#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 4.09 0.15 -0.61 1.10 -1.26 -5.00 121.20 119.67 2kui s ILE 356 Ca 0.00 1.24 0.10 0.00 -0.51 0.00 0.00 60.65 61.47 2kui s ILE 356 Cb 0.00 -4.09 -0.04 0.00 0.15 0.00 0.00 42.46 38.48 2kui s ILE 356 CO 0.00 -0.43 -0.18 -0.89 -2.11 0.00 0.00 174.94 171.33 2kui s THR 357 N 4.43 2.78 -0.03 4.00 2.01 -1.26 -5.01 115.64 122.55 2kui s THR 357 Ca 0.58 -1.67 -0.05 0.00 0.31 0.00 0.00 61.69 60.86 2kui s THR 357 Cb -0.18 -2.31 -0.21 0.00 0.01 0.00 0.00 72.50 69.81 2kui s THR 357 CO 0.23 0.00 3.37 0.54 -0.69 0.00 0.00 174.62 178.08 2kui n ARG 358 N 0.52 1.92 -4.07 4.92 1.74 -1.26 -4.78 116.66 115.64 2kui n ARG 358 Ca -0.14 -0.99 -0.31 0.00 -0.77 0.00 0.00 57.85 55.64 2kui n ARG 358 Cb 0.54 -1.90 -0.07 0.00 -1.02 0.00 0.00 32.46 30.02 2kui n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2kui s ASP 359 N 1.87 5.58 0.23 0.55 1.01 -1.26 -4.61 116.67 120.04 2kui s ASP 359 Ca 0.59 0.04 0.08 0.00 0.71 0.00 0.00 52.55 53.97 2kui s ASP 359 Cb 0.29 -1.53 -0.05 0.00 1.01 0.00 0.00 42.92 42.64 2kui s ASP 359 CO -0.02 0.20 -0.12 0.68 0.21 0.00 0.00 175.17 176.13 2kui s VAL 360 N -1.33 1.76 -0.04 -1.27 -7.23 0.15 -4.80 120.40 107.64 2kui s VAL 360 Ca 0.27 -2.20 -0.14 0.00 -1.81 0.00 0.00 61.98 58.10 2kui s VAL 360 Cb -0.12 -2.19 -0.05 0.00 0.56 0.00 0.00 36.38 34.58 2kui s VAL 360 CO 0.19 -0.49 0.38 -1.58 -0.31 0.00 0.00 175.10 173.29 2kui s GLN 361 N -3.66 3.95 -0.20 4.82 0.74 -1.26 -0.24 119.66 123.81 2kui s GLN 361 Ca 0.25 0.33 -0.15 0.00 0.05 0.00 0.00 55.36 55.84 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 0.09 0.60 0.36 0.08 -0.55 0.00 0.00 175.29 175.87 2kui s VAL 362 N -0.74 5.23 0.07 1.34 1.01 0.08 -4.98 120.40 122.41 2kui s VAL 362 Ca 0.22 0.64 -0.31 0.00 0.00 0.00 0.00 61.98 62.53 2kui s VAL 362 Cb -0.16 -3.69 -0.09 0.00 0.00 0.00 0.00 36.38 32.44 2kui s VAL 362 CO 0.11 0.28 1.80 -2.84 0.00 0.00 0.00 175.10 174.45 2kui s PRO 363 N 1.13 4.16 0.27 2.72 0.02 -1.26 -4.35 135.00 137.69 2kui s PRO 363 Ca 0.18 2.49 -0.25 0.00 0.02 0.00 0.00 61.00 63.43 2kui s PRO 363 Cb -0.14 -3.76 -0.09 0.00 0.02 0.00 0.00 34.50 30.52 2kui s PRO 363 CO 0.07 -0.84 0.88 0.16 -0.33 0.00 0.00 177.00 176.94 2kui s ASP 364 N 3.08 7.34 -0.07 2.53 -4.77 -1.26 -4.95 116.67 118.57 2kui s ASP 364 Ca 0.80 1.75 0.10 0.00 -3.30 0.00 0.00 52.55 51.90 2kui s ASP 364 Cb -0.42 -2.54 0.15 0.00 -1.09 0.00 0.00 42.92 39.02 2kui s ASP 364 CO 0.36 0.02 1.04 0.55 0.70 0.00 0.00 175.17 177.84 2kui n VAL 365 N 0.86 1.12 -1.96 2.11 3.14 -1.26 -5.07 118.33 117.26 2kui n VAL 365 Ca -0.00 -1.32 -0.38 0.00 -2.96 0.00 0.00 64.34 59.68 2kui n VAL 365 Cb 0.50 0.15 0.02 0.00 -1.06 0.00 0.00 33.84 33.45 2kui n VAL 365 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kui s ARG 366 N -1.64 3.32 0.00 1.45 3.03 -1.26 -3.84 118.95 120.01 2kui s ARG 366 Ca 0.17 2.04 0.00 0.00 2.03 0.00 0.00 55.73 59.96 2kui s ARG 366 Cb 0.15 -2.26 0.00 0.00 -1.03 0.00 0.00 34.95 31.80 2kui s ARG 366 CO 0.02 -0.99 0.00 0.41 -1.13 0.00 0.00 175.30 173.61 2kui n GLY 367 N 0.61 0.65 0.00 3.88 0.00 0.70 -4.96 105.19 106.07 2kui n GLY 367 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2kui n GLY 367 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kui n GLN 368 N -1.50 3.79 -3.22 1.61 6.02 -1.23 -4.95 117.38 117.90 2kui n GLN 