4.28 -0.07 3.43 1.01 -1.26 -3.98 120.40 120.70 2kui s VAL 550 Ca 0.67 -0.23 0.03 0.00 0.00 0.00 0.00 61.98 62.45 2kui s VAL 550 Cb -0.04 -2.88 -0.02 0.00 0.00 0.00 0.00 36.38 33.43 2kui s VAL 550 CO 0.44 0.50 -0.14 0.27 0.00 0.00 0.00 175.10 176.17 2kui s ILE 551 N 0.15 3.01 -0.23 2.22 -0.00 -0.71 -4.97 121.20 120.67 2kui s ILE 551 Ca 0.01 -0.72 -0.08 0.00 -0.00 0.00 0.00 60.65 59.86 2kui s ILE 551 Cb -0.13 -2.20 -0.04 0.00 -0.00 0.00 0.00 42.46 40.09 2kui s ILE 551 CO 0.02 0.57 0.09 -0.70 -0.00 0.00 0.00 174.94 174.92 2kui s GLU 552 N -0.37 3.86 -0.13 0.37 2.12 -1.26 -1.20 118.70 122.09 2kui s GLU 552 Ca 0.04 -0.38 -0.11 0.00 0.36 0.00 0.00 54.97 54.87 2kui s GLU 552 Cb -0.12 -3.36 -0.05 0.00 0.26 0.00 0.00 34.13 30.86 2kui s GLU 552 CO 0.02 0.01 0.24 -0.51 -0.54 0.00 0.00 175.26 174.48 2kui s LEU 553 N 1.13 4.32 -0.27 2.70 1.02 0.93 -0.44 118.68 128.08 2kui s LEU 553 Ca 0.05 0.54 -0.23 0.00 0.02 0.00 0.00 54.13 54.51 2kui s LEU 553 Cb -0.14 -2.28 -0.01 0.00 0.02 0.00 0.00 46.19 43.78 2kui s LEU 553 CO 0.04 0.24 0.75 -1.10 0.02 0.00 0.00 176.35 176.31 2kui s GLN 554 N -0.27 4.09 -0.12 1.70 -1.52 0.14 -0.30 119.66 123.38 2kui s GLN 554 Ca 0.16 0.70 0.00 0.00 -1.95 0.00 0.00 55.36 54.28 2kui s GLN 554 Cb -0.13 -3.67 -0.02 0.00 -0.22 0.00 0.00 33.01 28.97 2kui s GLN 554 CO 0.05 -0.54 -0.14 0.08 -0.25 0.00 0.00 175.29 174.49 2kui s VAL 555 N 2.77 3.00 0.55 1.09 1.01 0.75 -0.34 120.40 129.23 2kui s VAL 555 Ca 0.31 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.48 2kui s VAL 555 Cb -0.15 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 2kui s VAL 555 CO 0.09 0.53 0.97 -0.44 0.00 0.00 0.00 175.10 176.25 2kui s SER 556 N 0.23 6.38 0.25 3.32 0.01 0.82 -0.21 113.70 124.49 2kui s SER 556 Ca -0.09 1.38 0.11 0.00 1.31 0.00 0.00 55.95 58.67 2kui s SER 556 Cb -0.15 -2.44 -0.05 0.00 0.21 0.00 0.00 66.02 63.58 2kui s SER 556 CO 0.05 -0.71 -0.19 -1.59 0.41 0.00 0.00 173.24 171.21 2kui s LYS 557 N -4.68 1.72 0.04 12.44 -2.85 -0.17 -2.00 119.74 124.24 2kui s LYS 557 Ca 0.55 -1.65 -0.17 0.00 -1.00 0.00 0.00 55.97 53.69 2kui s LYS 557 Cb -0.11 -1.84 -0.21 0.00 -2.06 0.00 0.00 37.83 33.61 2kui s LYS 557 CO 0.44 0.35 1.17 0.78 0.10 0.00 0.00 175.35 178.20 2kui h GLY 558 N 2.49 0.61 0.00 0.59 0.00 -1.71 -1.67 103.07 103.38 2kui h GLY 558 Ca -0.42 -0.99 0.00 0.00 0.00 0.00 0.00 47.33 45.92 2kui h GLY 558 CO 0.57 0.87 0.00 -2.01 0.00 0.00 0.00 176.54 175.97 2kui n ASN 559 N -4.11 0.00 -4.16 0.19 5.15 -1.25 -3.91 115.26 107.17 2kui n ASN 559 Ca -0.10 0.00 -0.10 0.00 -0.60 0.00 0.00 54.58 53.78 2kui n ASN 559 Cb 0.71 -0.80 -0.10 0.00 -0.53 0.00 0.00 39.78 39.07 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 0.00 0.83 -0.01 1.20 -0.21 -1.26 -2.44 119.66 117.77 2kui s GLN 560 Ca 0.00 -1.34 0.00 0.00 0.02 0.00 0.00 55.36 54.04 2kui s GLN 560 Cb 0.00 -0.12 0.01 0.00 1.00 0.00 0.00 33.01 33.90 2kui s GLN 560 CO 0.00 -0.06 -0.00 -0.59 -2.12 0.00 0.00 175.29 172.52 2kui s PHE 561 N -3.70 0.14 0.07 0.91 -0.71 -0.33 -4.86 117.98 109.50 2kui s PHE 561 Ca 0.13 0.01 -0.30 0.00 -1.04 0.00 0.00 56.93 55.72 2kui s PHE 561 Cb 0.06 -0.16 -0.10 0.00 -1.21 0.00 0.00 43.02 41.61 2kui s PHE 561 CO -0.04 -0.04 1.94 1.55 -1.34 0.00 0.00 175.22 177.28 2kui n VAL 562 N 3.42 0.65 -3.22 -2.49 3.14 -1.26 -0.14 118.33 118.43 2kui n VAL 562 Ca -0.17 -0.12 -0.34 0.00 -2.96 0.00 0.00 64.34 60.75 2kui n VAL 562 Cb 0.56 -2.26 -0.06 0.00 -1.06 0.00 0.00 33.84 31.02 2kui n VAL 562 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kui s MET 563 N 3.92 4.04 0.93 1.45 0.23 0.20 -4.90 119.30 125.18 2kui s MET 563 Ca 0.87 0.63 -0.13 0.00 -1.03 0.00 0.00 55.69 56.03 2kui s MET 563 Cb -0.45 -2.72 0.15 0.00 -1.53 0.00 0.00 34.83 30.28 2kui s MET 563 CO 0.41 0.33 1.14 -1.25 -2.03 0.00 0.00 175.02 173.62 2kui s PRO 564 N -2.39 0.96 -0.14 3.16 0.04 -1.26 -2.37 135.00 132.99 2kui s PRO 564 Ca 0.46 0.25 -0.29 0.00 0.04 0.00 0.00 61.00 61.46 2kui s PRO 564 Cb -0.14 -1.82 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 2kui s PRO 564 CO 0.19 -2.31 0.99 -0.51 0.04 0.00 0.00 177.00 175.40 2kui s ASP 565 N -4.03 7.18 0.00 6.66 1.01 -1.26 -4.62 116.67 121.61 2kui s ASP 565 Ca 0.65 1.46 0.09 0.00 0.71 0.00 0.00 52.55 55.45 2kui s ASP 565 Cb -0.14 -2.54 0.02 0.00 1.01 0.00 0.00 42.92 41.27 2kui s ASP 565 CO 0.54 -0.49 0.63 0.18 0.21 0.00 0.00 175.17 176.24 2kui n LEU 566 N 5.31 1.29 -4.75 1.23 7.99 -1.26 -5.03 117.00 121.78 2kui n LEU 566 Ca 0.09 -0.83 -0.41 0.00 -0.01 0.00 0.00 56.01 54.85 2kui n LEU 566 Cb 0.48 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.77 2kui n LEU 566 CO 0.52 0.26 0.98 -0.44 -1.51 0.00 0.00 177.39 177.20 2kui s SER 567 N -1.07 6.84 0.00 -1.43 0.01 -1.26 -3.46 113.70 113.34 2kui s SER 567 Ca 0.08 2.56 0.00 0.00 1.31 0.00 0.00 55.95 59.89 2kui s SER 567 Cb 0.07 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.67 2kui s SER 567 CO 0.18 -0.52 0.00 0.61 0.41 0.00 0.00 173.24 173.92 2kui n GLY 568 N 1.53 0.45 3.29 3.44 0.00 -1.26 -5.04 105.19 107.60 2kui n GLY 568 Ca 0.03 -0.85 -0.17 0.00 0.00 0.00 0.00 