#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 4.96 0.40 -0.61 1.10 -1.26 -5.10 121.20 120.69 2kui s ILE 356 Ca 0.00 0.31 -0.01 0.00 -0.51 0.00 0.00 60.65 60.44 2kui s ILE 356 Cb 0.00 -3.68 -0.02 0.00 0.15 0.00 0.00 42.46 38.91 2kui s ILE 356 CO 0.00 -0.23 0.62 -0.89 -2.11 0.00 0.00 174.94 172.34 2kui s THR 357 N -1.99 4.74 -0.92 4.00 2.01 -1.26 -5.03 115.64 117.19 2kui s THR 357 Ca 0.46 -0.36 -0.04 0.00 0.31 0.00 0.00 61.69 62.06 2kui s THR 357 Cb -0.11 -3.75 0.23 0.00 0.01 0.00 0.00 72.50 68.88 2kui s THR 357 CO 0.26 -0.54 0.83 0.00 -0.69 0.00 0.00 174.62 174.48 2kui s ARG 358 N -4.46 3.43 0.10 4.92 3.03 -1.26 -5.03 118.95 119.69 2kui s ARG 358 Ca 0.44 -3.20 -0.31 0.00 2.03 0.00 0.00 55.73 54.69 2kui s ARG 358 Cb -0.10 -4.08 -0.08 0.00 -1.03 0.00 0.00 34.95 29.66 2kui s ARG 358 CO 0.38 -1.26 1.43 -0.51 -1.13 0.00 0.00 175.30 174.22 2kui s ASP 359 N 0.27 6.78 0.33 -2.89 1.11 -1.26 -4.82 116.67 116.19 2kui s ASP 359 Ca 0.27 2.34 0.10 0.00 0.18 0.00 0.00 52.55 55.44 2kui s ASP 359 Cb -0.09 -2.58 -0.06 0.00 1.07 0.00 0.00 42.92 41.27 2kui s ASP 359 CO -0.11 -0.70 -0.05 0.68 1.18 0.00 0.00 175.17 176.17 2kui s VAL 360 N 1.40 2.56 -0.02 -1.27 -7.23 -0.38 -4.62 120.40 110.84 2kui s VAL 360 Ca 0.66 -2.09 -0.15 0.00 -1.81 0.00 0.00 61.98 58.59 2kui s VAL 360 Cb -0.37 -2.70 -0.05 0.00 0.56 0.00 0.00 36.38 33.82 2kui s VAL 360 CO 0.30 -0.24 0.41 -1.58 -0.31 0.00 0.00 175.10 173.69 2kui s GLN 361 N -3.66 4.00 -0.27 4.82 0.74 -1.26 -0.50 119.66 123.54 2kui s GLN 361 Ca 0.33 0.41 -0.15 0.00 0.05 0.00 0.00 55.36 55.99 2kui s GLN 361 Cb -0.00 -3.26 -0.04 0.00 1.10 0.00 0.00 33.01 30.81 2kui s GLN 361 CO 0.18 0.59 0.39 0.08 -0.55 0.00 0.00 175.29 175.98 2kui s VAL 362 N -0.75 5.16 0.02 1.34 1.01 -0.47 -4.99 120.40 121.72 2kui s VAL 362 Ca 0.24 0.61 -0.30 0.00 0.00 0.00 0.00 61.98 62.53 2kui s VAL 362 Cb -0.16 -3.72 -0.07 0.00 0.00 0.00 0.00 36.38 32.43 2kui s VAL 362 CO 0.12 0.15 1.66 -2.84 0.00 0.00 0.00 175.10 174.19 2kui s PRO 363 N 2.10 4.19 0.15 2.72 0.02 -1.26 -4.48 135.00 138.44 2kui s PRO 363 Ca 0.16 2.27 0.06 0.00 0.02 0.00 0.00 61.00 63.51 2kui s PRO 363 Cb -0.16 -3.78 -0.04 0.00 0.02 0.00 0.00 34.50 30.54 2kui s PRO 363 CO 0.10 -0.78 0.05 0.16 -0.33 0.00 0.00 177.00 176.20 2kui s ASP 364 N 2.86 5.09 -0.05 2.53 1.47 -1.26 -4.82 116.67 122.49 2kui s ASP 364 Ca 0.74 -0.26 0.20 0.00 1.18 0.00 0.00 52.55 54.41 2kui s ASP 364 Cb -0.37 -1.20 0.38 0.00 -0.34 0.00 0.00 42.92 41.38 2kui s ASP 364 CO 0.31 0.10 1.16 1.33 0.68 0.00 0.00 175.17 178.76 2kui n VAL 365 N -0.05 0.56 -1.68 2.11 0.24 -1.26 -5.11 118.33 113.14 2kui n VAL 365 Ca -0.09 -1.43 -0.38 0.00 -2.04 0.00 0.00 64.34 60.39 2kui n VAL 365 Cb 0.54 0.63 0.05 0.00 -1.47 0.00 0.00 33.84 33.59 2kui n VAL 365 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2kui n ARG 366 N 0.01 1.26 0.00 7.34 0.00 -1.26 -3.58 116.66 120.43 2kui n ARG 366 Ca 0.09 0.47 0.00 0.00 -0.00 0.00 0.00 57.85 58.41 2kui n ARG 366 Cb 0.98 -2.37 0.00 0.00 -0.00 0.00 0.00 32.46 31.07 2kui n ARG 366 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2kui n GLY 367 N 1.02 0.54 0.00 2.89 0.00 0.14 -4.98 105.19 104.80 2kui n GLY 367 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.41 0.00 -3.65 1.61 6.02 -1.23 -4.89 117.38 113.84 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 -0.05 0.00 1.02 0.00 0.00 30.24 31.21 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 -0.35 -0.25 0.31 1.08 1.04 -1.26 -4.30 113.70 109.96 2kui s SER 369 Ca 0.00 -0.19 0.02 0.00 0.48 0.00 0.00 55.95 56.26 2kui s SER 369 Cb 0.00 0.45 0.50 0.00 0.10 0.00 0.00 66.02 67.07 2kui s SER 369 CO 0.00 -0.77 1.85 0.28 0.98 0.00 0.00 173.24 175.57 2kui h SER 370 N 2.63 0.62 -0.29 7.02 0.02 -1.85 -2.38 113.55 119.32 2kui h SER 370 Ca -0.33 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.50 2kui h SER 370 Cb 1.23 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.60 2kui h SER 370 CO 0.46 0.66 0.15 0.00 -1.14 0.00 0.00 176.83 176.96 2kui h ALA 371 N 1.42 0.37 -0.44 3.77 0.00 -1.96 0.29 119.26 122.72 2kui h ALA 371 Ca 0.14 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2kui h ALA 371 Cb 0.32 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2kui h ALA 371 CO 0.01 -0.09 -0.23 0.22 0.00 0.00 0.00 179.25 179.16 2kui h ASP 372 N 0.35 0.91 0.07 0.00 1.82 -1.94 0.36 116.42 117.99 2kui h ASP 372 Ca 0.10 -0.34 -0.00 0.00 -0.39 0.00 0.00 57.03 56.39 2kui h ASP 372 Cb 0.08 -0.25 0.00 0.00 0.68 0.00 0.00 39.33 39.84 2kui h ASP 372 CO -0.02 1.10 -0.04 0.00 -1.61 0.00 0.00 179.24 178.68 2kui h ALA 373 N 0.96 -0.10 -0.65 -0.78 0.00 -1.17 -1.14 119.26 116.39 2kui h ALA 373 Ca 0.10 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2kui h ALA 373 Cb 0.78 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 2kui h ALA 373 CO 0.06 -0.39 0.43 0.82 0.00 0.00 0.00 179.25 180.17 2kui h ILE 374 N -0.43 1.17 -0.27 0.00 2.04 -0.39 0.09 117.51 119.72 2kui h ILE 374 Ca -0.01 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.54 2kui h ILE 374 Cb 0.37 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 2kui h ILE 374 CO 0.02 0.16 0.17 0.00 0.00 0.00 0.00 178.15 178.50 2kui h ALA 375 N 1.24 0.35 -0.13 1.87 0.00 -0.85 0.77 119.26 122.51 2kui h ALA 375 Ca 0.24 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2kui h ALA 375 Cb -0.10 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2kui h ALA 375 CO -0.05 -0.17 -0.01 1.15 0.00 0.00 0.00 179.25 180.17 2kui h THR 376 N 0.36 1.26 -0.57 0.00 2.02 -0.85 -1.42 112.91 113.71 2kui h THR 376 Ca 0.10 -0.87 -0.06 0.00 0.77 0.00 0.00 66.41 66.35 2kui h THR 376 Cb -0.01 1.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.96 2kui h THR 376 CO -0.02 0.25 0.11 -0.07 0.37 0.00 0.00 175.52 176.17 2kui h LEU 377 N -0.04 0.84 -0.64 2.58 4.07 -0.86 -0.59 115.31 120.67 2kui h LEU 377 Ca 0.04 -0.17 -0.05 0.00 0.08 0.00 0.00 57.88 57.78 2kui h LEU 377 Cb 0.39 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 41.88 2kui h LEU 377 CO 0.01 0.84 0.20 -0.61 -1.08 0.00 0.00 178.44 177.80 2kui h GLN 378 N 0.86 1.00 0.00 1.13 5.75 -0.76 -0.46 115.11 122.63 2kui h GLN 378 Ca 0.18 -0.21 -0.02 0.00 -0.15 0.00 0.00 58.65 58.45 2kui h GLN 378 Cb 0.34 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 28.75 2kui h GLN 378 CO 0.00 0.88 -0.09 -0.91 -2.65 0.00 0.00 178.83 176.06 2kui h ASN 379 N 0.93 0.00 1.39 -0.69 2.35 -0.52 -0.35 115.58 118.68 2kui h ASN 379 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 2kui h ASN 379 Cb 0.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.66 2kui h ASN 379 CO -0.01 0.09 -0.07 0.54 -1.65 0.00 0.00 177.43 176.33 2kui n ARG 380 N -3.33 0.25 -0.16 0.81 5.12 -0.30 -4.91 116.66 114.15 2kui n ARG 380 Ca -0.01 0.19 0.00 0.00 -1.93 0.00 0.00 57.85 56.10 2kui n ARG 380 Cb 0.28 -1.78 0.00 0.00 -1.16 0.00 0.00 32.46 29.80 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 1.32 0.91 3.96 -0.13 0.00 -0.14 -4.88 105.19 106.24 2kui n GLY 381 Ca 0.05 -0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 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 3.01 -0.03 1.61 0.40 -0.26 -3.52 117.98 117.19 2kui s PHE 382 Ca 0.00 0.09 -0.01 0.00 -0.60 0.00 0.00 56.93 56.41 2kui s PHE 382 Cb 0.00 -2.58 -0.04 0.00 0.51 0.00 0.00 43.02 40.92 2kui s PHE 382 CO 0.00 -0.67 0.05 0.15 0.70 0.00 0.00 175.22 175.45 2kui s LYS 383 N -4.68 3.00 -0.07 0.44 -0.14 0.39 -4.25 119.74 114.44 2kui s LYS 383 Ca 0.54 -0.48 0.03 0.00 -1.36 0.00 0.00 55.97 54.70 2kui s LYS 383 Cb -0.10 -2.82 0.00 0.00 -1.68 0.00 0.00 37.83 33.23 2kui s LYS 383 CO 0.38 0.66 -0.17 0.96 -0.76 0.00 0.00 175.35 176.42 2kui s ILE 384 N -1.09 1.47 -0.15 2.17 -5.25 -1.26 -0.48 121.20 116.60 2kui s ILE 384 Ca 0.20 -0.70 -0.02 0.00 -0.99 0.00 0.00 60.65 59.13 2kui s ILE 384 Cb -0.12 -1.29 -0.02 0.00 2.95 0.00 0.00 42.46 43.98 2kui s ILE 384 CO 0.10 0.43 -0.07 -0.60 -1.79 0.00 0.00 174.94 173.01 2kui s ARG 385 N 0.36 3.55 -0.14 0.37 3.52 0.61 -4.89 118.95 122.34 2kui s ARG 385 Ca -0.12 -0.59 0.02 0.00 -0.13 0.00 0.00 55.73 54.92 2kui s ARG 385 Cb -0.15 -2.82 0.01 0.00 -1.56 0.00 0.00 34.95 30.44 2kui s ARG 385 CO 0.04 0.21 -0.19 0.99 -0.81 0.00 0.00 175.30 175.54 2kui s THR 386 N 0.42 1.88 -0.20 4.11 2.01 -1.26 0.23 115.64 122.84 2kui s THR 386 Ca -0.06 -0.86 -0.03 0.00 0.31 0.00 0.00 61.69 61.04 2kui s THR 386 Cb -0.15 -1.69 -0.01 0.00 0.01 0.00 0.00 72.50 70.66 2kui s THR 386 CO 0.04 0.51 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.67 2kui s LEU 387 N 0.98 2.94 -0.21 4.42 2.01 0.75 -4.97 118.68 124.61 2kui s LEU 387 Ca -0.04 -0.34 -0.08 0.00 0.01 0.00 0.00 54.13 53.68 2kui s LEU 387 Cb -0.15 -1.73 -0.04 0.00 0.01 0.00 0.00 46.19 44.28 2kui s LEU 387 CO -0.04 0.03 0.09 0.00 1.01 0.00 0.00 176.35 177.44 2kui s GLN 388 N 1.17 3.96 -0.02 1.70 0.00 -1.26 -0.71 119.66 124.49 2kui s GLN 388 Ca 0.02 -0.34 0.02 0.00 -0.00 0.00 0.00 55.36 55.06 2kui s GLN 388 Cb -0.14 -3.33 0.01 0.00 0.00 0.00 0.00 33.01 29.54 2kui s GLN 388 CO -0.01 0.14 -0.05 0.15 0.00 0.00 0.00 175.29 175.52 2kui s LYS 389 N 0.76 0.59 0.57 9.60 1.02 -0.92 -4.96 119.74 126.41 2kui s LYS 389 Ca 0.05 -0.17 -0.21 0.00 0.02 0.00 