368 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.71 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 0.50 6.42 0.36 1.08 1.04 -1.26 -1.63 113.70 120.21 2kui s SER 369 Ca 0.00 0.75 0.06 0.00 0.48 0.00 0.00 55.95 57.24 2kui s SER 369 Cb 0.00 -2.16 0.70 0.00 0.10 0.00 0.00 66.02 64.66 2kui s SER 369 CO 0.00 -0.27 1.93 0.28 0.98 0.00 0.00 173.24 176.16 2kui h SER 370 N 1.39 0.44 -0.20 7.02 0.02 -1.90 0.11 113.55 120.44 2kui h SER 370 Ca -0.48 -0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 60.37 2kui h SER 370 Cb 1.19 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.61 2kui h SER 370 CO 0.65 0.48 -0.03 0.00 -1.14 0.00 0.00 176.83 176.79 2kui h ALA 371 N 1.59 0.27 -0.30 3.77 0.00 -1.93 0.14 119.26 122.80 2kui h ALA 371 Ca 0.11 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 2kui h ALA 371 Cb 0.24 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2kui h ALA 371 CO 0.00 0.02 -0.22 0.22 0.00 0.00 0.00 179.25 179.27 2kui h ASP 372 N 0.10 0.71 -0.07 0.00 1.82 -1.87 -0.23 116.42 116.87 2kui h ASP 372 Ca 0.05 -0.44 -0.00 0.00 -0.39 0.00 0.00 57.03 56.25 2kui h ASP 372 Cb 0.45 -0.20 -0.00 0.00 0.68 0.00 0.00 39.33 40.26 2kui h ASP 372 CO 0.02 1.00 0.03 0.00 -1.61 0.00 0.00 179.24 178.67 2kui h ALA 373 N 0.73 0.09 -0.35 -0.78 0.00 -0.76 -0.26 119.26 117.93 2kui h ALA 373 Ca 0.06 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 2kui h ALA 373 Cb 0.77 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2kui h ALA 373 CO 0.06 -0.32 -0.34 0.82 0.00 0.00 0.00 179.25 179.46 2kui h ILE 374 N -0.05 1.28 -0.28 0.00 5.03 -0.75 -2.00 117.51 120.74 2kui h ILE 374 Ca 0.02 -1.51 -0.00 0.00 -0.12 0.00 0.00 64.86 63.26 2kui h ILE 374 Cb 0.17 1.38 -0.01 0.00 -3.03 0.00 0.00 36.82 35.33 2kui h ILE 374 CO -0.00 0.50 0.18 0.00 -0.68 0.00 0.00 178.15 178.14 2kui h ALA 375 N 0.95 0.36 -0.30 1.87 0.00 -0.86 0.23 119.26 121.51 2kui h ALA 375 Ca 0.07 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2kui h ALA 375 Cb 0.89 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2kui h ALA 375 CO 0.08 -0.15 0.18 1.15 0.00 0.00 0.00 179.25 180.51 2kui h THR 376 N 0.37 1.11 -0.70 0.00 2.02 -0.96 -0.50 112.91 114.23 2kui h THR 376 Ca 0.10 -0.25 -0.05 0.00 0.77 0.00 0.00 66.41 66.98 2kui h THR 376 Cb -0.00 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 67.11 2kui h THR 376 CO -0.02 0.11 0.25 0.25 0.37 0.00 0.00 175.52 176.47 2kui h LEU 377 N 0.38 0.98 -0.74 2.58 6.46 -1.07 -1.46 115.31 122.45 2kui h LEU 377 Ca 0.11 -0.16 -0.06 0.00 -0.12 0.00 0.00 57.88 57.65 2kui h LEU 377 Cb 0.01 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 39.66 2kui h LEU 377 CO -0.02 0.90 0.24 -0.61 -0.62 0.00 0.00 178.44 178.33 2kui h GLN 378 N 1.03 1.14 0.00 1.25 5.75 -0.18 -1.68 115.11 122.41 2kui h GLN 378 Ca 0.23 -0.24 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2kui h GLN 378 Cb 0.25 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 28.63 2kui h GLN 378 CO -0.01 0.96 0.00 -0.91 -2.65 0.00 0.00 178.83 176.22 2kui h ASN 379 N 1.08 0.00 1.15 -0.69 2.35 -0.39 -0.74 115.58 118.34 2kui h ASN 379 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 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 0.00 -0.32 0.54 -1.65 0.00 0.00 177.43 175.99 2kui n ARG 380 N -2.71 0.27 -0.18 0.81 5.12 -0.62 -4.93 116.66 114.42 