46.02 45.03 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 -4.03 1.48 0.35 1.61 1.00 -1.22 -5.05 119.30 113.44 2kui s MET 569 Ca 0.00 -1.83 0.07 0.00 0.00 0.00 0.00 55.69 53.93 2kui s MET 569 Cb 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 34.83 34.86 2kui s MET 569 CO 0.00 -0.44 0.48 -0.06 0.00 0.00 0.00 175.02 175.01 2kui s PHE 570 N -3.76 3.04 0.35 -0.03 0.08 -1.26 -1.09 117.98 115.31 2kui s PHE 570 Ca 0.37 -0.26 0.16 0.00 0.12 0.00 0.00 56.93 57.33 2kui s PHE 570 Cb 0.06 -2.07 0.84 0.00 -0.57 0.00 0.00 43.02 41.28 2kui s PHE 570 CO 0.17 -0.09 1.85 2.35 -0.10 0.00 0.00 175.22 179.40 2kui h TRP 571 N 0.85 0.00 0.00 0.36 7.01 -0.85 0.21 115.95 123.53 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 1.26 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.32 2kui h TRP 571 CO 0.42 0.33 0.00 1.55 -2.79 0.00 0.00 178.44 177.95 2kui n VAL 572 N -3.93 1.14 -0.13 2.65 3.14 -1.26 -0.57 118.33 119.37 2kui n VAL 572 Ca -0.02 0.29 -0.23 0.00 -2.96 0.00 0.00 64.34 61.42 2kui n VAL 572 Cb 0.39 -1.07 -0.11 0.00 -1.06 0.00 0.00 33.84 31.99 2kui n VAL 572 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 2kui n ASP 573 N -1.50 1.98 0.11 6.55 8.00 -0.23 -4.48 116.55 126.97 2kui n ASP 573 Ca 0.03 0.07 -0.13 0.00 0.71 0.00 0.00 54.79 55.47 2kui n ASP 573 Cb 0.15 -0.58 -0.07 0.00 -0.02 0.00 0.00 41.12 40.60 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 -0.44 -0.22 0.09 2.24 0.00 -0.49 -2.07 119.26 118.38 2kui h ALA 574 Ca -0.62 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.27 2kui h ALA 574 Cb 1.75 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 19.61 2kui h ALA 574 CO -0.24 -0.63 -0.38 1.49 0.00 0.00 0.00 179.25 179.49 2kui h GLU 575 N -0.23 -0.58 -0.86 0.00 4.57 -1.11 0.64 114.58 117.01 2kui h GLU 575 Ca -0.01 0.04 0.06 0.00 -1.18 0.00 0.00 59.36 58.27 2kui h GLU 575 Cb 0.20 0.13 -0.05 0.00 -0.16 0.00 0.00 28.75 28.87 2kui h GLU 575 CO 0.01 -0.39 0.56 -1.35 -1.18 0.00 0.00 179.01 176.66 2kui h PRO 576 N -0.60 0.96 -0.44 0.92 0.11 -1.78 -2.19 132.00 128.99 2kui h PRO 576 Ca 0.03 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 66.00 2kui h PRO 576 Cb 0.64 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 2kui h PRO 576 CO -0.24 0.64 -0.06 0.00 -0.21 0.00 0.00 178.00 178.13 2kui h ARG 577 N 0.99 0.76 -0.70 1.05 3.08 -0.73 -0.81 114.38 118.02 2kui h ARG 577 Ca 0.36 -0.23 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 2kui h ARG 577 Cb 0.17 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 2kui