0.00 55.97 55.66 2kui s LYS 389 Cb -0.13 -0.59 -0.04 0.00 -0.52 0.00 0.00 37.83 36.55 2kui s LYS 389 CO 0.02 0.05 1.35 -2.14 -0.92 0.00 0.00 175.35 173.72 2kui s PRO 390 N 0.24 2.96 0.00 -1.68 0.02 -1.26 -0.43 135.00 134.85 2kui s PRO 390 Ca -0.03 2.22 0.00 0.00 0.02 0.00 0.00 61.00 63.21 2kui s PRO 390 Cb -0.07 -2.15 0.00 0.00 0.02 0.00 0.00 34.50 32.30 2kui s PRO 390 CO -0.00 -1.32 0.00 -3.47 -0.33 0.00 0.00 177.00 171.88 2kui n ASP 391 N -1.27 0.00 -0.16 2.53 -0.08 0.07 -4.77 116.55 112.88 2kui n ASP 391 Ca 0.12 0.00 0.02 0.00 -1.51 0.00 0.00 54.79 53.42 2kui n ASP 391 Cb 0.46 0.00 0.02 0.00 2.34 0.00 0.00 41.12 43.94 2kui n ASP 391 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2kui n SER 392 N -0.82 0.82 0.19 1.67 7.64 -1.26 -3.27 113.62 118.59 2kui n SER 392 Ca 0.00 -1.86 0.04 0.00 1.01 0.00 0.00 58.87 58.06 2kui n SER 392 Cb 0.00 -0.13 0.38 0.00 -1.01 0.00 0.00 64.21 63.45 2kui n SER 392 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kui h THR 393 N 3.02 1.07 -3.54 0.44 1.03 -1.96 -3.43 112.91 109.54 2kui h THR 393 Ca 0.00 -1.34 -0.51 0.00 -0.01 0.00 0.00 66.41 64.55 2kui h THR 393 Cb 1.01 1.76 -0.02 0.00 -1.07 0.00 0.00 68.15 69.84 2kui h THR 393 CO 0.00 0.36 -0.01 0.27 -0.01 0.00 0.00 175.52 176.13 2kui s ILE 394 N -3.95 4.84 -0.22 0.00 -0.00 -1.26 -4.95 121.20 115.66 2kui s ILE 394 Ca -0.02 0.58 -0.21 0.00 -0.00 0.00 0.00 60.65 61.01 2kui s ILE 394 Cb 0.13 -3.66 -0.09 0.00 -0.00 0.00 0.00 42.46 38.84 2kui s ILE 394 CO 0.70 -0.24 0.79 -2.65 -0.00 0.00 0.00 174.94 173.54 2kui n PRO 395 N -0.58 0.00 -0.67 0.37 -0.02 -1.26 -4.68 135.00 128.16 2kui n PRO 395 Ca 0.01 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.18 2kui n PRO 395 Cb 0.53 -0.67 0.17 0.00 -0.02 0.00 0.00 33.50 33.51 2kui n PRO 395 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2kui n PRO 396 N 2.27 -0.65 0.00 0.52 -0.02 -1.26 -2.58 135.00 133.28 2kui n PRO 396 Ca 0.17 -0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 2kui n PRO 396 Cb -0.02 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 2kui n PRO 396 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2kui n ASP 397 N -3.79 0.00 -4.42 2.55 5.75 -1.26 -3.85 116.55 111.54 2kui n ASP 397 Ca 0.10 0.41 -0.36 0.00 -0.01 0.00 0.00 54.79 54.93 2kui n ASP 397 Cb 0.53 -0.41 -0.13 0.00 -1.03 0.00 0.00 41.12 40.08 2kui n ASP 397 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 2kui s HIS 398 N -2.81 3.06 -0.04 2.11 3.76 -1.26 -2.84 115.29 117.27 2kui s HIS 398 Ca 0.00 -0.54 -0.30 0.00 -0.15 0.00 0.00 55.06 54.07 2kui s HIS 398 Cb 0.00 -2.21 -0.07 0.00 1.11 0.00 0.00 32.58 31.41 2kui s HIS 398 CO 0.00 -0.40 1.89 0.14 -0.85 0.00 0.00 174.74 175.51 2kui s VAL 399 N 1.59 3.23 -0.02 -0.90 -7.23 -1.25 -4.84 120.40 110.97 2kui s VAL 399 Ca 0.06 0.27 0.00 0.00 -1.81 0.00 0.00 61.98 60.50 2kui s VAL 399 Cb -0.15 -3.19 -0.26 0.00 0.56 0.00 0.00 36.38 33.34 2kui s VAL 399 CO 0.02 -0.05 0.75 -0.29 -0.31 0.00 0.00 175.10 175.23 2kui h ILE 400 N 5.86 1.02 -3.30 -0.62 -0.00 -1.92 0.41 117.51 118.96 2kui h ILE 400 Ca -0.44 -2.73 -0.07 0.00 -0.00 0.00 0.00 64.86 61.62 2kui h ILE 400 Cb 1.21 2.65 -0.14 0.00 -0.00 0.00 0.00 36.82 40.54 2kui h ILE 400 CO 0.95 0.77 -0.12 -0.83 -0.00 0.00 0.00 178.15 178.92 2kui s GLY 401 N -5.08 -0.24 0.47 8.18 0.00 -1.26 -4.38 107.32 105.01 2kui s GLY 401 Ca -0.10 0.03 0.01 0.00 0.00 0.00 0.00 44.72 44.66 2kui s GLY 401 CO 0.83 -0.22 0.08 -1.30 0.00 0.00 0.00 173.10 172.49 2kui n THR 402 N 0.08 0.00 -3.94 0.90 -2.24 -1.26 -4.87 114.28 102.95 2kui n THR 402 Ca -0.17 -2.16 -0.33 0.00 -2.27 0.00 0.00 64.05 59.12 2kui n THR 402 Cb 0.62 0.34 -0.05 0.00 -2.10 0.00 0.00 70.33 69.13 2kui n THR 402 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2kui s ASP 403 N -3.64 6.25 0.42 3.42 1.01 -1.26 -4.96 116.67 117.91 2kui s ASP 403 Ca 0.06 0.31 0.14 0.00 0.71 0.00 0.00 52.55 53.77 2kui s ASP 403 Cb -0.00 -1.94 0.79 0.00 1.01 0.00 0.00 42.92 42.78 2kui s ASP 403 CO 0.04 0.26 1.35 1.55 0.21 0.00 0.00 175.17 178.58 2kui h PRO 404 N 3.81 0.00 -0.67 8.23 0.13 -1.99 -1.47 132.00 140.04 2kui h PRO 404 Ca -0.49 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.76 2kui h PRO 404 Cb 1.18 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.27 2kui h PRO 404 CO 0.68 0.00 0.45 0.00 -0.23 0.00 0.00 178.00 178.90 2kui h ALA 405 N 1.01 2.07 0.02 -0.56 0.00 -1.93 -0.09 119.26 119.78 2kui h ALA 405 Ca 0.00 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.67 2kui h ALA 405 Cb 0.81 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2kui h ALA 405 CO 0.00 -0.23 -1.19 0.00 0.00 0.00 0.00 179.25 177.82 2kui h ALA 406 N 1.67 0.41 -0.01 0.00 0.00 -1.58 -3.26 119.26 116.50 2kui h ALA 406 Ca 0.32 -1.03 0.00 0.00 0.00 0.00 0.00 54.91 54.19 2kui h ALA 406 Cb 0.69 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2kui h ALA 406 CO -0.09 1.29 -0.06 0.09 0.00 0.00 0.00 179.25 180.48 2kui n ASN 407 N -3.31 0.86 -4.71 0.00 5.03 -0.50 -1.37 115.26 111.26 2kui n ASN 407 Ca -0.05 -1.08 -0.31 0.00 0.87 0.00 0.00 54.58 54.01 2kui n ASN 407 Cb 0.97 -0.00 -0.08 0.00 -1.02 0.00 0.00 39.78 39.66 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 -2.18 4.21 -0.32 3.41 2.01 -0.16 -4.92 115.64 117.68 2kui s THR 408 Ca 0.36 -0.81 -0.29 0.00 0.31 0.00 0.00 61.69 61.27 2kui s THR 408 Cb 0.21 -2.97 -0.00 0.00 0.01 0.00 0.00 72.50 69.74 2kui s THR 408 CO 0.40 0.20 1.39 -0.44 -0.69 0.00 0.00 174.62 175.48 2kui s SER 409 N -2.10 6.51 0.31 3.53 0.01 -1.26 -4.19 113.70 116.50 2kui s SER 409 Ca 0.25 1.15 0.03 0.00 1.31 0.00 0.00 55.95 58.69 2kui s SER 409 Cb -0.12 -2.54 -0.06 0.00 0.21 0.00 0.00 66.02 63.51 2kui s SER 409 CO 0.17 -1.23 0.06 0.68 0.41 0.00 0.00 173.24 173.32 2kui s VAL 410 N 4.88 1.09 0.55 3.43 -7.23 0.35 -4.61 120.40 118.86 2kui s VAL 410 Ca 0.60 -2.01 -0.15 0.00 -1.81 0.00 0.00 61.98 58.62 2kui s VAL 410 Cb -0.17 -2.72 -0.06 0.00 0.56 0.00 0.00 36.38 33.98 2kui s VAL 410 CO 0.27 -0.03 1.00 -0.55 -0.31 0.00 0.00 175.10 175.48 2kui s SER 411 N -3.44 6.46 0.37 4.85 0.15 -1.26 -1.25 113.70 119.58 2kui s SER 411 Ca 0.36 1.52 -0.26 0.00 0.70 0.00 0.00 55.95 58.27 2kui s SER 411 Cb 0.08 -2.50 -0.09 0.00 -1.71 0.00 0.00 66.02 61.81 2kui s SER 411 CO 0.15 -0.70 1.17 0.00 1.20 0.00 0.00 173.24 175.05 2kui s ALA 412 N -2.81 3.23 0.00 5.45 0.00 -1.26 -3.73 121.76 122.63 2kui s ALA 412 Ca 0.58 0.98 0.00 0.00 0.00 0.00 0.00 51.96 53.51 2kui s ALA 412 Cb -0.10 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.64 2kui s ALA 412 CO 0.39 -0.47 0.00 0.41 0.00 0.00 0.00 175.76 176.09 2kui n GLY 413 N 0.71 1.08 3.92 0.00 0.00 -1.23 -5.01 105.19 104.67 2kui n GLY 413 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2kui n GLY 413 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kui s ASP 414 N -2.00 3.76 -0.29 1.61 -1.08 -1.24 -4.46 116.67 112.97 2kui s ASP 414 Ca 0.00 0.46 -0.06 0.00 -0.52 0.00 0.00 52.55 52.44 2kui s ASP 414 Cb 0.00 -0.71 0.01 0.00 -1.46 0.00 0.00 42.92 40.76 2kui s ASP 414 CO 0.00 -2.34 0.05 -1.61 0.52 0.00 0.00 175.17 171.79 2kui s GLU 415 N -5.72 3.01 -0.20 4.34 2.02 -1.25 -0.46 118.70 120.43 2kui s GLU 415 Ca 0.68 -0.90 -0.13 0.00 0.02 0.00 0.00 54.97 54.65 2kui s GLU 415 Cb -0.07 -3.28 -0.05 0.00 0.10 0.00 0.00 34.13 30.83 2kui s GLU 415 CO 0.51 -0.44 0.24 0.42 0.02 0.00 0.00 175.26 176.01 2kui s ILE 416 N 1.45 5.32 -0.05 -1.63 -1.09 0.37 -4.84 121.20 120.72 2kui s ILE 416 Ca 0.02 0.40 -0.23 0.00 -2.23 0.00 0.00 60.65 58.60 2kui s ILE 416 Cb -0.17 -3.58 -0.04 0.00 -1.58 0.00 0.00 42.46 37.09 2kui s ILE 416 CO 0.01 0.35 0.70 0.42 -1.23 0.00 0.00 174.94 175.19 2kui s THR 417 N 0.83 5.02 -0.05 2.92 -4.23 -1.26 -0.28 115.64 118.58 2kui s THR 417 Ca 0.13 1.44 0.05 0.00 -1.18 0.00 0.00 61.69 62.12 2kui s THR 417 Cb -0.13 -4.04 -0.01 0.00 1.34 0.00 0.00 72.50 69.67 2kui s THR 417 CO 0.04 0.27 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.50 2kui s VAL 418 N 0.66 1.71 -0.17 2.29 1.01 0.14 -4.41 120.40 121.62 2kui s VAL 418 Ca 0.37 -0.87 -0.06 0.00 0.00 0.00 0.00 61.98 61.43 2kui s VAL 418 Cb -0.18 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 2kui s VAL 418 CO 0.18 0.48 0.01 0.20 0.00 0.00 0.00 175.10 175.98 2kui s ASN 419 N -0.01 5.19 -0.10 3.32 0.01 -1.26 -0.17 114.94 121.91 2kui s ASN 419 Ca -0.05 -0.04 0.04 0.00 -0.71 0.00 0.00 52.86 52.10 2kui s ASN 419 Cb -0.13 -1.87 -0.01 0.00 0.41 0.00 0.00 41.25 39.65 2kui s ASN 419 CO 0.03 0.16 -0.22 0.54 -1.51 0.00 0.00 177.10 176.10 2kui s VAL 420 N 0.46 2.27 -0.13 1.60 0.11 0.11 -4.53 120.40 120.29 2kui s VAL 420 Ca -0.00 -0.95 -0.25 0.00 -2.93 0.00 0.00 61.98 57.84 2kui s VAL 420 Cb -0.13 -1.88 -0.02 0.00 -1.53 0.00 0.00 36.38 32.82 2kui s VAL 420 CO 0.02 0.56 0.80 -0.94 -3.33 0.00 0.00 175.10 172.21 2kui s SER 421 N 0.22 6.98 0.23 3.54 1.04 -1.06 -2.16 113.70 122.49 2kui s SER 421 Ca -0.14 1.20 0.02 0.00 0.48 0.00 0.00 55.95 57.51 2kui s SER 421 Cb -0.17 -2.45 -0.04 0.00 0.10 0.00 0.00 66.02 63.47 2kui s SER 421 CO 0.07 -0.32 0.39 -0.89 0.98 0.00 0.00 173.24 173.47 2kui s THR 422 N 1.75 5.23 0.49 2.02 2.01 0.42 -4.44 115.64 123.12 2kui s THR 422 Ca 0.39 -0.60 -0.19 0.00 0.31 0.00 0.00 