2kui n ARG 380 Ca 0.01 0.15 0.00 0.00 -1.93 0.00 0.00 57.85 56.08 2kui n ARG 380 Cb 0.27 -1.74 0.00 0.00 -1.16 0.00 0.00 32.46 29.84 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 1.33 0.85 3.90 -0.13 0.00 -0.29 -4.91 105.19 105.94 2kui n GLY 381 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.07 3.00 0.11 1.61 0.08 -0.89 -4.22 117.98 115.60 2kui s PHE 382 Ca 0.00 0.76 0.07 0.00 0.12 0.00 0.00 56.93 57.88 2kui s PHE 382 Cb 0.00 -3.39 -0.04 0.00 -0.57 0.00 0.00 43.02 39.02 2kui s PHE 382 CO 0.00 -1.64 -0.09 0.15 -0.10 0.00 0.00 175.22 173.55 2kui s LYS 383 N -5.50 2.18 0.06 0.44 -0.14 -0.29 -4.50 119.74 111.99 2kui s LYS 383 Ca 0.61 -1.02 0.05 0.00 -1.36 0.00 0.00 55.97 54.26 2kui s LYS 383 Cb -0.11 -2.33 -0.03 0.00 -1.68 0.00 0.00 37.83 33.69 2kui s LYS 383 CO 0.49 0.51 -0.14 0.96 -0.76 0.00 0.00 175.35 176.41 2kui s ILE 384 N -1.26 1.09 -0.07 2.17 -0.00 -1.26 -0.44 121.20 121.43 2kui s ILE 384 Ca 0.22 -1.23 0.01 0.00 -0.00 0.00 0.00 60.65 59.65 2kui s ILE 384 Cb -0.11 -1.04 -0.03 0.00 -0.00 0.00 0.00 42.46 41.28 2kui s ILE 384 CO 0.14 -0.18 -0.07 -0.60 -0.00 0.00 0.00 174.94 174.23 2kui s ARG 385 N -1.61 2.75 -0.09 0.37 6.06 0.83 -4.81 118.95 122.45 2kui s ARG 385 Ca -0.02 -0.56 -0.01 0.00 -2.50 0.00 0.00 55.73 52.64 2kui s ARG 385 Cb -0.10 -2.58 0.03 0.00 0.06 0.00 0.00 34.95 32.36 2kui s ARG 385 CO 0.02 0.65 -0.02 0.99 -2.50 0.00 0.00 175.30 174.44 2kui s THR 386 N -0.77 0.57 -0.23 4.11 2.01 -1.26 -0.06 115.64 120.01 2kui s THR 386 Ca 0.12 -0.05 -0.04 0.00 0.31 0.00 0.00 61.69 62.02 2kui s THR 386 Cb -0.11 -0.72 -0.01 0.00 0.01 0.00 0.00 72.50 71.67 2kui s THR 386 CO 0.01 0.25 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.42 2kui s LEU 387 N 1.89 3.06 -0.26 4.42 2.01 0.40 -4.97 118.68 125.22 2kui s LEU 387 Ca 0.04 -0.41 -0.10 0.00 0.01 0.00 0.00 54.13 53.68 2kui s LEU 387 Cb -0.13 -1.77 -0.04 0.00 0.01 0.00 0.00 46.19 44.26 2kui s LEU 387 CO -0.06 -0.04 0.14 0.00 1.01 0.00 0.00 176.35 177.40 2kui s GLN 388 N 1.49 3.87 0.00 1.70 0.00 -1.26 -0.50 119.66 124.96 2kui s GLN 388 Ca 0.05 -0.37 0.00 0.00 -0.00 0.00 0.00 55.36 55.05 2kui s GLN 388 Cb -0.15 -3.53 -0.00 0.00 0.00 0.00 0.00 33.01 29.33 2kui s GLN 388 CO -0.02 -0.15 -0.01 0.15 0.00 0.00 0.00 175.29 175.26 2kui s LYS 389 N 1.61 0.10 1.13 9.60 1.02 -0.48 -4.94 119.74 127.77 2kui s LYS 389 Ca 0.07 -0.09 -0.16 0.00 0.02 0.00 0.00 55.97 55.80 2kui s LYS 389 Cb -0.15 -0.06 0.25 0.00 -0.52 0.00 0.00 37.83 37.35 2kui s LYS 389 CO 0.08 0.01 1.09 -2.14 -0.92 0.00 0.00 175.35 173.48 2kui s PRO 390 N -0.16 -0.66 0.00 -1.68 0.02 -1.20 -0.71 135.00 130.61 2kui s PRO 390 Ca -0.01 0.20 0.00 0.00 0.02 0.00 0.00 61.00 61.21 2kui s PRO 390 Cb -0.01 -1.64 0.00 0.00 0.02 0.00 0.00 34.50 32.87 2kui s PRO 390 CO -0.00 -3.39 0.00 -0.25 -0.33 0.00 0.00 177.00 173.03 2kui n ASP 391 N -4.58 0.00 -0.06 2.53 8.00 0.46 -4.81 116.55 118.08 2kui n ASP 391 Ca 0.09 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.63 2kui n ASP 391 Cb 0.58 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.74 2kui n ASP 391 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2kui n SER 392 N -0.95 2.18 0.13 -2.24 7.64 -1.26 -4.55 113.62 114.57 2kui n SER 392 Ca 0.00 -2.38 0.13 0.00 1.01 0.00 0.00 58.87 57.63 2kui n SER 392 Cb 0.00 -0.16 0.40 0.00 -1.01 0.00 0.00 64.21 