h ARG 577 CO -0.13 0.81 0.25 -0.07 -1.07 0.00 0.00 179.97 179.76 2kui h LEU 578 N 0.70 0.97 -0.28 3.04 3.38 -0.29 0.35 115.31 123.17 2kui h LEU 578 Ca 0.13 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2kui h LEU 578 Cb 0.52 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2kui h LEU 578 CO 0.03 0.89 0.04 0.03 0.09 0.00 0.00 178.44 179.52 2kui h ARG 579 N 1.02 0.47 0.00 1.13 2.47 -0.97 -0.31 114.38 118.20 2kui h ARG 579 Ca 0.23 -0.13 -0.06 0.00 -1.26 0.00 0.00 59.98 58.76 2kui h ARG 579 Cb 0.24 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.50 2kui h ARG 579 CO -0.01 0.59 -0.31 0.00 0.56 0.00 0.00 179.97 180.80 2kui h ALA 580 N 0.87 1.48 -0.00 0.04 0.00 -0.72 -1.21 119.26 119.71 2kui h ALA 580 Ca 0.09 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2kui h ALA 580 Cb 0.35 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2kui h ALA 580 CO 0.01 0.38 -0.05 1.28 0.00 0.00 0.00 179.25 180.87 2kui n LEU 581 N -4.15 0.14 -1.29 0.00 4.77 0.07 -4.90 117.00 111.64 2kui n LEU 581 Ca -0.02 0.24 -0.08 0.00 -0.03 0.00 0.00 56.01 56.11 2kui n LEU 581 Cb 0.35 -0.29 0.01 0.00 -2.33 0.00 0.00 43.42 41.17 2kui n LEU 581 CO 0.38 0.03 0.01 0.61 -1.33 0.00 0.00 177.39 177.09 2kui n GLY 582 N 1.33 0.27 3.70 -0.72 0.00 -0.46 -4.98 105.19 104.33 2kui n GLY 582 Ca 0.13 -0.44 -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 -2.80 3.44 -0.41 1.61 -0.00 -0.16 -4.98 118.94 115.64 2kui s TRP 583 Ca 0.12 1.40 0.05 0.00 -0.00 0.00 0.00 56.10 57.66 2kui s TRP 583 Cb -0.05 -3.33 0.17 0.00 -0.00 0.00 0.00 33.47 30.25 2kui s TRP 583 CO 0.15 -0.92 0.47 0.99 -0.00 0.00 0.00 176.95 177.64 2kui s THR 584 N 1.37 -0.43 0.00 5.86 2.01 -1.26 -4.78 115.64 118.40 2kui s THR 584 Ca 0.56 -1.14 0.00 0.00 0.31 0.00 0.00 61.69 61.42 2kui s THR 584 Cb -0.26 -0.55 0.00 0.00 0.01 0.00 0.00 72.50 71.71 2kui s THR 584 CO 0.27 -0.51 0.00 0.61 -0.69 0.00 0.00 174.62 174.30 2kui n GLY 585 N 3.78 4.86 3.67 4.40 0.00 -1.24 -4.93 105.19 115.73 2kui n GLY 585 Ca 0.16 -0.69 -0.37 0.00 0.00 0.00 0.00 46.02 45.12 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 4.12 4.13 -0.17 1.61 -2.45 -1.26 -5.02 119.30 120.26 2kui s MET 586 Ca 0.00 0.02 -0.14 0.00 -1.25 0.00 0.00 55.69 54.32 2kui s MET 586 Cb 0.00 -3.54 -0.05 0.00 1.25 0.00 0.00 34.83 32.50 2kui s MET 586 CO 0.00 0.00 0.30 -1.17 1.05 0.00 0.00 175.02 175.20 2kui s LEU 587 N 1.21 4.22 -0.23 4.11 1.98 -1.26 -2.98 118.68 125.73 2kui s LEU 587 Ca 0.15 0.47 -0.15 0.00 -2.89 0.00 0.00 54.13 51.71 2kui s LEU 587 Cb -0.14 -2.37 -0.04 0.00 0.66 0.00 0.00 46.19 44.30 2kui s LEU 587 CO 0.07 0.07 0.38 -0.62 -1.89 0.00 0.00 176.35 174.36 2kui s ASP 588 N 0.60 6.36 -0.22 3.68 2.15 -0.13 -4.98 116.67 124.14 2kui s ASP 588 Ca 0.16 0.42 -0.24 0.00 0.43 0.00 0.00 52.55 53.32 2kui s ASP 588 Cb -0.13 -2.22 -0.01 0.00 -0.30 0.00 0.00 42.92 40.26 2kui s ASP 588 CO 0.04 -0.12 0.80 -0.75 -0.17 0.00 0.00 175.17 174.97 2kui s LYS 589 N 1.60 4.21 -0.02 4.34 2.47 -1.26 -3.69 119.74 127.39 2kui s LYS 589 Ca 0.17 0.91 -0.01 0.00 -1.56 0.00 0.00 55.97 55.48 2kui s LYS 589 Cb -0.15 -3.62 -0.04 0.00 -1.46 0.00 0.00 37.83 32.57 2kui s LYS 589 CO 0.08 -0.43 0.05 0.20 0.16 0.00 0.00 175.35 175.42 2kui s GLY 590 N 1.28 1.96 0.18 5.54 0.00 -1.18 -4.95 107.32 110.15 2kui s GLY 590 Ca 0.35 -0.87 -0.05 0.00 0.00 0.00 0.00 44.72 44.14 2kui s GLY 590 CO 0.09 -0.72 0.44 0.00 0.00 0.00 0.00 173.10 172.91 2kui s ALA 591 N -1.10 3.73 -0.04 3.20 0.00 -1.26 -4.81 121.76 121.46 2kui s ALA 591 Ca 0.20 -0.52 -0.30 0.00 0.00 0.00 0.00 51.96 51.34 2kui s ALA 591 Cb -0.12 -2.20 -0.04 0.00 0.00 0.00 0.00 23.12 20.76 2kui s ALA 591 CO 0.10 0.57 1.29 0.16 0.00 0.00 0.00 175.76 177.88 2kui s ASP 592 N -2.57 6.96 -0.22 0.00 -4.77 -1.26 -3.87 116.67 110.95 2kui s ASP 592 Ca 0.43 1.93 -0.07 0.00 -3.30 0.00 0.00 52.55 51.54 2kui s ASP 592 Cb -0.12 -2.56 -0.03 0.00 -1.09 0.00 0.00 42.92 39.13 2kui s ASP 592 CO 0.25 -0.65 0.06 -0.69 0.70 0.00 0.00 175.17 174.83 2kui s VAL 593 N 2.39 4.37 -0.53 2.11 1.01 -0.62 -4.78 120.40 124.36 2kui s VAL 593 Ca 0.59 -0.16 -0.28 0.00 0.00 0.00 0.00 61.98 62.13 2kui s VAL 593 Cb -0.27 -3.01 0.03 0.00 0.00 0.00 0.00 36.38 33.13 2kui s VAL 593 CO 0.23 0.38 1.12 1.51 0.00 0.00 0.00 175.10 178.34 2kui s ASP 594 N 1.20 6.50 -0.03 3.32 -4.77 -1.26 -1.02 116.67 120.61 2kui s ASP 594 Ca 0.04 0.17 0.06 0.00 -3.30 0.00 0.00 52.55 49.52 2kui s ASP 594 Cb -0.14 -2.53 0.10 0.00 -1.09 0.00 0.00 42.92 39.26 2kui s ASP 594 CO 0.03 -1.33 1.05 0.00 0.70 0.00 0.00 175.17 175.61 2kui n ALA 595 N 7.99 2.11 0.00 2.11 0.00 -1.26 -5.01 120.51 126.46 2kui n ALA 595 Ca 0.09 -1.45 0.00 0.00 0.00 0.00 0.00 53.44 52.07 2kui n ALA 595 Cb 0.49 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.44 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 -0.23 1.07 0.28 0.00 0.00 -1.26 -4.72 105.19 100.33 2kui n GLY 596 Ca 0.04 -2.05 0.03 0.00 0.00 0.00 0.00 46.02 44.03 2kui n GLY 596 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2kui h GLY 597 N 0.00 0.46 1.76 -0.02 0.00 -1.99 -2.99 103.07 100.28 2kui h GLY 597 