61.69 61.59 2kui s THR 422 Cb -0.17 -3.79 -0.13 0.00 0.01 0.00 0.00 72.50 68.42 2kui s THR 422 CO 0.15 -0.26 0.24 0.61 -0.69 0.00 0.00 174.62 174.66 2kui n GLY 423 N -1.02 -2.28 3.54 4.40 0.00 -1.26 -0.75 105.19 107.82 2kui n GLY 423 Ca -0.06 -0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 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 0.81 0.51 -2.39 1.61 -0.02 -1.26 -2.37 135.00 131.89 2kui n PRO 424 Ca 0.10 0.22 -0.37 0.00 -2.02 0.00 0.00 63.50 61.43 2kui n PRO 424 Cb 0.45 -1.98 -0.03 0.00 -0.02 0.00 0.00 33.50 31.92 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 -2.80 4.00 0.22 -0.52 2.02 -1.26 -4.76 118.70 115.59 2kui s GLU 425 Ca 0.71 1.67 0.10 0.00 0.02 0.00 0.00 54.97 57.47 2kui s GLU 425 Cb -0.38 -2.52 -0.05 0.00 0.10 0.00 0.00 34.13 31.29 2kui s GLU 425 CO 0.53 -0.32 -0.20 -0.65 0.02 0.00 0.00 175.26 174.64 2kui s GLN 426 N -2.53 1.48 0.23 1.61 -0.21 -1.26 -4.24 119.66 114.75 2kui s GLN 426 Ca 0.60 -1.59 0.10 0.00 0.02 0.00 0.00 55.36 54.48 2kui s GLN 426 Cb -0.26 -1.58 -0.05 0.00 1.00 0.00 0.00 33.01 32.13 2kui s GLN 426 CO 0.32 0.31 -0.17 1.03 -2.12 0.00 0.00 175.29 174.66 2kui s ARG 427 N -3.15 1.48 0.21 2.91 1.81 -0.09 -4.91 118.95 117.22 2kui s ARG 427 Ca 0.23 -1.65 -0.26 0.00 -1.72 0.00 0.00 55.73 52.33 2kui s ARG 427 Cb -0.05 -1.42 -0.09 0.00 -0.45 0.00 0.00 34.95 32.94 2kui s ARG 427 CO 0.10 0.26 0.84 -1.21 -0.68 0.00 0.00 175.30 174.61 2kui s GLU 428 N -3.51 4.61 -0.07 3.54 2.02 -1.26 0.10 118.70 124.12 2kui s GLU 428 Ca 0.25 1.23 -0.30 0.00 0.02 0.00 0.00 54.97 56.18 2kui s GLU 428 Cb -0.03 -3.15 -0.02 0.00 0.10 0.00 0.00 34.13 31.02 2kui s GLU 428 CO 0.10 0.50 1.09 0.42 0.02 0.00 0.00 175.26 177.39 2kui s ILE 429 N -1.27 4.54 0.33 -1.63 1.01 -0.62 -4.89 121.20 118.67 2kui s ILE 429 Ca 0.40 1.83 -0.28 0.00 0.00 0.00 0.00 60.65 62.60 2kui s ILE 429 Cb -0.22 -4.17 -0.10 0.00 0.01 0.00 0.00 42.46 37.98 2kui s ILE 429 CO 0.27 0.02 1.22 -2.84 0.00 0.00 0.00 174.94 173.61 2kui s PRO 430 N 1.96 4.37 -0.15 2.79 0.02 -1.26 -4.51 135.00 138.21 2kui s PRO 430 Ca 0.52 2.02 -0.15 0.00 0.02 0.00 0.00 61.00 63.42 2kui s PRO 430 Cb -0.22 -3.02 -0.05 0.00 0.02 0.00 0.00 34.50 31.24 2kui s PRO 430 CO 0.21 -0.11 0.33 0.34 -0.33 0.00 0.00 177.00 177.44 2kui s ASP 431 N -0.73 6.48 0.08 2.53 2.15 -1.26 -4.99 116.67 120.93 2kui s ASP 431 Ca 0.49 0.56 0.06 0.00 0.43 0.00 0.00 52.55 54.09 2kui s ASP 431 Cb -0.36 -2.20 -0.03 0.00 -0.30 0.00 0.00 42.92 40.03 2kui s ASP 431 CO 0.47 0.08 -0.15 0.54 -0.17 0.00 0.00 175.17 175.94 2kui s VAL 432 N 0.48 1.24 0.32 1.11 0.11 -1.26 -5.10 120.40 117.29 2kui s VAL 432 Ca 0.18 -1.39 -0.29 0.00 -2.93 0.00 0.00 61.98 57.55 2kui s VAL 432 Cb -0.13 -1.20 -0.11 0.00 -1.53 0.00 0.00 36.38 33.41 2kui s VAL 432 CO 0.05 -0.22 1.45 -0.44 -3.33 0.00 0.00 175.10 172.61 2kui s SER 433 N -1.85 6.53 0.54 3.54 0.01 -1.26 -4.89 113.70 116.31 2kui s SER 433 Ca 0.01 2.85 0.19 0.00 1.31 0.00 0.00 55.95 60.31 2kui s SER 433 Cb -0.09 -2.65 1.40 0.00 0.21 0.00 0.00 66.02 64.89 2kui s SER 433 CO 0.03 -0.76 2.17 0.71 0.41 0.00 0.00 173.24 175.80 2kui h THR 434 N 3.20 0.88 0.00 1.44 1.35 -1.99 -0.45 112.91 117.34 2kui h THR 434 Ca -0.48 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 2kui h THR 434 Cb 1.23 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.66 2kui h THR 434 CO 0.71 0.01 -0.44 0.00 -0.25 0.00 0.00 175.52 175.55 2kui n LEU 435 N -4.35 0.45 -2.86 3.87 -0.00 -1.26 0.02 117.00 112.86 2kui n LEU 435 Ca -0.03 0.11 -0.38 0.00 -0.00 0.00 0.00 56.01 55.71 2kui n LEU 435 Cb 0.09 -0.28 0.03 0.00 -0.00 0.00 0.00 43.42 43.27 2kui n LEU 435 CO 0.32 0.08 1.37 0.41 -0.00 0.00 0.00 177.39 179.57 2kui n THR 436 N -1.59 3.44 -0.30 1.47 -1.04 -0.18 -4.74 114.28 111.35 2kui n THR 436 Ca 0.05 -4.38 0.14 0.00 -2.04 0.00 0.00 64.05 57.82 2kui n THR 436 Cb 0.35 -1.24 0.39 0.00 -1.82 0.00 0.00 70.33 68.00 2kui n THR 436 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 2kui h TYR 437 N 2.94 0.85 -1.00 -1.42 3.20 -1.75 -1.54 116.97 118.26 2kui h TYR 437 Ca 0.53 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.46 2kui h TYR 437 Cb 0.14 -0.26 -0.06 0.00 1.54 0.00 0.00 36.73 38.09 2kui h TYR 437 CO 1.13 0.26 0.66 0.00 -1.64 0.00 0.00 178.16 178.56 2kui h ALA 438 N 1.61 1.32 -0.23 1.82 0.00 -1.96 -1.27 119.26 120.55 2kui h ALA 438 Ca 0.50 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.23 2kui h ALA 438 Cb 0.88 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2kui h ALA 438 CO -0.25 0.56 -0.40 1.49 0.00 0.00 0.00 179.25 180.65 2kui h GLU 439 N 1.28 0.53 0.16 0.00 4.57 -1.69 -2.84 114.58 116.58 2kui h GLU 439 Ca 0.39 -0.27 -0.01 0.00 -1.18 0.00 0.00 59.36 58.30 2kui h GLU 439 Cb -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 2kui h GLU 439 CO -0.12 0.84 -0.08 0.00 -1.18 0.00 0.00 179.01 178.47 2kui h ALA 440 N 1.13 -0.22 -0.47 2.92 0.00 -0.80 0.17 119.26 121.99 2kui h ALA 440 Ca 0.04 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2kui h ALA 440 Cb 0.89 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2kui h ALA 440 CO 0.08 -0.60 0.23 -0.39 0.00 0.00 0.00 179.25 178.56 2kui h VAL 441 N -0.26 1.18 -0.17 0.00 -1.51 -1.28 0.05 116.25 114.27 2kui h VAL 441 Ca -0.02 -0.52 -0.11 0.00 -1.23 0.00 0.00 66.70 64.82 2kui h VAL 441 Cb 0.20 0.67 -0.01 0.00 -2.13 0.00 0.00 31.29 30.02 2kui h VAL 441 CO 0.04 0.20 -0.37 0.07 -1.23 0.00 0.00 177.57 176.28 2kui h LYS 442 N 0.61 0.37 -0.48 5.19 5.09 -1.35 -0.90 116.57 125.10 2kui h LYS 442 Ca 0.16 -0.17 -0.05 0.00 0.09 0.00 0.00 60.65 60.68 2kui h LYS 442 Cb 0.11 -0.01 -0.02 0.00 0.10 0.00 0.00 32.23 32.42 2kui h LYS 442 CO -0.02 0.69 0.09 0.87 -2.09 0.00 0.00 179.45 178.99 2kui h LYS 443 N 0.31 0.79 -0.42 0.07 1.79 -0.26 -0.60 116.57 118.26 2kui h LYS 443 Ca 0.03 -0.21 -0.04 0.00 -2.18 0.00 0.00 60.65 58.26 2kui h LYS 443 Cb 0.80 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.33 2kui h LYS 443 CO 0.06 0.79 0.08 -0.07 -1.08 0.00 0.00 179.45 179.23 2kui h LEU 444 N 0.66 0.58 -0.31 2.94 4.07 -0.78 -1.12 115.31 121.35 2kui h LEU 444 Ca 0.15 -0.09 -0.07 0.00 0.08 0.00 0.00 57.88 57.95 2kui h LEU 444 Cb 0.37 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 41.95 2kui h LEU 444 CO 0.01 0.60 -0.07 0.74 -1.08 0.00 0.00 178.44 178.64 2kui h THR 445 N 0.61 1.28 0.00 0.22 2.02 -0.85 0.11 112.91 116.30 2kui h THR 445 Ca 0.14 -1.10 -0.02 0.00 0.77 0.00 0.00 66.41 66.19 2kui h THR 445 Cb 0.27 1.35 -0.00 0.00 -1.74 0.00 0.00 68.15 68.03 2kui h THR 445 CO 0.00 0.35 -0.11 0.00 0.37 0.00 0.00 175.52 176.13 2kui h ALA 446 N 0.80 1.11 -0.00 6.16 0.00 -0.69 -2.01 119.26 124.63 2kui h ALA 446 Ca 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2kui h ALA 446 Cb 0.55 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2kui h ALA 446 CO 0.03 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.42 2kui n ALA 447 N -2.20 2.59 0.00 0.00 0.00 -0.46 -4.92 120.51 115.53 2kui n ALA 447 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2kui n ALA 447 Cb 0.30 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.50 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 0.75 2.61 0.33 0.00 0.00 -0.75 -4.65 105.19 103.46 2kui n GLY 448 Ca 0.12 -0.64 -0.12 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.98 -1.64 1.61 -5.15 -1.68 -3.46 116.94 105.63 2kui h PHE 449 Ca 0.00 0.02 -0.43 0.00 -0.20 0.00 0.00 57.97 57.36 2kui h PHE 449 Cb 0.00 0.40 -0.12 0.00 0.22 0.00 0.00 35.95 36.44 2kui h PHE 449 CO 0.00 -0.43 -0.44 0.41 -2.00 0.00 0.00 178.31 175.85 2kui n GLY 450 N -1.35 1.20 3.31 6.09 0.00 0.36 -4.90 105.19 109.89 2kui n GLY 450 Ca -0.07 -0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 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 -4.19 2.74 0.04 1.61 1.81 -1.26 -4.73 118.95 114.97 2kui s ARG 451 Ca 0.00 -1.10 0.04 0.00 -1.72 0.00 0.00 55.73 52.95 2kui s ARG 451 Cb 0.00 -3.51 -0.02 0.00 -0.45 0.00 0.00 34.95 30.97 2kui s ARG 451 CO 0.00 -0.64 -0.13 -0.59 -0.68 0.00 0.00 175.30 173.27 2kui s PHE 452 N 1.45 1.10 -0.04 -0.53 -0.12 -1.26 -1.75 117.98 116.84 2kui s PHE 452 Ca -0.00 -0.36 0.02 0.00 -0.05 0.00 0.00 56.93 56.54 2kui s PHE 452 Cb -0.19 -0.65 0.01 0.00 -0.63 0.00 0.00 43.02 41.56 2kui s PHE 452 CO 0.04 0.02 -0.09 0.21 -0.05 0.00 0.00 175.22 175.34 2kui s LYS 453 N -1.14 1.16 -0.22 1.99 2.47 -0.34 -4.94 119.74 118.71 2kui s LYS 453 Ca -0.00 -0.30 -0.10 0.00 -1.56 0.00 0.00 55.97 54.02 2kui s LYS 453 Cb -0.08 -1.04 -0.05 0.00 -1.46 0.00 0.00 37.83 35.20 2kui s LYS 453 CO 0.01 0.05 0.13 -1.14 0.16 0.00 0.00 175.35 174.56 2kui s GLN 454 N 0.48 4.06 0.18 4.03 0.74 -1.26 0.44 119.66 128.33 2kui s GLN 454 Ca -0.08 -0.28 0.11 0.00 0.05 0.00 0.00 55.36 55.16 2kui s GLN 454 Cb -0.12 -3.43 -0.04 0.00 1.10 0.00 0.00 33.01 30.51 2kui s GLN 454 CO 0.01 0.15 -0.24 0.00 -0.55 0.00 0.00 175.29 174.66 2kui s ALA 455 N 0.77 2.47 0.04 1.58 0.00 0.64 -4.95 121.76 122.31 2kui s ALA 455 Ca 0.07 -1.59 0.06 0.00 0.00 0.00 0.00 51.96 50.49 2kui s ALA 455 Cb -0.13 -0.33 -0.02 0.00 0.00 0.00 0.00 23.12 22.64 2kui s ALA 455 CO 0.02 0.44 -0.17 0.54 0.00 0.00 0.00 175.76 176.59 2kui s ASN 456 N -2.53 2.05 -0.01 0.00 2.20 -1.26 -0.05 114.94 115.34 2kui s ASN 456 Ca 0.19 -0.47 -0.02 0.00 -0.94 0.00 0.00 52.86 51.61 2kui s ASN 456 Cb -0.08 -0.16 0.00 0.00 -2.00 0.00 0.00 41.25 39.01 2kui s ASN 456 CO 0.09 0.11 0.06 -0.55 -2.94 0.00 0.00 177.10 173.86 2kui s SER 457 N -1.09 -0.00 0.32 3.54 0.15 -0.21 -4.91 113.70 111.50 2kui s SER 457 Ca 0.05 -0.02 -0.29 0.00 0.70 0.00 0.00 55.95 56.38 2kui s SER 457 Cb -0.08 0.14 -0.10 0.00 -1.71 0.00 0.00 66.02 64.26 2kui s SER 457 CO 0.01 -0.11 1.36 -2.84 1.20 0.00 0.00 173.24 172.86 2kui s PRO 458 N -0.41 4.31 0.30 5.44 0.02 -1.25 -0.60 135.00 142.82 2kui s PRO 458 Ca -0.05 2.28 -0.09 0.00 0.02 0.00 0.00 61.00 63.16 2kui s PRO 458 Cb -0.03 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.42 2kui s PRO 458 CO 0.00 -0.28 0.50 -1.12 -0.33 0.00 0.00 177.00 175.77 2kui s SER 459 N -0.23 0.33 0.26 2.53 0.01 -1.06 -4.82 113.70 110.72 2kui s SER 459 Ca 0.52 -1.20 -0.30 0.00 1.31 0.00 0.00 55.95 56.28 2kui s SER 459 Cb -0.41 0.64 -0.14 0.00 0.21 0.00 0.00 66.02 66.32 2kui s SER 459 CO 0.52 -1.26 1.26 1.07 0.41 0.00 0.00 173.24 175.23 2kui n THR 460 N -0.47 1.38 -0.14 1.44 5.66 -1.26 -4.73 114.28 116.16 2kui n THR 460 Ca -0.01 -0.35 0.26 0.00 -3.05 0.00 0.00 64.05 60.91 2kui n THR 460 Cb 0.62 -1.28 0.71 0.00 -1.55 0.00 0.00 70.33 68.82 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 3.25 0.02 0.00 1.09 0.13 -1.95 0.12 132.00 134.65 2kui h PRO 461 Ca -0.44 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.63 2kui h PRO 461 Cb 1.30 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 2kui h PRO 461 CO 0.69 0.01 -0.29 1.05 -0.23 0.00 0.00 178.00 179.23 2kui h GLU 462 N 0.02 0.00 0.00 0.86 4.11 -1.96 -2.65 114.58 114.95 2kui h GLU 462 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.82 2kui h GLU 462 Cb 1.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.78 2kui h GLU 462 CO -0.01 0.29 -1.29 1.28 0.07 0.00 0.00 179.01 179.35 2kui n LEU 463 N -3.88 0.66 -4.71 3.06 7.99 0.35 -4.95 117.00 115.51 2kui n LEU 463 Ca -0.02 -0.30 -0.43 0.00 -0.01 0.00 0.00 56.01 55.26 2kui n LEU 463 Cb 0.37 -0.01 -0.03 0.00 -0.11 0.00 0.00 43.42 43.64 2kui n LEU 463 CO 0.36 0.15 1.34 0.52 -1.51 0.00 0.00 177.39 178.25 2kui n VAL 464 N -1.77 0.11 0.00 4.08 0.31 -0.78 -1.74 118.33 118.54 2kui n VAL 464 Ca 0.01 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2kui n VAL 464 Cb 0.41 -1.92 0.00 0.00 -0.91 0.00 0.00 33.84 31.42 2kui n VAL 464 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2kui n GLY 465 N 3.70 0.10 3.61 2.92 0.00 0.54 -4.97 105.19 111.09 2kui n GLY 465 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 2kui n GLY 465 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kui s LYS 466 N -1.00 1.98 0.35 1.61 3.01 -0.71 -4.92 119.74 120.06 2kui s LYS 466 Ca 0.00 -1.90 -0.26 0.00 -1.01 0.00 0.00 55.97 52.79 2kui s LYS 466 Cb 0.00 -1.79 -0.09 0.00 -1.01 0.00 0.00 37.83 34.93 2kui s LYS 466 CO 0.00 0.07 1.11 0.08 0.51 0.00 0.00 175.35 177.12 2kui s VAL 467 N -2.60 3.45 -0.14 3.17 1.01 0.10 -0.76 120.40 124.63 2kui s VAL 467 Ca 0.35 1.27 0.18 0.00 0.00 0.00 0.00 61.98 63.78 2kui s VAL 467 Cb 0.03 -3.74 -0.25 0.00 0.00 0.00 0.00 36.38 32.42 2kui s VAL 467 CO 0.18 0.17 0.31 -0.38 0.00 0.00 0.00 175.10 175.38 2kui n ILE 468 N 0.46 1.05 -3.59 2.22 2.08 0.96 -4.67 119.36 117.87 2kui n ILE 468 Ca 0.02 -0.75 0.00 0.00 0.56 0.00 0.00 62.75 62.59 2kui n ILE 468 Cb 0.47 -0.43 0.00 0.00 -0.75 0.00 0.00 39.64 38.93 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 1.57 -0.46 3.46 7.39 0.00 -1.14 -5.04 105.19 110.97 2kui n GLY 469 Ca -0.22 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.27 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 -2.98 2.90 0.04 2.61 -4.23 -1.26 -2.08 115.64 110.63 2kui s THR 470 Ca 0.00 -0.88 -0.25 0.00 -1.18 0.00 0.00 61.69 59.39 2kui s THR 470 Cb 0.00 -2.14 -0.18 0.00 1.34 0.00 0.00 72.50 71.52 2kui s THR 470 CO 0.00 0.53 1.50 -1.13 -0.54 0.00 0.00 174.62 174.97 2kui h ASN 471 N 5.15 -0.04 -4.22 3.99 -1.24 -1.18 -3.43 115.58 114.62 2kui h ASN 471 Ca -0.46 -0.23 -0.49 0.00 0.71 0.00 0.00 56.30 55.83 2kui h ASN 471 Cb 1.15 0.01 0.06 0.00 0.73 0.00 0.00 38.32 40.27 2kui h ASN 471 CO 0.49 0.20 0.38 -2.16 -1.29 0.00 0.00 177.43 175.06 2kui s PRO 472 N -5.24 3.37 0.11 6.67 0.04 -1.26 -4.97 135.00 133.72 2kui s PRO 472 Ca -0.14 1.13 -0.31 0.00 0.04 0.00 0.00 61.00 61.71 2kui s PRO 472 Cb 0.04 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.44 2kui s PRO 472 CO 0.66 -0.77 1.70 -2.14 0.04 0.00 0.00 177.00 176.50 2kui s PRO 473 N -4.22 4.17 0.00 0.56 0.02 -1.26 -4.86 135.00 129.42 2kui s PRO 473 Ca 0.62 2.44 0.23 0.00 0.02 0.00 0.00 61.00 64.31 2kui s PRO 473 Cb -0.15 -3.50 1.34 0.00 0.02 0.00 0.00 34.50 32.22 2kui s PRO 473 CO 0.39 -0.75 1.74 0.00 -0.33 0.00 0.00 177.00 178.04 2kui n ALA 474 N 5.27 2.33 0.26 -1.55 0.00 -1.26 -1.89 120.51 123.67 2kui n ALA 474 Ca 0.16 -0.14 0.07 0.00 0.00 0.00 0.00 53.44 53.53 2kui n ALA 474 Cb 0.39 -1.37 0.10 0.00 0.00 0.00 0.00 19.45 18.57 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 -1.04 2.49 -4.97 0.00 5.03 -1.26 -4.14 115.26 111.38 2kui n ASN 475 Ca 0.16 -1.73 -0.20 0.00 0.87 0.00 0.00 54.58 53.69 2kui n ASN 475 Cb 0.09 -0.11 0.05 0.00 -1.02 0.00 0.00 39.78 38.80 2kui n ASN 475 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2kui s GLN 476 N -1.06 2.35 -0.34 3.52 -1.52 -0.79 -4.83 119.66 116.98 2kui s GLN 476 Ca 0.20 -1.39 -0.09 0.00 -1.95 0.00 0.00 55.36 52.12 2kui s GLN 476 Cb 0.12 -2.61 0.02 0.00 -0.22 0.00 0.00 33.01 30.32 2kui s GLN 476 CO 0.17 -0.80 0.16 0.99 -0.25 0.00 0.00 175.29 175.56 2kui s THR 477 N -2.67 4.35 -0.01 -0.19 2.01 -1.26 -1.59 115.64 116.28 2kui s THR 477 Ca 0.61 -0.77 -0.02 0.00 0.31 0.00 0.00 61.69 61.82 2kui s THR 477 Cb -0.07 -3.35 -0.04 0.00 0.01 0.00 0.00 72.50 69.05 2kui s THR 477 CO 0.38 -0.10 0.16 -0.94 -0.69 0.00 0.00 174.62 173.43 2kui s SER 478 N 1.54 6.20 0.49 3.53 1.04 0.11 -4.83 113.70 121.78 2kui s SER 478 Ca 0.02 0.30 -0.20 0.00 0.48 0.00 0.00 55.95 56.55 2kui s SER 478 Cb -0.18 -1.91 -0.08 0.00 0.10 0.00 0.00 66.02 63.95 2kui s SER 478 CO 0.05 0.26 1.03 0.00 0.98 0.00 0.00 173.24 175.57 2kui s ALA 479 N -1.29 2.87 0.31 5.32 0.00 -1.26 -0.92 121.76 126.80 2kui s ALA 479 Ca 0.26 0.56 0.22 0.00 0.00 0.00 0.00 51.96 53.00 2kui s ALA 479 Cb -0.12 -3.24 1.06 0.00 0.00 0.00 0.00 23.12 20.81 2kui s ALA 479 CO 0.17 -0.33 1.91 0.82 0.00 0.00 0.00 175.76 178.34 2kui h ILE 480 N 1.46 0.78 -0.10 0.00 5.03 -1.90 -1.05 117.51 121.72 2kui h ILE 480 Ca -0.49 -0.97 0.00 0.00 -0.12 0.00 0.00 64.86 63.28 2kui h ILE 480 Cb 1.22 1.59 0.00 0.00 -3.03 0.00 0.00 36.82 36.60 2kui h ILE 480 CO 0.59 0.23 0.00 1.07 -0.68 0.00 0.00 178.15 179.36 2kui n THR 481 N -3.68 0.12 -4.04 -0.27 5.66 -1.26 -3.93 114.28 106.87 2kui n THR 481 Ca -0.01 -0.30 -0.34 0.00 -3.05 0.00 0.00 64.05 60.35 2kui n THR 481 Cb 0.36 0.39 -0.07 0.00 -1.55 0.00 0.00 70.33 69.46 2kui n THR 481 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 2kui s ASN 482 N -1.74 5.92 -0.18 1.09 2.47 -0.40 -5.09 114.94 117.01 2kui s ASN 482 Ca 0.35 0.25 -0.05 0.00 0.42 0.00 0.00 52.86 53.83 2kui s ASN 482 Cb 0.19 -1.78 -0.03 0.00 -1.45 0.00 0.00 41.25 38.18 2kui s ASN 482 CO 0.29 0.30 -0.01 0.54 -3.72 0.00 0.00 177.10 174.51 2kui s VAL 483 N -1.17 4.03 -0.06 -5.21 0.11 -1.26 -4.60 120.40 112.24 2kui s VAL 483 Ca 0.22 -0.30 -0.02 0.00 -2.93 0.00 0.00 61.98 58.95 2kui s VAL 483 Cb -0.12 -2.80 -0.04 0.00 -1.53 0.00 0.00 36.38 31.89 2kui s VAL 483 CO 0.12 0.46 0.05 0.68 -3.33 0.00 0.00 175.10 173.08 2kui s VAL 484 N 0.69 4.68 -0.15 2.04 -7.23 -0.71 -4.99 120.40 114.72 2kui s VAL 484 Ca -0.00 -0.22 -0.04 0.00 -1.81 0.00 0.00 61.98 59.91 2kui s VAL 484 Cb -0.14 -3.04 -0.03 0.00 0.56 0.00 0.00 36.38 33.73 2kui s VAL 484 CO 0.02 0.52 -0.04 -0.51 -0.31 0.00 0.00 175.10 174.79 2kui s ILE 485 N -1.02 3.91 -0.13 -0.62 -1.16 -1.26 -1.20 121.20 119.72 2kui s ILE 485 Ca 0.17 -0.35 -0.00 0.00 -0.51 0.00 0.00 60.65 59.95 2kui s ILE 485 Cb -0.12 -2.71 -0.02 0.00 0.61 0.00 0.00 42.46 40.22 2kui s ILE 485 CO 0.07 0.49 -0.12 -0.63 -2.81 0.00 0.00 174.94 171.94 2kui s ILE 486 N 0.34 3.10 -0.20 2.00 1.01 0.17 -0.51 121.20 127.10 2kui s ILE 486 Ca -0.04 -0.64 -0.07 0.00 0.00 0.00 0.00 60.65 59.90 2kui s ILE 486 Cb -0.14 -2.31 -0.04 0.00 0.01 0.00 0.00 42.46 39.99 2kui s ILE 486 CO 0.03 0.52 0.05 -0.51 0.00 0.00 0.00 174.94 175.03 2kui s ILE 487 N 0.38 4.49 0.12 2.92 2.07 -0.88 -0.26 121.20 130.04 2kui s ILE 487 Ca -0.10 -0.13 0.06 0.00 -1.41 0.00 0.00 60.65 59.07 2kui s ILE 487 Cb -0.16 -3.04 -0.04 0.00 0.13 0.00 0.00 42.46 39.35 2kui s ILE 487 CO 0.05 0.43 -0.00 0.68 -1.91 0.00 0.00 174.94 174.19 2kui s VAL 488 N 0.74 3.88 -0.09 4.00 -7.23 0.93 -0.03 120.40 122.60 2kui s VAL 488 Ca 0.03 -1.16 -0.17 0.00 -1.81 0.00 0.00 61.98 58.87 2kui s VAL 488 Cb -0.14 -2.88 -0.05 0.00 0.56 0.00 0.00 36.38 33.87 2kui s VAL 488 CO 0.02 0.04 0.46 -0.83 -0.31 0.00 0.00 175.10 174.47 2kui s GLY 489 N -2.53 2.41 0.12 2.32 0.00 0.06 -1.04 107.32 108.66 2kui s GLY 489 Ca 0.26 -0.20 0.03 0.00 0.00 0.00 0.00 44.72 44.81 2kui s GLY 489 CO 0.18 0.61 -0.07 -0.45 0.00 0.00 0.00 