63.44 2kui n SER 392 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2kui h THR 393 N 0.10 0.00 -3.34 0.44 2.02 -1.98 -3.44 112.91 106.71 2kui h THR 393 Ca 0.00 -0.52 -0.65 0.00 0.77 0.00 0.00 66.41 66.01 2kui h THR 393 Cb 0.69 1.47 -0.15 0.00 -1.74 0.00 0.00 68.15 68.42 2kui h THR 393 CO 0.00 0.00 -0.74 0.27 0.37 0.00 0.00 175.52 175.43 2kui s ILE 394 N -3.17 3.27 0.88 3.11 -0.00 -1.26 -5.11 121.20 118.91 2kui s ILE 394 Ca 0.09 -1.44 -0.14 0.00 -0.00 0.00 0.00 60.65 59.15 2kui s ILE 394 Cb 0.11 -2.56 -0.01 0.00 -0.00 0.00 0.00 42.46 39.99 2kui s ILE 394 CO 0.57 0.02 0.28 -0.81 -0.00 0.00 0.00 174.94 175.00 2kui n PRO 395 N 0.43 -0.08 -0.71 0.37 -0.04 -1.26 -4.79 135.00 128.91 2kui n PRO 395 Ca -0.13 0.02 -0.32 0.00 -0.04 0.00 0.00 63.50 63.03 2kui n PRO 395 Cb 0.54 -1.73 0.16 0.00 -0.04 0.00 0.00 33.50 32.42 2kui n PRO 395 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2kui n PRO 396 N -0.84 -0.64 0.00 0.54 -0.02 -1.26 -3.43 135.00 129.34 2kui n PRO 396 Ca 0.07 -0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 2kui n PRO 396 Cb 0.53 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 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 -2.86 0.00 -4.51 2.55 5.75 -1.26 -4.42 116.55 111.80 2kui n ASP 397 Ca 0.08 0.45 -0.31 0.00 -0.01 0.00 0.00 54.79 55.00 2kui n ASP 397 Cb 0.54 -0.45 -0.12 0.00 -1.03 0.00 0.00 41.12 40.06 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 -2.89 2.66 -0.15 2.11 3.76 -1.26 -4.18 115.29 115.33 2kui s HIS 398 Ca 0.00 -0.19 -0.29 0.00 -0.15 0.00 0.00 55.06 54.42 2kui s HIS 398 Cb 0.00 -1.48 -0.03 0.00 1.11 0.00 0.00 32.58 32.18 2kui s HIS 398 CO 0.00 0.31 1.42 0.14 -0.85 0.00 0.00 174.74 175.76 2kui s VAL 399 N -1.00 4.00 -0.16 -0.90 -7.23 -0.65 -4.81 120.40 109.65 2kui s VAL 399 Ca 0.16 1.19 0.17 0.00 -1.81 0.00 0.00 61.98 61.70 2kui s VAL 399 Cb -0.11 -3.82 -0.25 0.00 0.56 0.00 0.00 36.38 32.76 2kui s VAL 399 CO 0.07 -0.16 0.23 0.00 -0.31 0.00 0.00 175.10 174.93 2kui n ILE 400 N 5.60 1.31 -3.94 -0.62 0.00 -1.26 -0.21 119.36 120.24 2kui n ILE 400 Ca 0.15 -0.81 -0.09 0.00 0.00 0.00 0.00 62.75 62.00 2kui n ILE 400 Cb 0.44 -0.53 -0.07 0.00 0.00 0.00 0.00 39.64 39.48 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 -5.32 0.36 0.35 4.50 0.00 -1.26 -4.34 107.32 101.61 2kui s GLY 401 Ca -0.09 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 43.81 2kui s GLY 401 CO 0.83 -0.87 0.01 -1.30 0.00 0.00 0.00 173.10 171.78 2kui n THR 402 N -0.14 0.00 -3.77 0.90 -2.24 -1.26 -4.87 114.28 102.90 2kui n THR 402 Ca -0.10 -1.63 -0.36 0.00 -2.27 0.00 0.00 64.05 59.68 2kui n THR 402 Cb 0.63 0.31 -0.07 0.00 -2.10 0.00 0.00 70.33 69.09 2kui n THR 402 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2kui s ASP 403 N -2.92 6.33 0.47 3.42 2.15 -1.26 -4.97 116.67 119.90 2kui s ASP 403 Ca 0.01 0.39 0.21 0.00 0.43 0.00 0.00 52.55 53.59 2kui s ASP 403 Cb -0.00 -2.10 1.15 0.00 -0.30 0.00 0.00 42.92 41.67 2kui s ASP 403 CO 0.01 0.28 1.60 -0.65 -0.17 0.00 0.00 175.17 176.23 2kui h PRO 404 N 5.85 0.00 -0.28 4.34 0.11 -1.99 -0.28 132.00 139.74 2kui h PRO 404 Ca -0.48 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2kui h PRO 404 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2kui h PRO 404 CO 0.68 0.00 0.13 0.00 -0.21 0.00 0.00 178.00 178.60 2kui h ALA 405 N 1.32 1.71 -0.02 -0.75 0.00 -1.91 -0.29 119.26 119.32 2kui h ALA 405 Ca 0.00 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.70 2kui h ALA 405 Cb 0.58 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2kui h ALA 405 CO 0.00 0.24 -0.64 0.00 0.00 0.00 0.00 179.25 178.85 2kui h ALA 406 N 1.76 0.89 0.00 0.00 0.00 -1.34 -2.64 119.26 117.93 2kui h ALA 406 Ca 0.10 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2kui h ALA 406 Cb 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2kui h ALA 406 CO -0.01 0.79 -0.05 0.09 0.00 0.00 0.00 179.25 180.06 2kui n ASN 407 N -3.80 0.17 -4.90 0.00 5.03 -0.27 -0.74 115.26 110.75 2kui n ASN 407 Ca -0.02 0.44 -0.31 0.00 0.87 0.00 0.00 54.58 55.56 2kui n ASN 407 Cb 0.64 -0.47 -0.04 0.00 -1.02 0.00 0.00 39.78 38.89 2kui n ASN 407 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2kui s THR 408 N -3.02 5.21 -0.43 3.41 2.01 -0.34 -4.90 115.64 117.59 2kui s THR 408 Ca 0.13 -0.07 -0.28 0.00 0.31 0.00 0.00 61.69 61.78 2kui s THR 408 Cb 0.18 -3.63 0.02 0.00 0.01 0.00 0.00 72.50 69.09 2kui s THR 408 CO 0.56 0.05 1.07 -0.44 -0.69 0.00 0.00 174.62 175.17 2kui s SER 409 N -2.47 6.68 0.36 3.53 0.01 -1.26 -3.97 113.70 116.59 2kui s SER 409 Ca 0.40 0.56 0.06 0.00 1.31 0.00 0.00 55.95 58.27 2kui s SER 409 Cb -0.12 -2.52 -0.07 0.00 0.21 0.00 0.00 66.02 63.51 2kui s SER 409 CO 0.25 -1.09 0.02 0.68 0.41 0.00 0.00 173.24 173.51 2kui s VAL 410 N 4.06 1.66 0.28 3.43 -7.23 0.67 -4.72 120.40 118.53 2kui s VAL 410 Ca 0.45 -2.02 -0.29 0.00 -1.81 0.00 0.00 61.98 58.30 2kui s VAL 410 Cb -0.09 -2.85 -0.10 0.00 0.56 0.00 0.00 36.38 33.89 2kui s VAL 410 CO 0.26 -0.04 1.39 -0.44 -0.31 0.00 0.00 175.10 175.96 2kui s SER 411 N -3.59 6.69 -0.20 4.85 0.01 -1.26 -0.68 113.70 119.52 2kui s SER 411 Ca 0.35 2.68 -0.29 0.00 1.31 0.00 0.00 55.95 60.00 2kui s SER 411 Cb 0.09 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.65 2kui s SER 411 CO 0.16 -0.64 1.76 0.00 0.41 0.00 0.00 173.24 174.93 2kui s ALA 412 N -0.44 3.18 0.00 1.44 0.00 -1.26 -3.08 121.76 121.61 2kui s ALA 412 Ca 0.55 0.59 0.00 0.00 0.00 0.00 0.00 51.96 53.10 2kui s ALA 412 Cb -0.41 -3.90 0.00 0.00 0.00 0.00 0.00 23.12 18.81 2kui s ALA 412 CO 0.47 -2.10 0.00 0.41 0.00 0.00 0.00 175.76 174.54 2kui n GLY 413 N 4.89 0.99 2.55 0.00 0.00 -1.26 -4.97 105.19 107.40 2kui n GLY 413 Ca 0.21 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.03 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 2.55 -4.63 1.61 2.03 -1.18 -4.53 116.55 112.41 2kui n ASP 414 Ca 0.00 -2.40 -0.41 0.00 0.52 0.00 0.00 54.79 52.49 2kui n ASP 414 Cb 0.00 0.10 -0.05 0.00 -0.72 0.00 0.00 41.12 40.45 2kui n ASP 414 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2kui s GLU 415 N -3.41 4.11 -0.21 -0.67 0.41 -1.26 -1.14 118.70 116.54 2kui s GLU 415 Ca 0.11 0.72 -0.03 0.00 -0.41 0.00 0.00 54.97 55.36 2kui s GLU 415 Cb -0.01 -3.66 -0.01 0.00 -1.78 0.00 0.00 34.13 28.67 2kui s GLU 415 CO 0.07 -0.50 -0.06 0.42 -0.49 0.00 0.00 175.26 174.70 2kui s ILE 416 N 2.72 3.32 -0.14 -1.63 -1.09 0.41 -4.92 121.20 119.88 2kui s ILE 416 Ca 0.31 -0.52 -0.17 0.00 -2.23 0.00 0.00 60.65 58.04 2kui s ILE 416 Cb -0.15 -2.49 -0.04 0.00 -1.58 0.00 0.00 42.46 38.19 2kui s ILE 416 CO 0.09 0.44 0.43 -0.89 -1.23 0.00 0.00 174.94 173.78 2kui s THR 417 N 1.30 5.21 -0.04 2.92 2.01 -1.26 -0.12 115.64 125.66 2kui