Ca 0.00 -0.22 0.02 0.00 0.00 0.00 0.00 47.33 47.13 2kui h GLY 597 CO 0.00 0.21 0.10 1.76 0.00 0.00 0.00 176.54 178.61 2kui h SER 598 N 0.42 0.00 -0.02 0.19 0.02 -2.02 -2.13 113.55 110.01 2kui h SER 598 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 2kui h SER 598 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 2kui h SER 598 CO -0.00 0.00 -0.03 0.00 -1.14 0.00 0.00 176.83 175.66 2kui n GLN 599 N -3.68 2.16 -1.16 3.45 1.13 -1.13 -4.98 117.38 113.17 2kui n GLN 599 Ca -0.01 -1.73 -0.30 0.00 -1.94 0.00 0.00 57.00 53.02 2kui n GLN 599 Cb 0.20 -1.46 -0.12 0.00 0.11 0.00 0.00 30.24 28.96 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 1.09 0.37 -0.67 1.08 1.44 -0.80 -2.56 115.22 115.18 2kui n HIS 600 Ca 0.14 0.25 -0.00 0.00 -2.01 0.00 0.00 57.72 56.10 2kui n HIS 600 Cb 0.56 -1.64 -0.00 0.00 0.12 0.00 0.00 29.99 29.02 2kui n HIS 600 CO 0.00 0.00 0.00 -1.71 -2.81 0.00 0.00 176.34 171.82 2kui n ASN 601 N 7.60 -3.88 -4.77 4.39 2.85 -1.19 -4.79 115.26 115.47 2kui n ASN 601 Ca 0.51 0.01 -0.38 0.00 -0.11 0.00 0.00 54.58 54.62 2kui n ASN 601 Cb 0.03 -2.47 -0.06 0.00 1.24 0.00 0.00 39.78 38.52 2kui n ASN 601 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 2kui s ARG 602 N -1.35 4.64 0.08 1.20 3.52 -1.06 -0.15 118.95 125.83 2kui s ARG 602 Ca 0.00 1.38 -0.30 0.00 -0.13 0.00 0.00 55.73 56.67 2kui s ARG 602 Cb 0.00 -2.91 -0.06 0.00 -1.56 0.00 0.00 34.95 30.42 2kui s ARG 602 CO 0.00 0.33 1.17 0.08 -0.81 0.00 0.00 175.30 176.07 2kui s VAL 603 N -1.51 4.03 -0.23 7.11 1.01 -0.25 -3.34 120.40 127.23 2kui s VAL 603 Ca 0.48 1.50 -0.16 0.00 0.00 0.00 0.00 61.98 63.81 2kui s VAL 603 Cb -0.21 -3.96 -0.17 0.00 0.00 0.00 0.00 36.38 32.04 2kui s VAL 603 CO 0.26 0.14 0.01 0.52 0.00 0.00 0.00 175.10 176.03 2kui n VAL 604 N 3.65 1.56 -3.79 2.92 0.31 1.00 -4.65 118.33 119.33 2kui n VAL 604 Ca 0.08 -0.26 -0.12 0.00 -0.01 0.00 0.00 64.34 64.02 2kui n VAL 604 Cb 0.46 -1.91 -0.09 0.00 -0.91 0.00 0.00 33.84 31.40 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 -2.45 -0.10 -0.02 3.52 -0.85 -1.26 -5.01 117.35 111.19 2kui s TYR 605 Ca -0.32 0.08 0.05 0.00 -0.52 0.00 0.00 57.07 56.37 2kui s TYR 605 Cb 0.09 0.05 -0.03 0.00 0.38 0.00 0.00 41.96 42.46 2kui s TYR 605 CO 0.58 -0.39 -0.17 1.14 -1.52 0.00 0.00 175.55 175.19 2kui s GLN 606 N -1.65 2.31 0.12 -3.49 -2.07 -1.25 -3.61 119.66 110.02 2kui s GLN 606 Ca -0.12 -0.82 -0.30 0.00 -1.82 0.00 0.00 55.36 52.31 2kui s GLN 606 Cb -0.05 -2.27 -0.07 0.00 -1.09 0.00 0.00 33.01 29.53 2kui s GLN 606 CO 0.02 0.59 1.59 -0.97 -1.32 0.00 0.00 175.29 175.19 2kui h ASN 607 N 5.09 -1.26 -2.73 12.60 -0.73 -1.63 -3.39 115.58 123.54 2kui h ASN 607 Ca -0.46 0.16 -0.66 0.00 1.87 0.00 0.00 56.30 57.20 2kui h ASN 607 Cb 1.15 0.50 -0.08 0.00 0.27 0.00 0.00 38.32 40.16 2kui h ASN 607 CO 0.49 -0.45 -0.48 -2.16 -0.37 0.00 0.00 177.43 174.46 2kui s PRO 608 N -5.90 3.54 0.47 6.67 0.05 -1.26 -4.97 135.00 133.59 2kui s PRO 608 Ca -0.16 -0.14 -0.22 0.00 0.05 0.00 0.00 61.00 60.53 2kui s PRO 608 Cb 0.09 -3.22 -0.07 0.00 0.05 0.00 0.00 34.50 31.34 2kui s PRO 608 CO 0.64 0.72 1.15 -1.25 0.05 0.00 0.00 177.00 178.30 2kui s PRO 609 N -0.84 3.70 0.35 0.56 0.04 -1.26 -4.96 135.00 132.58 2kui s PRO 609 Ca 0.14 1.72 -0.29 0.00 0.04 0.00 0.00 61.00 62.62 2kui s PRO 609 Cb -0.12 -2.33 -0.11 0.00 0.04 0.00 0.00 34.50 31.98 2kui s PRO 609 CO 0.03 -0.59 1.45 0.00 0.04 0.00 0.00 177.00 177.94 2kui s ALA 610 N -1.60 3.58 0.00 8.56 0.00 -1.26 -2.03 121.76 129.00 2kui s ALA 610 Ca 0.65 1.48 0.00 0.00 0.00 0.00 0.00 51.96 54.09 2kui s ALA 610 Cb -0.27 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.27 2kui s ALA 610 CO 0.32 -0.93 0.00 0.41 0.00 0.00 0.00 175.76 175.57 2kui n GLY 611 N 0.89 0.43 3.94 0.00 0.00 -1.00 -5.00 105.19 104.45 2kui n GLY 611 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 2kui n GLY 611 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kui s THR 612 N -2.00 5.18 -0.01 2.61 2.01 -0.86 -4.81 115.64 117.75 2kui s THR 612 Ca 0.00 -0.89 -0.24 0.00 0.31 0.00 0.00 61.69 60.87 2kui s THR 612 Cb 0.00 -3.73 -0.04 0.00 0.01 0.00 0.00 72.50 68.73 2kui s THR 612 CO 0.00 -0.21 0.73 -0.83 -0.69 0.00 0.00 174.62 173.63 2kui s GLY 613 N -3.56 2.70 -0.03 4.40 0.00 -1.26 -0.63 107.32 108.94 2kui s GLY 613 Ca 0.34 0.21 -0.08 0.00 0.00 0.00 0.00 44.72 45.18 2kui s GLY 613 CO 0.28 1.14 0.26 -1.34 0.00 0.00 0.00 173.10 173.44 2kui s VAL 614 N 0.40 5.31 1.11 1.40 -7.23 0.80 -4.73 120.40 117.45 2kui s VAL 614 Ca 0.38 0.30 -0.14 0.00 -1.81 0.00 0.00 61.98 60.72 2kui s VAL 614 Cb -0.19 -3.55 0.20 0.00 0.56 0.00 0.00 36.38 33.40 2kui s VAL 614 CO 0.20 0.48 0.70 -0.46 -0.31 0.00 0.00 175.10 175.71 2kui n ASN 615 N 1.48 -1.68 0.29 4.85 6.94 -1.26 -1.19 115.26 124.69 2kui n ASN 615 Ca -0.14 -0.03 0.14 0.00 -0.02 0.00 0.00 54.58 54.53 2kui n ASN 615 Cb 0.53 -1.20 0.87 0.00 -2.36 0.00 0.00 39.78 37.62 2kui n ASN 615 CO 0.00 0.00 0.00 0.08 -1.03 0.00 0.00 177.26 176.31 2kui h ARG 616 N -2.32 0.00 0.11 -3.83 0.11 -1.88 -0.47 114.38 106.11 2kui h ARG 616 Ca -0.55 0.00 -0.28 0.00 0.10 0.00 0.00 