173.10 173.37 2kui s SER 490 N 0.19 1.33 0.00 1.64 0.15 0.23 -0.34 113.70 116.90 2kui s SER 490 Ca 0.25 -1.02 0.00 0.00 0.70 0.00 0.00 55.95 55.88 2kui s SER 490 Cb -0.15 0.07 0.00 0.00 -1.71 0.00 0.00 66.02 64.22 2kui s SER 490 CO 0.11 -0.44 0.00 0.61 1.20 0.00 0.00 173.24 174.72 2kui n GLY 491 N -0.11 0.77 3.77 9.45 0.00 -1.26 -2.57 105.19 115.24 2kui n GLY 491 Ca -0.11 -0.62 -0.37 0.00 0.00 0.00 0.00 46.02 44.92 2kui n GLY 491 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2kui s PRO 492 N -0.55 3.68 -0.25 1.61 0.02 -1.26 -4.62 135.00 133.64 2kui s PRO 492 Ca 0.00 1.85 0.12 0.00 0.02 0.00 0.00 61.00 62.99 2kui s PRO 492 Cb 0.00 -2.40 0.51 0.00 0.02 0.00 0.00 34.50 32.63 2kui s PRO 492 CO 0.00 -0.64 1.45 0.00 -0.33 0.00 0.00 177.00 177.49 2kui n ALA 493 N -0.54 3.80 -2.42 -1.55 0.00 -1.26 -4.96 120.51 113.58 2kui n ALA 493 Ca 0.08 -2.82 -0.31 0.00 0.00 0.00 0.00 53.44 50.38 2kui n ALA 493 Cb 0.47 -0.74 -0.13 0.00 0.00 0.00 0.00 19.45 19.05 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 -3.09 2.64 -0.06 0.00 -4.23 -1.26 -0.49 115.64 109.14 2kui s THR 494 Ca 0.44 -1.13 -0.16 0.00 -1.18 0.00 0.00 61.69 59.65 2kui s THR 494 Cb 0.38 -2.06 0.03 0.00 1.34 0.00 0.00 72.50 72.19 2kui s THR 494 CO 0.03 0.42 0.38 -0.75 -0.54 0.00 0.00 174.62 174.16 2kui s LYS 495 N -1.18 0.65 -0.01 3.99 2.20 0.44 -4.89 119.74 120.95 2kui s LYS 495 Ca 0.13 0.08 -0.24 0.00 -0.36 0.00 0.00 55.97 55.58 2kui s LYS 495 Cb -0.10 0.30 -0.05 0.00 -1.51 0.00 0.00 37.83 36.47 2kui s LYS 495 CO 0.03 -0.16 0.73 0.16 -0.36 0.00 0.00 175.35 175.75 2kui s ASP 496 N -0.87 7.10 0.20 1.43 -4.77 -1.26 -1.32 116.67 117.19 2kui s ASP 496 Ca -0.09 1.32 -0.30 0.00 -3.30 0.00 0.00 52.55 50.18 2kui s ASP 496 Cb -0.04 -2.44 -0.08 0.00 -1.09 0.00 0.00 42.92 39.27 2kui s ASP 496 CO 0.04 -0.04 1.04 0.27 0.70 0.00 0.00 175.17 177.17 2kui s ILE 497 N 0.33 3.95 0.79 2.11 -4.36 -0.34 -4.83 121.20 118.86 2kui s ILE 497 Ca 0.38 1.79 -0.08 0.00 -0.26 0.00 0.00 60.65 62.48 2kui s ILE 497 Cb -0.19 -4.14 0.13 0.00 1.25 0.00 0.00 42.46 39.51 2kui s ILE 497 CO 0.21 0.35 1.11 -2.16 0.24 0.00 0.00 174.94 174.69 2kui s PRO 498 N -0.71 1.53 -0.15 0.37 0.04 -1.26 0.04 135.00 134.86 2kui s PRO 498 Ca 0.46 -0.57 -0.12 0.00 0.04 0.00 0.00 61.00 60.80 2kui s PRO 498 Cb -0.28 -2.12 -0.05 0.00 0.04 0.00 0.00 34.50 32.10 2kui s PRO 498 CO 0.34 -1.69 0.25 0.34 0.04 0.00 0.00 177.00 176.29 2kui s ASP 499 N -4.71 6.42 -0.25 6.66 2.15 -1.26 -4.69 116.67 120.98 2kui s ASP 499 Ca 0.67 0.49 -0.02 0.00 0.43 0.00 0.00 52.55 54.11 2kui s ASP 499 Cb -0.07 -2.15 0.11 0.00 -0.30 0.00 0.00 42.92 40.51 2kui s ASP 499 CO 0.47 0.18 0.24 0.54 -0.17 0.00 0.00 175.17 176.43 2kui s VAL 500 N 0.08 -0.32 -0.09 1.11 0.11 -1.26 -5.11 120.40 114.92 2kui s VAL 500 Ca 0.15 -0.38 -0.08 0.00 -2.93 0.00 0.00 61.98 58.74 2kui s VAL 500 Cb -0.13 -0.86 0.02 0.00 -1.53 0.00 0.00 36.38 33.88 2kui s VAL 500 CO 0.04 -0.40 0.24 0.00 -3.33 0.00 0.00 175.10 171.64 2kui s ALA 501 N 2.31 -0.58 0.00 1.54 0.00 -1.26 -3.68 121.76 120.08 2kui s ALA 501 Ca 0.08 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.71 2kui s ALA 501 Cb -0.15 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.58 2kui s ALA 501 CO -0.25 -0.11 0.00 0.41 0.00 0.00 0.00 175.76 175.81 2kui n GLY 502 N 2.96 2.37 3.83 0.00 0.00 -0.36 -4.97 105.19 109.02 2kui n GLY 502 Ca -0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.68 2kui n GLY 502 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kui n GLN 503 N -0.61 0.22 -3.22 1.61 6.02 -1.26 -4.83 117.38 115.31 2kui n GLN 503 Ca 0.00 -2.85 -0.27 0.00 -0.01 0.00 0.00 57.00 53.87 2kui n GLN 503 Cb 0.00 -0.46 -0.02 0.00 1.02 0.00 0.00 30.24 30.78 2kui n GLN 503 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 2kui s THR 504 N -2.81 5.02 0.25 5.09 -1.32 -1.26 -0.32 115.64 120.30 2kui s THR 504 Ca 0.63 -0.06 -0.03 0.00 -1.21 0.00 0.00 61.69 61.02 2kui s THR 504 Cb -0.04 -3.79 0.23 0.00 -1.51 0.00 0.00 72.50 67.38 2kui s THR 504 CO 0.41 -0.49 1.79 1.62 -2.21 0.00 0.00 174.62 175.74 2kui h VAL 505 N 0.98 0.82 -0.56 5.08 3.04 -1.12 0.24 116.25 124.73 2kui h VAL 505 Ca -0.48 -0.24 -0.07 0.00 -1.01 0.00 0.00 66.70 64.89 2kui h VAL 505 Cb 1.20 0.05 -0.02 0.00 -2.01 0.00 0.00 31.29 30.51 2kui h VAL 505 CO 0.64 0.13 0.07 -0.78 -1.01 0.00 0.00 177.57 176.61 2kui h ASP 506 N 0.71 0.91 -0.19 3.17 3.58 -1.94 0.29 116.42 122.96 2kui h ASP 506 Ca 0.43 -0.27 -0.10 0.00 0.42 0.00 0.00 57.03 57.51 2kui h ASP 506 Cb 0.50 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.30 2kui h ASP 506 CO -0.30 0.96 -0.26 0.58 -2.88 0.00 0.00 179.24 177.34 2kui h VAL 507 N 0.84 1.34 -0.14 2.25 2.07 -1.80 -2.02 116.25 118.79 2kui h VAL 507 Ca 0.17 -1.47 -0.00 0.00 0.82 0.00 0.00 66.70 66.22 2kui h VAL 507 Cb 0.45 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 32.06 2kui h VAL 507 CO 0.02 0.45 0.08 0.00 0.02 0.00 0.00 177.57 178.13 2kui h ALA 508 N 0.61 0.18 -0.68 1.67 0.00 -0.80 -0.55 119.26 119.69 2kui h ALA 508 Ca 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2kui h ALA 508 Cb 0.83 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2kui h ALA 508 CO 0.06 -0.29 0.43 0.37 0.00 0.00 0.00 179.25 179.82 2kui h GLN 509 N 0.13 0.91 -0.62 0.00 4.15 -0.97 -1.53 115.11 117.18 2kui h GLN 509 Ca 0.05 -0.07 -0.04 0.00 0.77 0.00 0.00 58.65 59.37 2kui h GLN 509 Cb 0.06 -0.20 -0.03 0.00 0.21 0.00 0.00 27.48 27.53 2kui h GLN 509 CO -0.01 0.62 0.25 -0.22 -1.93 0.00 0.00 178.83 177.54 2kui h LYS 510 N 0.92 0.92 -0.72 1.69 3.64 -1.04 -0.54 116.57 121.44 2kui h LYS 510 Ca 0.25 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 2kui h LYS 510 Cb -0.07 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.57 2kui h LYS 510 CO -0.05 0.78 0.35 -0.91 -2.27 0.00 0.00 179.45 177.35 2kui h ASN 511 N 0.86 0.93 -0.38 4.20 2.35 -0.60 -1.19 115.58 121.75 2kui h ASN 511 Ca 0.21 -0.13 -0.08 0.00 -0.55 0.00 0.00 56.30 55.74 2kui h ASN 511 Cb 0.20 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.31 2kui h ASN 511 CO -0.02 0.80 -0.05 -0.07 -1.65 0.00 0.00 177.43 176.45 2kui h LEU 512 N 1.00 0.76 -0.93 1.61 3.38 -0.81 -2.08 115.31 118.25 2kui h LEU 512 Ca 0.25 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 2kui h LEU 512 Cb 0.11 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2kui h LEU 512 CO -0.03 0.86 0.12 0.78 0.09 0.00 0.00 178.44 180.25 2kui h ASN 513 N 0.72 0.85 0.01 -0.43 -0.26 -0.53 -1.64 115.58 114.31 2kui h ASN 513 Ca 0.13 -0.17 -0.03 0.00 -0.56 0.00 0.00 56.30 55.68 2kui h ASN 513 Cb 0.51 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.54 2kui h ASN 513 CO 0.03 0.84 -0.07 0.58 -1.06 0.00 0.00 177.43 177.75 2kui h VAL 514 N 0.86 1.11 0.00 2.81 2.07 -0.58 -0.97 116.25 121.55 2kui h VAL 514 Ca 0.18 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2kui h VAL 514 Cb 0.34 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 2kui h VAL 514 CO 0.00 0.15 0.00 -1.22 0.02 0.00 0.00 177.57 176.52 2kui n TYR 515 N -4.38 0.00 0.00 1.57 4.01 -0.66 -4.85 117.16 112.85 2kui n TYR 515 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 2kui n TYR 515 Cb 0.19 -0.34 0.00 0.00 -0.31 0.00 0.00 39.34 38.89 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 0.97 0.67 3.42 2.72 0.00 -0.37 -5.03 105.19 107.57 2kui n GLY 516 Ca 0.11 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.69 2kui n GLY 516 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kui s PHE 517 N -2.00 2.83 -0.89 1.61 0.08 -0.93 -4.69 117.98 113.99 2kui s PHE 517 Ca 0.00 -0.77 0.24 0.00 0.12 0.00 0.00 56.93 56.52 2kui s PHE 517 Cb 0.00 -4.18 0.37 0.00 -0.57 0.00 0.00 43.02 38.64 2kui s PHE 517 CO 0.00 -1.50 1.31 2.41 -0.10 0.00 0.00 175.22 177.34 2kui n THR 518 N 5.74 0.08 -3.80 0.64 -1.04 -1.26 -3.50 114.28 111.13 2kui n THR 518 Ca -0.04 -0.07 -0.36 0.00 -2.04 0.00 0.00 64.05 61.53 2kui n THR 518 Cb 0.44 0.24 -0.13 0.00 -1.82 0.00 0.00 70.33 69.06 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 -3.05 3.38 0.12 -2.82 1.02 -1.26 -5.06 119.74 112.07 2kui s LYS 519 Ca 0.09 -0.65 0.06 0.00 0.02 0.00 0.00 55.97 55.49 2kui s LYS 519 Cb 0.16 -3.25 -0.04 0.00 -0.52 0.00 0.00 37.83 34.19 2kui s LYS 519 CO 0.73 -0.28 -0.14 -0.59 -0.92 0.00 0.00 175.35 174.15 2kui s PHE 520 N 1.53 1.38 0.01 3.18 -0.12 -1.26 -1.59 117.98 121.11 2kui s PHE 520 Ca 0.05 -0.57 -0.02 0.00 -0.05 0.00 0.00 56.93 56.34 2kui s PHE 520 Cb -0.16 -0.72 -0.01 0.00 -0.63 0.00 0.00 43.02 41.50 2kui s PHE 520 CO 0.01 0.14 0.01 -1.54 -0.05 0.00 0.00 175.22 173.79 2kui s SER 521 N -2.50 0.15 -0.04 1.98 1.04 0.07 -4.88 113.70 109.52 2kui s SER 521 Ca 0.09 -0.34 0.02 0.00 0.48 0.00 0.00 55.95 56.20 2kui s SER 521 Cb -0.04 0.12 0.01 0.00 0.10 0.00 0.00 66.02 66.20 2kui s SER 521 CO 0.03 -0.26 -0.08 0.00 0.98 0.00 0.00 173.24 173.91 2kui s GLN 522 N -1.18 1.01 -0.03 4.02 -2.07 -1.26 -0.10 119.66 120.06 2kui s GLN 522 Ca -0.13 -0.24 0.04 0.00 -1.82 0.00 0.00 55.36 53.21 2kui s GLN 522 Cb -0.08 -0.94 -0.03 0.00 -1.09 0.00 0.00 33.01 30.88 2kui s GLN 522 CO -0.00 0.02 -0.13 0.00 -1.32 0.00 0.00 175.29 173.86 2kui s ALA 523 N 0.54 2.74 -0.10 2.60 0.00 0.54 -4.95 121.76 123.13 2kui s