s THR 417 Ca 0.04 0.84 0.05 0.00 0.31 0.00 0.00 61.69 62.92 2kui s THR 417 Cb -0.14 -3.77 -0.01 0.00 0.01 0.00 0.00 72.50 68.59 2kui s THR 417 CO -0.02 0.33 -0.19 0.54 -0.69 0.00 0.00 174.62 174.58 2kui s VAL 418 N 0.70 1.59 -0.17 3.82 0.11 0.92 -4.00 120.40 123.37 2kui s VAL 418 Ca 0.23 -0.82 -0.05 0.00 -2.93 0.00 0.00 61.98 58.41 2kui s VAL 418 Cb -0.15 -1.36 -0.03 0.00 -1.53 0.00 0.00 36.38 33.31 2kui s VAL 418 CO 0.08 0.45 0.00 0.20 -3.33 0.00 0.00 175.10 172.51 2kui s ASN 419 N -0.07 5.05 -0.07 3.54 0.01 -1.26 -0.45 114.94 121.68 2kui s ASN 419 Ca -0.02 -0.09 0.04 0.00 -0.71 0.00 0.00 52.86 52.08 2kui s ASN 419 Cb -0.12 -1.85 0.00 0.00 0.41 0.00 0.00 41.25 39.70 2kui s ASN 419 CO 0.02 0.14 -0.19 0.54 -1.51 0.00 0.00 177.10 176.10 2kui s VAL 420 N 0.53 1.66 -0.24 1.60 0.11 0.34 -4.71 120.40 119.69 2kui s VAL 420 Ca -0.01 -0.80 -0.15 0.00 -2.93 0.00 0.00 61.98 58.10 2kui s VAL 420 Cb -0.14 -1.44 -0.04 0.00 -1.53 0.00 0.00 36.38 33.23 2kui s VAL 420 CO 0.02 0.47 0.35 -0.44 -3.33 0.00 0.00 175.10 172.17 2kui s SER 421 N 0.34 6.30 -0.29 3.54 0.01 -1.22 -1.39 113.70 120.99 2kui s SER 421 Ca -0.13 0.35 0.03 0.00 1.31 0.00 0.00 55.95 57.51 2kui s SER 421 Cb -0.16 -2.20 0.07 0.00 0.21 0.00 0.00 66.02 63.94 2kui s SER 421 CO 0.06 -0.10 -0.05 0.28 0.41 0.00 0.00 173.24 173.83 2kui s THR 422 N 1.61 2.28 0.00 1.44 -1.32 0.11 -4.40 115.64 115.36 2kui s THR 422 Ca 0.15 -1.83 0.00 0.00 -1.21 0.00 0.00 61.69 58.80 2kui s THR 422 Cb -0.15 -2.45 0.00 0.00 -1.51 0.00 0.00 72.50 68.39 2kui s THR 422 CO 0.08 -0.21 0.00 0.61 -2.21 0.00 0.00 174.62 172.89 2kui n GLY 423 N 4.40 0.13 3.65 6.08 0.00 -1.26 -3.25 105.19 114.94 2kui n GLY 423 Ca -0.09 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 44.88 2kui n GLY 423 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2kui n PRO 424 N 0.08 -0.16 -2.37 1.61 -0.04 -1.26 -0.41 135.00 132.46 2kui n PRO 424 Ca 0.00 0.03 -0.38 0.00 -0.04 0.00 0.00 63.50 63.11 2kui n PRO 424 Cb 0.00 -2.34 -0.03 0.00 -0.04 0.00 0.00 33.50 31.09 2kui n PRO 424 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2kui s GLU 425 N -4.27 4.14 0.15 0.54 2.02 -1.26 -4.67 118.70 115.34 2kui s GLU 425 Ca 0.69 1.75 0.10 0.00 0.02 0.00 0.00 54.97 57.53 2kui s GLU 425 Cb -0.26 -2.69 -0.04 0.00 0.10 0.00 0.00 34.13 31.24 2kui s GLU 425 CO 0.56 -0.22 -0.18 -0.65 0.02 0.00 0.00 175.26 174.79 2kui s GLN 426 N -2.26 1.77 0.18 1.61 -1.52 -1.26 -4.37 119.66 113.80 2kui s GLN 426 Ca 0.56 -1.28 0.10 0.00 -1.95 0.00 0.00 55.36 52.79 2kui s GLN 426 Cb -0.29 -2.06 -0.04 0.00 -0.22 0.00 0.00 33.01 30.40 2kui s GLN 426 CO 0.36 0.45 -0.21 1.03 -0.25 0.00 0.00 175.29 176.67 2kui s ARG 427 N -2.40 1.39 0.15 2.91 1.81 0.42 -4.91 118.95 118.33 2kui s ARG 427 Ca 0.20 -1.46 -0.26 0.00 -1.72 0.00 0.00 55.73 52.48 2kui s ARG 427 Cb -0.10 -1.57 -0.08 0.00 -0.45 0.00 0.00 34.95 32.76 2kui s ARG 427 CO 0.11 0.33 0.80 -1.83 -0.68 0.00 0.00 175.30 174.03 2kui s GLU 428 N -2.74 4.60 -0.11 3.54 -1.05 -1.26 -0.07 118.70 121.60 2kui s GLU 428 Ca 0.18 1.19 -0.24 0.00 -0.15 0.00 0.00 54.97 55.96 2kui s GLU 428 Cb -0.07 -3.28 -0.03 0.00 -0.44 0.00 0.00 34.13 30.31 2kui s GLU 428 CO 0.08 0.51 0.72 0.42 0.95 0.00 0.00 175.26 177.95 2kui s ILE 429 N -0.95 5.00 0.56 1.83 1.01 -0.91 -4.90 121.20 122.86 2kui s ILE 429 Ca 0.37 1.46 -0.18 0.00 0.00 