59.98 59.25 2kui h ARG 616 Cb 1.33 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.42 2kui h ARG 616 CO 0.44 0.03 -1.20 0.22 0.10 0.00 0.00 179.97 179.55 2kui h ASP 617 N 0.00 0.62 0.00 0.08 3.58 -1.90 -3.48 116.42 115.32 2kui h ASP 617 Ca -0.00 -0.60 0.00 0.00 0.42 0.00 0.00 57.03 56.85 2kui h ASP 617 Cb 0.07 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 40.92 2kui h ASP 617 CO 0.00 1.44 0.00 0.61 -2.88 0.00 0.00 179.24 178.41 2kui n GLY 618 N 1.37 0.83 3.68 -0.78 0.00 -0.18 -3.68 105.19 106.42 2kui n GLY 618 Ca -0.10 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 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 3.39 -0.05 -0.61 -1.16 -1.26 -4.72 121.20 114.78 2kui s ILE 619 Ca 0.00 0.70 0.03 0.00 -0.51 0.00 0.00 60.65 60.86 2kui s ILE 619 Cb 0.00 -3.45 0.01 0.00 0.61 0.00 0.00 42.46 39.63 2kui s ILE 619 CO 0.00 -0.02 -0.12 -0.51 -2.81 0.00 0.00 174.94 171.48 2kui s ILE 620 N 3.13 1.08 -0.12 2.00 1.10 -1.16 -4.79 121.20 122.44 2kui s ILE 620 Ca 0.72 -0.48 -0.05 0.00 -0.51 0.00 0.00 60.65 60.33 2kui s ILE 620 Cb -0.36 -0.97 -0.04 0.00 0.15 0.00 0.00 42.46 41.25 2kui s ILE 620 CO 0.30 0.33 0.05 -0.89 -2.11 0.00 0.00 174.94 172.62 2kui s THR 621 N 0.45 4.72 0.06 4.00 2.01 -1.26 -0.96 115.64 124.66 2kui s THR 621 Ca -0.10 -0.08 0.00 0.00 0.31 0.00 0.00 61.69 61.83 2kui s THR 621 Cb -0.13 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.30 2kui s THR 621 CO 0.02 0.57 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.72 2kui s LEU 622 N -0.58 2.42 -0.06 4.42 1.43 -1.24 -1.56 118.68 123.51 2kui s LEU 622 Ca 0.11 -0.86 -0.05 0.00 -1.03 0.00 0.00 54.13 52.30 2kui s LEU 622 Cb -0.12 0.05 0.02 0.00 0.03 0.00 0.00 46.19 46.17 2kui s LEU 622 CO 0.02 -0.46 0.16 -0.60 0.23 0.00 0.00 176.35 175.71 2kui s ARG 623 N -3.18 0.16 0.09 1.70 6.06 -1.24 -3.10 118.95 119.44 2kui s ARG 623 Ca 0.02 0.28 -0.04 0.00 -2.50 0.00 0.00 55.73 53.49 2kui s ARG 623 Cb 0.02 0.00 -0.02 0.00 0.06 0.00 0.00 34.95 35.00 2kui s ARG 623 CO -0.05 -0.07 0.09 -0.59 -2.50 0.00 0.00 175.30 172.18 2kui s PHE 624 N 0.46 0.46 0.00 5.12 -0.71 -1.25 -0.00 117.98 122.05 2kui s PHE 624 Ca -0.03 -0.91 0.00 0.00 -1.04 0.00 0.00 56.93 54.94 2kui s PHE 624 Cb -0.05 -0.26 0.00 0.00 -1.21 0.00 0.00 43.02 41.50 2kui s PHE 624 CO -0.02 -0.50 0.00 0.41 -1.34 0.00 0.00 175.22 173.77 2kui n GLY 625 N -0.02 0.26 0.00 1.99 0.00 -1.07 -1.59 105.19 104.77 2kui n GLY 625 Ca -0.12 -1.82 0.13 0.00 0.00 0.00 0.00 46.02 44.21 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14