ALA 523 Ca -0.08 -1.01 0.04 0.00 0.00 0.00 0.00 51.96 50.90 2kui s ALA 523 Cb -0.12 -0.98 0.00 0.00 0.00 0.00 0.00 23.12 22.02 2kui s ALA 523 CO 0.01 0.57 -0.22 -1.54 0.00 0.00 0.00 175.76 174.58 2kui s SER 524 N -0.97 2.91 0.35 0.00 1.04 -1.26 -0.07 113.70 115.71 2kui s SER 524 Ca 0.13 -0.53 0.08 0.00 0.48 0.00 0.00 55.95 56.11 2kui s SER 524 Cb -0.11 -1.33 -0.07 0.00 0.10 0.00 0.00 66.02 64.61 2kui s SER 524 CO 0.02 0.13 -0.05 0.68 0.98 0.00 0.00 173.24 175.01 2kui s VAL 525 N 0.47 1.97 -0.01 5.02 -7.23 -0.54 -4.96 120.40 115.12 2kui s VAL 525 Ca -0.16 -2.12 -0.16 0.00 -1.81 0.00 0.00 61.98 57.73 2kui s VAL 525 Cb -0.17 -2.71 -0.06 0.00 0.56 0.00 0.00 36.38 34.00 2kui s VAL 525 CO 0.07 -0.15 0.45 1.51 -0.31 0.00 0.00 175.10 176.66 2kui s ASP 526 N -3.59 6.82 0.25 4.85 -4.77 -1.26 -1.06 116.67 117.91 2kui s ASP 526 Ca 0.33 0.98 0.00 0.00 -3.30 0.00 0.00 52.55 50.56 2kui s ASP 526 Cb 0.05 -2.28 -0.03 0.00 -1.09 0.00 0.00 42.92 39.58 2kui s ASP 526 CO 0.16 0.25 0.23 -0.44 0.70 0.00 0.00 175.17 176.07 2kui s SER 527 N -0.72 0.61 0.34 2.11 0.01 0.14 -4.79 113.70 111.40 2kui s SER 527 Ca 0.25 -1.46 0.25 0.00 1.31 0.00 0.00 55.95 56.30 2kui s SER 527 Cb -0.17 0.47 0.61 0.00 0.21 0.00 0.00 66.02 67.14 2kui s SER 527 CO 0.14 -0.96 1.70 -0.65 0.41 0.00 0.00 173.24 173.88 2kui h PRO 528 N 2.42 0.00 -7.14 12.44 0.11 -1.83 -3.39 132.00 134.61 2kui h PRO 528 Ca -0.31 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.28 2kui h PRO 528 Cb 1.24 0.00 0.11 0.00 0.11 0.00 0.00 31.00 32.46 2kui h PRO 528 CO 0.46 0.00 0.42 1.03 -0.21 0.00 0.00 178.00 179.70 2kui s ARG 529 N -3.19 2.89 0.68 1.05 1.81 -1.26 -4.89 118.95 116.05 2kui s ARG 529 Ca 0.08 1.63 -0.14 0.00 -1.72 0.00 0.00 55.73 55.58 2kui s ARG 529 Cb 0.09 -1.94 0.01 0.00 -0.45 0.00 0.00 34.95 32.65 2kui s ARG 529 CO 0.62 -1.22 1.10 -2.14 -0.68 0.00 0.00 175.30 172.98 2kui s PRO 530 N -3.64 2.73 -0.01 3.54 0.02 -1.26 -2.32 135.00 134.06 2kui s PRO 530 Ca 0.72 1.30 -0.30 0.00 0.02 0.00 0.00 61.00 62.75 2kui s PRO 530 Cb -0.25 -1.95 -0.05 0.00 0.02 0.00 0.00 34.50 32.27 2kui s PRO 530 CO 0.36 -1.29 1.39 0.00 -0.33 0.00 0.00 177.00 177.13 2kui s ALA 531 N -2.51 3.58 0.00 -1.55 0.00 -1.25 -2.46 121.76 117.57 2kui s ALA 531 Ca 0.65 0.86 0.00 0.00 0.00 0.00 0.00 51.96 53.47 2kui s ALA 531 Cb -0.19 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.33 2kui s ALA 531 CO 0.45 -0.92 0.00 0.41 0.00 0.00 0.00 175.76 175.69 2kui n GLY 532 N 3.64 0.82 3.76 0.00 0.00 -0.44 -4.87 105.19 108.10 2kui n GLY 532 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.61 4.66 -0.30 1.61 -6.30 -1.03 -0.57 118.70 116.17 2kui s GLU 533 Ca 0.00 1.28 -0.16 0.00 -2.50 0.00 0.00 54.97 53.59 2kui s GLU 533 Cb 0.00 -3.29 -0.03 0.00 0.00 0.00 0.00 34.13 30.81 2kui s GLU 533 CO 0.00 0.48 0.41 0.54 0.02 0.00 0.00 175.26 176.71 2kui s VAL 534 N -0.88 5.13 -2.20 3.70 0.11 0.56 0.40 120.40 127.23 2kui s VAL 534 Ca 0.39 0.47 0.30 0.00 -2.93 0.00 0.00 61.98 60.22 2kui s VAL 534 Cb -0.24 -3.78 0.76 0.00 -1.53 0.00 0.00 36.38 31.59 2kui s VAL 534 CO 0.28 0.04 2.03 1.07 -3.33 0.00 0.00 175.10 175.19 2kui n THR 535 N 5.20 0.00 0.00 5.04 5.66 -0.33 -1.22 114.28 128.63 2kui n THR 535 Ca -0.07 -0.10 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 2kui n THR 535 Cb 0.50 -0.09 0.00 0.00 -1.55 0.00 0.00 70.33 69.19 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 1.07 0.88 3.49 1.09 0.00 -1.19 -4.82 105.19 105.71 2kui n GLY 536 Ca 0.22 -1.98 -0.26 0.00 0.00 0.00 0.00 46.02 44.00 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 -2.25 2.71 -0.09 2.61 -4.23 -1.26 -0.85 115.64 112.27 2kui s THR 537 Ca 0.00 -1.95 -0.27 0.00 -1.18 0.00 0.00 61.69 58.29 2kui s THR 537 Cb 0.00 -2.34 -0.23 0.00 1.34 0.00 0.00 72.50 71.27 2kui s THR 537 CO 0.00 -0.16 0.93 -1.13 -0.54 0.00 0.00 174.62 173.72 2kui h ASN 538 N 2.92 -0.01 -3.49 3.99 -1.24 -1.50 -3.44 115.58 112.82 2kui h ASN 538 Ca -0.46 -0.78 -0.52 0.00 0.71 0.00 0.00 56.30 55.25 2kui h ASN 538 Cb 1.22 0.00 0.05 0.00 0.73 0.00 0.00 38.32 40.32 2kui h ASN 538 CO 0.52 0.79 0.70 -2.16 -1.29 0.00 0.00 177.43 175.99 2kui s PRO 539 N -2.96 4.32 0.60 6.67 0.04 -1.26 -4.98 135.00 137.43 2kui s PRO 539 Ca -0.17 2.21 -0.18 0.00 0.04 0.00 0.00 61.00 62.89 2kui s PRO 539 Cb -0.01 -3.13 -0.03 0.00 0.04 0.00 0.00 34.50 31.37 2kui s PRO 539 CO 0.66 -0.32 1.20 -2.14 0.04 0.00 0.00 177.00 176.45 2kui s PRO 540 N -0.61 2.93 0.30 0.56 0.02 -1.26 -4.97 135.00 131.97 2kui s PRO 540 Ca 0.56 1.79 -0.29 0.00 0.02 0.00 0.00 61.00 63.08 2kui s PRO 540 Cb -0.40 -1.93 -0.10 0.00 0.02 0.00 0.00 34.50 32.09 2kui s PRO 540 CO 0.44 -1.23 1.36 0.00 -0.33 0.00 0.00 177.00 177.24 2kui s ALA 541 N -1.67 3.54 0.00 -1.55 0.00 -1.26 -2.40 121.76 118.43 2kui s ALA 541 Ca 0.76 1.29 0.00 0.00 0.00 0.00 0.00 51.96 54.01 2kui s ALA 541 Cb -0.29 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.32 2kui s ALA 541 CO 0.34 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 175.82 2kui n GLY 542 N 1.33 0.55 3.66 0.00 0.00 0.11 -4.98 105.19 105.86 2kui n GLY 542 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.12 3.79 -0.19 2.61 2.01 -1.01 -4.67 115.64 116.07 2kui s THR 543 Ca 0.00 1.00 -0.24 0.00 0.31 0.00 0.00 61.69 62.76 2kui s THR 543 Cb 0.00 -3.65 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 2kui s THR 543 CO 0.00 -0.07 0.77 0.28 -0.69 0.00 0.00 174.62 174.91 2kui s THR 544 N 3.61 4.92 0.10 -0.82 -1.32 -1.26 -1.20 115.64 119.67 2kui s THR 544 Ca 0.67 1.49 0.02 0.00 -1.21 0.00 0.00 61.69 62.65 2kui s THR 544 Cb -0.30 -4.08 -0.04 0.00 -1.51 0.00 0.00 72.50 66.57 2kui s THR 544 CO 0.25 0.04 -0.07 0.68 -2.21 0.00 0.00 174.62 173.31 2kui s VAL 545 N 2.16 0.69 0.40 5.08 -7.23 -0.44 -4.87 120.40 116.19 2kui s VAL 545 Ca 0.35 -1.93 -0.27 0.00 -1.81 0.00 0.00 61.98 58.32 2kui s VAL 545 Cb -0.16 -1.68 -0.10 0.00 0.56 0.00 0.00 36.38 35.00 2kui s VAL 545 CO 0.11 -0.87 1.44 -2.84 -0.31 0.00 0.00 175.10 172.62 2kui s PRO 546 N -3.83 3.99 0.64 4.82 0.02 -1.26 -0.42 135.00 138.96 2kui s PRO 546 Ca 0.12 2.46 0.42 0.00 0.02 0.00 0.00 61.00 64.02 2kui s PRO 546 Cb 0.05 -2.86 2.26 0.00 0.02 0.00 0.00 34.50 33.97 2kui s PRO 546 CO -0.05 -0.59 2.29 -0.39 -0.33 0.00 0.00 177.00 177.94 2kui h VAL 547 N 2.72 0.00 -0.01 3.83 -1.51 -1.12 0.34 116.25 120.50 2kui h VAL 547 Ca -0.51 -0.05 0.00 0.00 -1.23 0.00 0.00 66.70 64.91 2kui h VAL 547 Cb 1.25 1.02 0.00 0.00 -2.13 0.00 0.00 31.29 31.43 2kui h VAL 547 CO 0.63 0.00 -0.06 -0.67 -1.23 0.00 0.00 177.57 176.24 2kui n ASP 548 N -3.03 1.39 -4.74 4.19 2.03 -1.26 -4.14 116.55 110.99 2kui n ASP 548 Ca -0.03 -1.35 -0.26 0.00 0.52 0.00 0.00 54.79 53.67 2kui n ASP 548 Cb 0.09 0.03 0.09 0.00 -0.72 0.00 0.00 41.12 40.62 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 -2.12 4.45 -0.15 1.67 0.01 0.11 -4.79 113.70 112.88 2kui s SER 549 Ca 0.35 0.23 -0.08 0.00 1.31 0.00 0.00 55.95 57.75 2kui s SER 549 Cb 0.21 -0.73 -0.04 0.00 0.21 0.00 0.00 66.02 65.66 2kui s SER 549 CO 0.38 -1.82 0.13 0.54 0.41 0.00 0.00 173.24 172.88 2kui s VAL 550 N -3.31 5.45 0.02 3.43 0.11 -1.26 -4.04 120.40 120.81 2kui s VAL 550 Ca 0.64 0.19 0.03 0.00 -2.93 0.00 0.00 61.98 59.91 2kui s VAL 550 Cb -0.08 -3.41 -0.04 0.00 -1.53 0.00 0.00 36.38 31.32 2kui s VAL 550 CO 0.46 0.56 -0.02 0.27 -3.33 0.00 0.00 175.10 173.03 2kui s ILE 551 N -0.54 3.97 -0.29 7.04 -0.00 -0.62 -4.96 121.20 125.80 2kui s ILE 551 Ca 0.12 -0.74 -0.06 0.00 -0.00 0.00 0.00 60.65 59.98 2kui s ILE 551 Cb -0.12 -2.79 0.01 0.00 -0.00 0.00 0.00 42.46 39.57 2kui s ILE 551 CO 0.02 0.33 0.06 -0.70 -0.00 0.00 0.00 174.94 174.65 2kui s GLU 552 N -1.67 3.09 -0.09 0.37 2.12 -1.26 -0.75 118.70 120.50 2kui s GLU 552 Ca 0.20 -0.85 -0.13 0.00 0.36 0.00 0.00 54.97 54.55 2kui s GLU 552 Cb -0.11 -3.32 -0.05 0.00 0.26 0.00 0.00 34.13 30.91 2kui s GLU 552 CO 0.11 -0.42 0.32 -0.51 -0.54 0.00 0.00 175.26 174.22 2kui s LEU 553 N 1.48 4.35 -0.25 2.70 1.02 0.86 -1.21 118.68 127.64 2kui s LEU 553 Ca 0.02 0.68 -0.05 0.00 0.02 0.00 0.00 54.13 54.81 2kui s LEU 553 Cb -0.17 -2.42 -0.00 0.00 0.02 0.00 0.00 46.19 43.62 2kui s LEU 553 CO 0.02 0.22 0.01 0.00 0.02 0.00 0.00 176.35 176.61 2kui s GLN 554 N -0.31 3.29 -0.06 1.70 -2.07 -0.03 -0.34 119.66 121.84 2kui s GLN 554 Ca 0.19 -0.70 -0.09 0.00 -1.82 0.00 0.00 55.36 52.95 2kui s GLN 554 Cb -0.14 -3.15 -0.05 0.00 -1.09 0.00 0.00 33.01 28.58 2kui s GLN 554 CO 0.08 -0.28 0.23 0.08 -1.32 0.00 0.00 175.29 174.08 2kui s VAL 555 N 1.49 5.35 0.28 3.63 1.01 0.91 -1.18 120.40 131.87 2kui s VAL 555 Ca 0.04 0.34 -0.16 0.00 0.00 0.00 0.00 61.98 62.21 2kui s VAL 555 Cb -0.15 -3.51 -0.09 0.00 0.00 0.00 0.00 36.38 32.63 2kui s VAL 555 CO -0.01 0.55 0.71 -0.44 0.00 0.00 0.00 175.10 175.91 2kui s SER 556 N -1.20 6.86 -0.08 3.32 0.01 0.16 -1.46 113.70 121.30 2kui s SER 556 Ca 0.20 1.29 0.03 0.00 1.31 0.00 0.00 55.95 58.79 2kui s SER 556 Cb -0.13 -2.37 0.01 0.00 0.21 0.00 0.00 66.02 63.73 2kui s SER 556 CO 0.09 -0.10 -0.19 -0.75 0.41 0.00 0.00 173.24 172.69 2kui s LYS 557 N -2.59 2.49 0.12 12.44 2.20 -0.22 -1.32 119.74 132.85 2kui s LYS 557 Ca 0.49 -0.69 -0.15 0.00 -0.36 0.00 0.00 55.97 55.27 2kui s LYS 557 Cb -0.13 -1.93 -0.02 0.00 -1.51 0.00 0.00 37.83 34.24 2kui s LYS 557 CO 0.19 0.12 1.57 0.78 -0.36 0.00 0.00 175.35 177.65 2kui h GLY 558 N 6.80 0.77 0.00 5.54 0.00 -1.63 0.41 103.07 114.96 2kui h GLY 558 Ca -0.24 -0.57 0.00 0.00 0.00 0.00 0.00 47.33 46.52 2kui h GLY 558 CO 0.47 0.52 0.00 -2.01 0.00 0.00 0.00 176.54 175.52 2kui n ASN 559 N -4.44 0.00 -4.29 0.19 5.15 -1.26 -4.61 115.26 106.00 2kui n ASN 559 Ca -0.01 0.00 -0.20 0.00 -0.60 0.00 0.00 54.58 53.77 2kui n ASN 559 Cb 0.29 -0.61 -0.11 0.00 -0.53 0.00 0.00 39.78 38.82 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 -0.05 1.16 0.07 1.20 -0.21 -1.26 -2.78 119.66 117.79 2kui s GLN 560 Ca 0.00 -1.34 0.07 0.00 0.02 0.00 0.00 55.36 54.11 2kui s GLN 560 Cb 0.00 -1.11 -0.03 0.00 1.00 0.00 0.00 33.01 32.87 2kui s GLN 560 CO 0.00 0.22 -0.19 -0.59 -2.12 0.00 0.00 175.29 172.61 2kui s PHE 561 N -2.17 1.63 -0.08 0.91 -0.71 0.71 -4.81 117.98 113.45 2kui s PHE 561 Ca 0.13 -0.40 -0.29 0.00 -1.04 0.00 0.00 56.93 55.33 2kui s PHE 561 Cb -0.05 -0.93 -0.06 0.00 -1.21 0.00 0.00 43.02 40.77 2kui s PHE 561 CO 0.05 0.12 1.89 0.08 -1.34 0.00 0.00 175.22 176.02 2kui s VAL 562 N -1.01 3.26 -0.07 -2.49 1.01 -1.26 -0.12 120.40 119.73 2kui s VAL 562 Ca 0.05 0.31 -0.30 0.00 0.00 0.00 0.00 61.98 62.04 2kui s VAL 562 Cb -0.09 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 2kui s VAL 562 CO 0.03 -0.07 1.20 -0.32 0.00 0.00 0.00 175.10 175.94 2kui s MET 563 N 4.80 4.34 1.08 2.72 1.75 0.33 -4.91 119.30 129.41 2kui s MET 563 Ca 0.84 1.67 -0.13 0.00 -1.25 0.00 0.00 55.69 56.83 2kui s MET 563 Cb -0.35 -3.57 0.23 0.00 2.84 0.00 0.00 34.83 33.98 2kui s MET 563 CO 0.35 -0.47 1.06 -2.14 -0.65 0.00 0.00 175.02 173.18 2kui s PRO 564 N 2.32 -0.21 -0.37 4.11 0.02 -1.26 -1.42 135.00 138.20 2kui s PRO 564 Ca 0.56 0.66 -0.22 0.00 0.02 0.00 0.00 61.00 62.02 2kui s PRO 564 Cb -0.24 -1.65 0.01 0.00 0.02 0.00 0.00 34.50 32.63 2kui s PRO 564 CO 0.21 -3.20 0.71 0.34 -0.33 0.00 0.00 177.00 174.73 2kui s ASP 565 N -3.03 6.48 0.00 2.53 2.15 -1.26 -4.70 116.67 118.84 2kui s ASP 565 Ca 0.67 0.21 0.00 0.00 0.43 0.00 0.00 52.55 53.86 2kui s ASP 565 Cb -0.21 -2.36 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 2kui s ASP 565 CO 0.61 -0.68 0.36 0.18 -0.17 0.00 0.00 175.17 175.47 2kui n LEU 566 N 6.25 0.72 -4.75 -1.34 7.99 -1.26 -5.09 117.00 119.53 2kui n LEU 566 Ca 0.01 -0.72 -0.35 0.00 -0.01 0.00 0.00 56.01 54.93 2kui n LEU 566 Cb 0.48 0.00 0.05 0.00 -0.11 0.00 0.00 43.42 43.84 2kui n LEU 566 CO 0.52 0.18 0.83 -0.44 -1.51 0.00 0.00 177.39 176.96 2kui s SER 567 N -0.01 4.99 0.00 -1.43 0.01 -1.26 -4.01 113.70 111.99 2kui s SER 567 Ca 0.00 2.35 0.00 0.00 1.31 0.00 0.00 55.95 59.61 2kui s SER 567 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2kui s SER 567 CO 0.00 -1.72 0.00 0.61 0.41 0.00 0.00 173.24 172.54 2kui n GLY 568 N 0.40 1.09 3.51 3.44 0.00 -1.26 -5.09 105.19 107.28 2kui n GLY 568 Ca 0.13 -0.35 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 2kui n GLY 568 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2kui s MET 569 N -2.33 1.84 0.75 1.61 0.00 -1.26 -4.91 119.30 115.00 2kui s MET 569 Ca 0.00 -1.54 -0.08 0.00 0.00 0.00 0.00 55.69 54.07 2kui s MET 569 Cb 0.00 -1.94 0.08 0.00 0.00 0.00 0.00 34.83 32.97 2kui s MET 569 CO 0.00 0.37 1.07 -0.06 0.00 0.00 0.00 175.02 176.41 2kui s PHE 570 N -2.11 2.66 0.37 3.16 0.08 -1.26 -1.69 117.98 119.19 2kui s PHE 570 Ca 0.27 0.41 0.06 0.00 0.12 0.00 0.00 56.93 57.79 2kui s PHE 570 Cb -0.07 -3.33 0.72 0.00 -0.57 0.00 0.00 43.02 39.77 2kui s PHE 570 CO 0.15 -1.63 1.95 2.35 -0.10 0.00 0.00 175.22 177.93 2kui h TRP 571 N -0.78 0.49 0.00 0.36 7.01 -1.66 0.18 115.95 121.56 2kui h TRP 571 Ca -0.44 -0.03 0.00 0.00 2.11 0.00 0.00 58.89 60.53 2kui h TRP 571 Cb 1.30 -0.15 0.00 0.00 -2.10 0.00 0.00 29.16 28.21 2kui h TRP 571 CO 0.12 0.44 0.00 1.33 -2.79 0.00 0.00 178.44 177.54 2kui n VAL 572 N -4.35 0.61 -0.13 2.65 0.24 -1.26 -1.52 118.33 114.57 2kui n VAL 572 Ca 0.02 0.15 -0.23 0.00 -2.04 0.00 0.00 64.34 62.24 2kui n VAL 572 Cb 0.18 -0.84 -0.11 0.00 -1.47 0.00 0.00 33.84 31.60 2kui n VAL 572 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2kui n ASP 573 N -1.40 1.97 0.19 -1.34 8.00 -0.31 -4.52 116.55 119.15 2kui n ASP 573 Ca 0.06 0.09 -0.15 0.00 0.71 0.00 0.00 54.79 55.51 2kui n ASP 573 Cb 0.18 -0.58 -0.08 0.00 -0.02 0.00 0.00 41.12 40.62 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 -0.46 -0.42 -0.04 2.24 0.00 -0.40 -2.48 119.26 117.70 2kui h ALA 574 Ca -0.61 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.20 2kui h ALA 574 Cb 1.73 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.66 2kui h ALA 574 CO -0.24 -0.71 -0.06 1.49 0.00 0.00 0.00 179.25 179.73 2kui h GLU 575 N -0.47 -0.08 -0.88 0.00 4.22 -1.53 0.14 114.58 115.99 2kui h GLU 575 Ca -0.04 0.01 0.05 0.00 0.08 0.00 0.00 59.36 59.45 2kui h GLU 575 Cb 0.35 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.57 2kui h GLU 575 CO 0.07 -0.05 0.57 -1.35 -2.18 0.00 0.00 179.01 176.07 2kui h PRO 576 N -0.09 1.02 -0.22 0.92 0.11 -1.79 -2.16 132.00 129.79 2kui h PRO 576 Ca 0.04 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 65.99 2kui h PRO 576 Cb 0.14 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.00 2kui h PRO 576 CO -0.09 0.68 -0.29 0.00 -0.21 0.00 0.00 178.00 178.09 2kui h ARG 577 N 1.05 0.44 -0.67 1.05 -0.00 -0.80 -0.10 114.38 115.35 2kui h ARG 577 Ca 0.36 -0.17 -0.00 0.00 -0.50 0.00 0.00 59.98 59.66 2kui h ARG 577 Cb 0.10 -0.02 -0.03 0.00 0.00 0.00 0.00 29.97 30.01 2kui h ARG 577 CO -0.12 0.69 0.41 -0.07 0.00 0.00 0.00 179.97 180.88 2kui h LEU 578 N 0.38 0.79 -0.30 3.04 3.38 -0.12 0.80 115.31 123.28 2kui h LEU 578 Ca 0.05 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2kui h LEU 578 Cb 0.70 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2kui h LEU 578 CO 0.05 0.61 0.09 0.03 0.09 0.00 0.00 178.44 179.31 2kui h ARG 579 N 0.90 0.48 -0.78 1.13 3.08 -1.06 -1.31 114.38 116.82 2kui h ARG 579 Ca 0.24 -0.11 -0.03 0.00 0.07 0.00 0.00 59.98 60.15 2kui h ARG 579 Cb -0.04 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 29.90 2kui h ARG 579 CO -0.05 0.54 0.36 0.00 -1.07 0.00 0.00 179.97 179.75 2kui h ALA 580 N 0.92 1.17 -0.00 0.04 0.00 -0.39 -2.60 119.26 118.39 2kui h ALA 580 Ca 0.10 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2kui h ALA 580 Cb 0.27 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2kui h ALA 580 CO -0.00 0.63 -0.10 1.28 0.00 0.00 0.00 179.25 181.05 2kui n LEU 581 N -4.31 0.13 -1.56 0.00 4.32 0.22 -4.89 117.00 110.91 2kui n LEU 581 Ca 0.07 0.34 -0.12 0.00 -0.02 0.00 0.00 56.01 56.29 2kui n LEU 581 Cb 0.15 -0.40 0.01 0.00 -1.62 0.00 0.00 43.42 41.55 2kui n LEU 581 CO 0.40 0.03 -0.08 0.61 -1.22 0.00 0.00 177.39 177.12 2kui n GLY 582 N 1.46 -0.06 3.74 -0.72 0.00 -0.98 -4.95 105.19 103.68 2kui n GLY 582 Ca 0.08 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.73 2.79 -0.08 1.61 -0.00 -0.51 -4.91 118.94 115.11 2kui s TRP 583 Ca 0.08 0.70 0.12 0.00 -0.00 0.00 0.00 56.10 57.00 2kui s TRP 583 Cb -0.03 -4.08 0.18 0.00 -0.00 0.00 0.00 33.47 29.54 2kui s TRP 583 CO 0.10 -3.72 1.08 -2.37 -0.00 0.00 0.00 176.95 172.04 2kui n THR 584 N 2.55 1.23 0.00 5.86 5.66 -1.25 -4.89 114.28 123.44 2kui n THR 584 Ca 0.10 -1.46 0.00 0.00 -3.05 0.00 0.00 64.05 59.63 2kui n THR 584 Cb 0.37 0.05 0.00 0.00 -1.55 0.00 0.00 70.33 69.20 2kui n THR 584 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kui n GLY 585 N -0.92 0.04 3.13 1.09 0.00 -1.20 -4.98 105.19 102.35 2kui n GLY 585 Ca 0.10 -1.56 -0.27 0.00 0.00 0.00 0.00 46.02 44.28 2kui n GLY 585 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2kui s MET 586 N 0.00 2.10 -0.16 1.61 -1.94 -1.26 -5.01 119.30 114.65 2kui s MET 586 Ca 0.00 -0.64 -0.05 0.00 -1.71 0.00 0.00 55.69 53.29 2kui s MET 586 Cb 0.00 -1.73 -0.03 0.00 2.01 0.00 0.00 34.83 35.08 2kui s MET 586 CO 0.00 0.18 0.00 -1.17 -0.01 0.00 0.00 175.02 174.02 2kui s LEU 587 N 0.27 3.50 -0.19 -0.03 2.96 -1.26 -4.50 118.68 119.41 2kui s LEU 587 Ca -0.10 -0.03 -0.02 0.00 -0.22 0.00 0.00 54.13 53.76 2kui s LEU 587 Cb -0.14 -1.86 -0.00 0.00 0.50 0.00 0.00 46.19 44.69 2kui s LEU 587 CO 0.04 0.19 -0.10 -0.62 -1.32 0.00 0.00 176.35 174.54 2kui s ASP 588 N 0.27 3.97 -0.27 3.68 2.15 -1.26 -5.09 116.67 120.12 2kui s ASP 588 Ca -0.00 -0.44 -0.08 0.00 0.43 0.00 0.00 52.55 52.46 2kui s ASP 588 Cb -0.13 -1.65 -0.02 0.00 -0.30 0.00 0.00 42.92 40.81 2kui s ASP 588 CO 0.02 0.02 0.10 -0.75 -0.17 0.00 0.00 175.17 174.39 2kui s LYS 589 N 1.22 3.54 0.00 4.34 2.20 -1.26 -4.83 119.74 124.95 2kui s LYS 589 Ca 0.02 -0.57 0.00 0.00 -0.36 0.00 0.00 55.97 55.07 2kui s LYS 589 Cb -0.14 -3.41 0.00 0.00 -1.51 0.00 0.00 37.83 32.77 2kui s LYS 589 CO -0.04 -0.27 0.00 0.41 -0.36 0.00 0.00 175.35 175.09 2kui n GLY 590 N 4.94 0.27 3.76 5.54 0.00 -1.26 -5.04 105.19 113.41 2kui n GLY 590 Ca -0.15 -1.82 -0.37 0.00 0.00 0.00 0.00 46.02 43.68 2kui n GLY 590 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kui s ALA 591 N -3.18 2.80 -0.21 4.61 0.00 -1.26 -4.98 121.76 119.54 2kui s ALA 591 Ca 0.00 1.00 -0.16 0.00 0.00 0.00 0.00 51.96 52.80 2kui s ALA 591 Cb 0.00 