0.00 0.00 60.65 62.29 2kui s ILE 429 Cb -0.23 -4.05 -0.05 0.00 0.01 0.00 0.00 42.46 38.14 2kui s ILE 429 CO 0.27 0.18 1.12 -2.84 0.00 0.00 0.00 174.94 173.66 2kui s PRO 430 N 1.29 3.27 0.27 2.79 0.02 -1.26 -4.41 135.00 136.96 2kui s PRO 430 Ca 0.36 1.54 -0.29 0.00 0.02 0.00 0.00 61.00 62.63 2kui s PRO 430 Cb -0.17 -2.00 -0.10 0.00 0.02 0.00 0.00 34.50 32.25 2kui s PRO 430 CO 0.16 -0.90 1.28 0.16 -0.33 0.00 0.00 177.00 177.36 2kui s ASP 431 N -1.98 6.90 -0.27 2.53 -4.77 -1.26 -4.79 116.67 113.03 2kui s ASP 431 Ca 0.71 2.51 0.00 0.00 -3.30 0.00 0.00 52.55 52.47 2kui s ASP 431 Cb -0.22 -2.63 0.05 0.00 -1.09 0.00 0.00 42.92 39.02 2kui s ASP 431 CO 0.30 -0.47 -0.06 0.54 0.70 0.00 0.00 175.17 176.18 2kui s VAL 432 N -0.64 2.63 0.33 2.11 0.11 -1.26 -4.97 120.40 118.71 2kui s VAL 432 Ca 0.51 -1.40 -0.29 0.00 -2.93 0.00 0.00 61.98 57.88 2kui s VAL 432 Cb -0.37 -2.48 -0.10 0.00 -1.53 0.00 0.00 36.38 31.90 2kui s VAL 432 CO 0.45 -0.00 1.35 -0.94 -3.33 0.00 0.00 175.10 172.63 2kui s SER 433 N 1.21 6.69 0.43 3.54 1.04 -1.26 -4.89 113.70 120.46 2kui s SER 433 Ca -0.05 2.75 0.13 0.00 0.48 0.00 0.00 55.95 59.25 2kui s SER 433 Cb -0.19 -2.65 0.95 0.00 0.10 0.00 0.00 66.02 64.23 2kui s SER 433 CO -0.04 -0.61 1.99 0.71 0.98 0.00 0.00 173.24 176.27 2kui h THR 434 N 3.07 1.13 0.00 2.02 1.35 -1.98 0.92 112.91 119.42 2kui h THR 434 Ca -0.49 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 2kui h THR 434 Cb 1.23 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.86 2kui h THR 434 CO 0.66 0.18 -0.58 0.00 -0.25 0.00 0.00 175.52 175.53 2kui n LEU 435 N -4.34 0.55 -2.56 3.87 -0.00 -1.26 0.15 117.00 113.42 2kui n LEU 435 Ca -0.02 0.02 -0.34 0.00 -0.00 0.00 0.00 56.01 55.67 2kui n LEU 435 Cb 0.23 -0.22 0.04 0.00 -0.00 0.00 0.00 43.42 43.47 2kui n LEU 435 CO 0.37 0.10 1.14 0.41 -0.00 0.00 0.00 177.39 179.40 2kui n THR 436 N -1.63 3.28 -0.27 1.47 -1.04 0.32 -4.71 114.28 111.70 2kui n THR 436 Ca 0.05 -3.98 0.02 0.00 -2.04 0.00 0.00 64.05 58.11 2kui n THR 436 Cb 0.36 -1.21 0.24 0.00 -1.82 0.00 0.00 70.33 67.90 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 2.53 1.02 -0.55 -1.42 3.20 -1.74 -2.45 116.97 117.54 2kui h TYR 437 Ca 0.51 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.38 2kui h TYR 437 Cb 0.59 -0.34 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 2kui h TYR 437 CO 1.16 0.58 0.22 0.00 -1.64 0.00 0.00 178.16 178.48 2kui h ALA 438 N 1.51 1.34 -0.79 1.82 0.00 -1.95 0.43 119.26 121.62 2kui h ALA 438 Ca 0.34 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 2kui h ALA 438 Cb 0.06 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 2kui h ALA 438 CO -0.11 0.49 0.35 1.49 0.00 0.00 0.00 179.25 181.48 2kui h GLU 439 N 0.79 1.15 -0.54 0.00 4.57 -1.84 -1.87 114.58 116.85 2kui h GLU 439 Ca 0.19 -0.18 -0.04 0.00 -1.18 0.00 0.00 59.36 58.15 2kui h GLU 439 Cb 0.17 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 2kui h GLU 439 CO -0.02 0.91 0.18 0.00 -1.18 0.00 0.00 179.01 178.90 2kui h ALA 440 N 1.25 0.71 -0.18 2.92 0.00 -0.78 -1.78 119.26 121.39 2kui h ALA 440 Ca 0.27 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2kui h ALA 440 Cb 0.16 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2kui h ALA 440 CO -0.03 0.35 0.05 0.28 0.00 0.00 0.00 179.25 179.90 2kui h VAL 441 N 0.74 0.94 -0.48 0.00 2.07 -0.50 