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 2kui s ALA 591 CO 0.00 -0.91 0.43 -0.51 0.00 0.00 0.00 175.76 174.77 2kui s ASP 592 N -1.41 6.46 -0.16 0.00 1.01 -1.26 -4.86 116.67 116.44 2kui s ASP 592 Ca 0.70 0.54 -0.01 0.00 0.71 0.00 0.00 52.55 54.49 2kui s ASP 592 Cb -0.30 -2.25 -0.01 0.00 1.01 0.00 0.00 42.92 41.37 2kui s ASP 592 CO 0.35 -0.12 -0.13 -0.69 0.21 0.00 0.00 175.17 174.80 2kui s VAL 593 N 1.47 2.93 -0.23 -1.27 1.01 -1.26 -4.97 120.40 118.09 2kui s VAL 593 Ca 0.20 -0.68 -0.09 0.00 0.00 0.00 0.00 61.98 61.41 2kui s VAL 593 Cb -0.15 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 2kui s VAL 593 CO 0.09 0.51 0.11 1.51 0.00 0.00 0.00 175.10 177.31 2kui s ASP 594 N 0.73 5.75 0.00 3.32 -4.77 -1.26 0.09 116.67 120.53 2kui s ASP 594 Ca -0.06 0.03 0.00 0.00 -3.30 0.00 0.00 52.55 49.22 2kui s ASP 594 Cb -0.15 -2.02 0.00 0.00 -1.09 0.00 0.00 42.92 39.65 2kui s ASP 594 CO 0.01 0.07 0.00 0.00 0.70 0.00 0.00 175.17 175.96 2kui n ALA 595 N 4.21 1.26 0.00 2.11 0.00 -1.26 -4.95 120.51 121.88 2kui n ALA 595 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2kui n ALA 595 Cb 0.52 0.08 0.00 0.00 0.00 0.00 0.00 19.45 20.04 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 1.30 3.81 0.36 0.00 0.00 -1.23 -4.91 105.19 104.52 2kui n GLY 596 Ca 0.00 -0.88 0.09 0.00 0.00 0.00 0.00 46.02 45.24 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 0.96 1.80 -0.02 0.00 -1.74 0.11 103.07 104.18 2kui h GLY 597 Ca 0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.02 2kui h GLY 597 CO 0.00 0.17 -0.03 1.76 0.00 0.00 0.00 176.54 178.44 2kui h SER 598 N 0.68 0.23 -0.01 0.19 0.02 -1.94 -2.72 113.55 110.00 2kui h SER 598 Ca 0.35 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2kui h SER 598 Cb 0.45 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.93 2kui h SER 598 CO -0.13 0.30 -0.10 0.00 -1.14 0.00 0.00 176.83 175.76 2kui n GLN 599 N -4.36 1.25 0.00 3.45 1.13 -0.46 -5.04 117.38 113.35 2kui n GLN 599 Ca -0.00 -1.02 0.00 0.00 -1.94 0.00 0.00 57.00 54.04 2kui n GLN 599 Cb 0.19 -1.20 0.00 0.00 0.11 0.00 0.00 30.24 29.34 2kui n GLN 599 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 2kui n HIS 600 N 0.34 0.00 -0.68 1.08 -0.00 0.25 -4.94 115.22 111.27 2kui n HIS 600 Ca 0.06 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.24 2kui n HIS 600 Cb 0.29 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.16 2kui n HIS 600 CO 0.00 0.00 0.00 -1.71 0.46 0.00 0.00 176.34 175.09 2kui n ASN 601 N 0.00 -1.62 -4.82 0.26 4.05 -1.13 -4.64 115.26 107.35 2kui n ASN 601 Ca 0.00 0.00 -0.24 0.00 0.45 0.00 0.00 54.58 54.79 2kui n ASN 601 Cb 0.00 -2.49 -0.05 0.00 1.23 0.00 0.00 39.78 38.47 2kui n ASN 601 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2kui s ARG 602 N -1.14 2.35 0.19 1.20 1.70 -1.26 -1.63 118.95 120.35 2kui s ARG 602 Ca 0.00 -1.77 -0.33 0.00 -0.47 0.00 0.00 55.73 53.16 2kui s ARG 602 Cb 0.00 -2.14 -0.13 0.00 -0.57 0.00 0.00 34.95 32.11 2kui s ARG 602 CO 0.00 -0.24 1.61 1.55 -1.08 0.00 0.00 175.30 177.15 2kui n VAL 603 N -1.45 0.16 -0.11 4.99 3.14 -0.68 -4.08 118.33 120.29 2kui n VAL 603 Ca 0.00 -0.04 -0.15 0.00 -2.96 0.00 0.00 64.34 61.20 2kui n VAL 603 Cb 0.63 -1.70 -0.12 0.00 -1.06 0.00 0.00 33.84 31.59 2kui n VAL 603 CO 0.00 0.00 0.00 1.33 -6.46 0.00 0.00 176.83 171.70 2kui n VAL 604 N 3.37 1.37 -3.72 1.55 0.24 0.15 -4.83 118.33 116.45 2kui n VAL 604 Ca 0.16 -0.61 -0.13 0.00 -2.04 0.00 0.00 64.34 61.71 2kui n VAL 604 Cb 0.31 -1.12 -0.07 0.00 -1.47 0.00 0.00 33.84 31.49 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 -2.48 -0.21 0.03 6.34 -0.85 -1.26 -5.04 117.35 113.88 2kui s TYR 605 Ca -0.26 0.21 0.05 0.00 -0.52 0.00 0.00 57.07 56.55 2kui s TYR 605 Cb 0.08 0.15 -0.02 0.00 0.38 0.00 0.00 41.96 42.54 2kui s TYR 605 CO 0.62 -0.49 -0.16 1.14 -1.52 0.00 0.00 175.55 175.15 2kui s GLN 606 N -2.03 1.09 -0.05 -3.49 -2.07 -1.26 -2.83 119.66 109.02 2kui s GLN 606 Ca -0.08 -0.76 -0.24 0.00 -1.82 0.00 0.00 55.36 52.45 2kui s GLN 606 Cb -0.02 -1.12 -0.19 0.00 -1.09 0.00 0.00 33.01 30.59 2kui s GLN 606 CO 0.00 0.28 1.03 -0.97 -1.32 0.00 0.00 175.29 174.32 2kui h ASN 607 N 5.07 -0.08 -3.57 12.60 -1.24 -1.16 -3.40 115.58 123.80 2kui h ASN 607 Ca -0.38 -0.50 -0.69 0.00 0.71 0.00 0.00 56.30 55.43 2kui h ASN 607 Cb 1.17 0.02 -0.19 0.00 0.73 0.00 0.00 38.32 40.05 2kui h ASN 607 CO 0.45 0.50 -0.29 -2.16 -1.29 0.00 0.00 177.43 174.64 2kui s PRO 608 N -3.63 3.19 0.77 6.67 0.05 -1.26 -5.03 135.00 135.77 2kui s PRO 608 Ca -0.15 -0.74 -0.11 0.00 0.05 0.00 0.00 61.00 60.05 2kui s PRO 608 Cb 0.00 -3.93 0.06 0.00 0.05 0.00 0.00 34.50 30.69 2kui s PRO 608 CO 0.59 -0.73 1.11 -2.14 0.05 0.00 0.00 177.00 175.87 2kui s PRO 609 N 1.98 2.16 0.26 0.56 0.02 -1.26 -4.90 135.00 133.81 2kui s PRO 609 Ca 0.10 1.27 -0.31 0.00 0.02 0.00 0.00 61.00 62.09 2kui s PRO 609 Cb -0.17 -1.88 -0.12 0.00 0.02 0.00 0.00 34.50 32.35 2kui s PRO 609 CO 0.12 -1.73 1.66 0.00 -0.33 0.00 0.00 177.00 176.72 2kui s ALA 610 N -2.76 3.84 0.00 -1.55 0.00 -1.26 -1.65 121.76 118.38 2kui s ALA 610 Ca 0.63 1.59 0.00 0.00 0.00 0.00 0.00 51.96 54.19 2kui s ALA 610 Cb -0.19 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.26 2kui s ALA 610 CO 0.54 -0.97 0.00 0.41 0.00 0.00 0.00 175.76 175.74 2kui n GLY 611 N 2.95 0.69 3.90 0.00 0.00 -0.50 -5.01 105.19 107.22 2kui n GLY 611 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 2kui n GLY 611 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kui s THR 612 N -2.08 4.95 -0.12 2.61 2.01 -0.66 -4.65 115.64 117.70 2kui s THR 612 Ca 0.00 0.17 -0.29 0.00 0.31 0.00 0.00 61.69 61.88 2kui s THR 612 Cb 0.00 -3.77 -0.01 0.00 0.01 0.00 0.00 72.50 68.72 2kui s THR 612 CO 0.00 -0.50 0.97 -0.83 -0.69 0.00 0.00 174.62 173.57 2kui s GLY 613 N -3.45 2.31 -0.06 4.40 0.00 -1.26 -0.51 107.32 108.75 2kui s GLY 613 Ca 0.46 0.31 -0.00 0.00 0.00 0.00 0.00 44.72 45.49 2kui s GLY 613 CO 0.34 1.87 -0.01 -1.34 0.00 0.00 0.00 173.10 173.96 2kui s VAL 614 N 2.02 4.19 1.00 1.40 -7.23 0.83 -4.75 120.40 117.85 2kui s VAL 614 Ca 0.46 -0.39 -0.11 0.00 -1.81 0.00 0.00 61.98 60.13 2kui s VAL 614 Cb -0.18 -2.79 0.19 0.00 0.56 0.00 0.00 36.38 34.16 2kui s VAL 614 CO 0.17 0.53 1.09 0.54 -0.31 0.00 0.00 175.10 177.12 2kui s ASN 615 N -1.09 2.39 0.56 4.85 4.22 -1.26 -0.21 114.94 124.40 2kui s ASN 615 Ca 0.15 1.77 0.27 0.00 -2.14 0.00 0.00 52.86 52.92 2kui s ASN 615 Cb -0.11 -2.38 1.63 0.00 1.28 0.00 0.00 41.25 41.67 2kui s ASN 615 CO 0.05 -3.36 2.18 0.08 -2.04 0.00 0.00 177.10 174.00 2kui h ARG 616 N -2.05 0.00 -0.37 3.55 0.11 -1.90 0.30 114.38 114.02 2kui h ARG 616 Ca -0.51 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 59.45 2kui h ARG 616 Cb 1.29 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.36 2kui h ARG 616 CO 0.48 0.05 -0.26 0.22 0.10 0.00 0.00 179.97 180.57 2kui h ASP 617 N 0.00 0.77 0.00 0.08 3.58 -1.90 -3.48 116.42 115.47 2kui h ASP 617 Ca -0.00 -0.29 0.00 0.00 0.42 0.00 0.00 57.03 57.16 2kui h ASP 617 Cb 0.13 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 40.97 2kui h ASP 617 CO 0.01 0.99 0.00 0.61 -2.88 0.00 0.00 179.24 177.97 2kui n GLY 618 N -0.19 0.68 3.65 -0.78 0.00 0.09 -3.23 105.19 105.42 2kui n GLY 618 Ca -0.00 -0.55 -0.43 0.00 0.00 0.00 0.00 46.02 45.04 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 3.80 -0.07 -0.61 -1.16 -1.26 -4.76 121.20 115.15 2kui s ILE 619 Ca 0.00 0.95 0.02 0.00 -0.51 0.00 0.00 60.65 61.11 2kui s ILE 619 Cb 0.00 -3.69 0.01 0.00 0.61 0.00 0.00 42.46 39.40 2kui s ILE 619 CO 0.00 -0.17 -0.12 -0.51 -2.81 0.00 0.00 174.94 171.33 2kui s ILE 620 N 4.32 1.10 -0.30 2.00 -1.16 -1.26 -4.79 121.20 121.10 2kui s ILE 620 Ca 0.68 -0.45 -0.12 0.00 -0.51 0.00 0.00 60.65 60.25 2kui s ILE 620 Cb -0.27 -1.01 -0.04 0.00 0.61 0.00 0.00 42.46 41.75 2kui s ILE 620 CO 0.26 0.35 0.22 -0.89 -2.81 0.00 0.00 174.94 172.07 2kui s THR 621 N 0.74 5.29 0.06 4.00 2.01 -1.26 -4.84 115.64 121.63 2kui s THR 621 Ca -0.13 0.06 0.03 0.00 0.31 0.00 0.00 61.69 61.96 2kui s THR 621 Cb -0.16 -3.61 -0.03 0.00 0.01 0.00 0.00 72.50 68.72 2kui s THR 621 CO 0.03 0.15 -0.10 -1.48 -0.69 0.00 0.00 174.62 172.52 2kui s LEU 622 N 1.77 2.28 -0.01 4.42 2.34 -1.26 -0.45 118.68 127.77 2kui s LEU 622 Ca 0.07 -0.60 0.03 0.00 0.06 0.00 0.00 54.13 53.69 2kui s LEU 622 Cb -0.16 -0.30 -0.01 0.00 -0.56 0.00 0.00 46.19 45.16 2kui s LEU 622 CO 0.11 -0.16 -0.09 -0.60 -1.06 0.00 0.00 176.35 174.54 2kui s ARG 623 N -1.75 0.76 0.11 1.48 3.52 -1.13 -4.79 118.95 117.16 2kui s ARG 623 Ca -0.06 -0.32 -0.01 0.00 -0.13 0.00 0.00 55.73 55.21 2kui s ARG 623 Cb -0.09 -0.74 -0.04 0.00 -1.56 0.00 0.00 34.95 32.52 2kui s ARG 623 CO 0.01 0.18 0.04 -0.59 -0.81 0.00 0.00 175.30 174.13 2kui s PHE 624 N -0.15 0.75 0.00 5.12 -0.12 -1.26 0.31 117.98 122.63 2kui s PHE 624 Ca 0.03 -1.18 0.00 0.00 -0.05 0.00 0.00 56.93 55.73 2kui s PHE 624 Cb -0.04 -0.45 0.00 0.00 -0.63 0.00 0.00 43.02 41.90 2kui s PHE 624 CO -0.00 -0.48 0.00 0.41 -0.05 0.00 0.00 175.22 175.09 2kui n GLY 625 N -0.04 5.27 0.00 1.99 0.00 -1.26 -4.77 105.19 106.38 2kui n GLY 625 Ca -0.08 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.43 2kui n GLY 625 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26