0.13 116.25 119.15 2kui h VAL 441 Ca 0.18 -0.05 -0.11 0.00 0.82 0.00 0.00 66.70 67.54 2kui h VAL 441 Cb 0.26 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 2kui h VAL 441 CO -0.01 0.02 -0.15 0.07 0.02 0.00 0.00 177.57 177.53 2kui h LYS 442 N 0.13 0.94 -0.55 1.57 2.10 -1.26 -1.83 116.57 117.68 2kui h LYS 442 Ca 0.08 -0.37 -0.09 0.00 -2.00 0.00 0.00 60.65 58.26 2kui h LYS 442 Cb 0.06 -0.05 -0.02 0.00 -0.90 0.00 0.00 32.23 31.33 2kui h LYS 442 CO -0.09 1.04 -0.02 0.87 -2.00 0.00 0.00 179.45 179.24 2kui h LYS 443 N 0.79 0.98 -0.66 0.07 1.79 -0.99 -0.19 116.57 118.37 2kui h LYS 443 Ca 0.12 -0.33 -0.05 0.00 -2.18 0.00 0.00 60.65 58.21 2kui h LYS 443 Cb 0.71 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.25 2kui h LYS 443 CO 0.05 1.00 0.20 -0.07 -1.08 0.00 0.00 179.45 179.56 2kui h LEU 444 N 0.86 0.93 -0.19 2.94 4.07 -0.68 -1.15 115.31 122.09 2kui h LEU 444 Ca 0.15 -0.16 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 2kui h LEU 444 Cb 0.57 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.06 2kui h LEU 444 CO 0.03 0.88 0.06 0.74 -1.08 0.00 0.00 178.44 179.07 2kui h THR 445 N 0.97 1.19 0.00 0.22 2.02 -0.71 0.62 112.91 117.21 2kui h THR 445 Ca 0.21 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.80 2kui h THR 445 Cb 0.28 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 2kui h THR 445 CO -0.01 0.18 0.00 0.00 0.37 0.00 0.00 175.52 176.07 2kui h ALA 446 N 0.88 1.00 -0.11 6.16 0.00 -0.87 -2.53 119.26 123.79 2kui h ALA 446 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2kui h ALA 446 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2kui h ALA 446 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2kui n ALA 447 N -1.83 2.54 0.00 0.00 0.00 -0.45 -4.95 120.51 115.81 2kui n ALA 447 Ca 0.02 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.11 2kui n ALA 447 Cb 0.27 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.58 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 0.95 2.17 0.41 0.00 0.00 -0.95 -4.79 105.19 102.98 2kui n GLY 448 Ca 0.14 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.37 -2.18 1.61 -5.15 -1.69 -3.46 116.94 104.70 2kui h PHE 449 Ca 0.00 0.05 -0.38 0.00 -0.20 0.00 0.00 57.97 57.43 2kui h PHE 449 Cb 0.00 0.60 -0.08 0.00 0.22 0.00 0.00 35.95 36.68 2kui h PHE 449 CO 0.00 -0.49 -0.42 0.41 -2.00 0.00 0.00 178.31 175.81 2kui n GLY 450 N -1.39 0.62 3.37 6.09 0.00 0.18 -4.92 105.19 109.14 2kui n GLY 450 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 2kui n GLY 450 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kui s ARG 451 N -4.34 3.06 0.04 1.61 0.52 -1.26 -4.72 118.95 113.87 2kui s ARG 451 Ca 0.00 -0.89 0.01 0.00 -0.52 0.00 0.00 55.73 54.33 2kui s ARG 451 Cb 0.00 -3.50 -0.03 0.00 0.52 0.00 0.00 34.95 31.94 2kui s ARG 451 CO 0.00 -0.50 -0.06 -0.59 0.02 0.00 0.00 175.30 174.17 2kui s PHE 452 N 1.53 0.53 -0.07 -0.53 -0.71 -1.25 -0.38 117.98 117.10 2kui s PHE 452 Ca 0.03 -0.60 -0.03 0.00 -1.04 0.00 0.00 56.93 55.29 2kui s PHE 452 Cb -0.18 -0.33 0.04 0.00 -1.21 0.00 0.00 43.02 41.34 2kui s PHE 452 CO 0.04 -0.15 0.12 0.15 -1.34 0.00 0.00 175.22 174.04 2kui s LYS 453 N -1.95 0.01 -0.20 1.99 -0.14 0.27 -4.88 119.74 114.84 2kui s LYS 453 Ca -0.09 0.45 -0.16 0.00 -1.36 0.00 0.00 55.97 54.81 2kui s LYS 453 Cb -0.07 -0.30 -0.04 0.00 -1.68 0.00 0.00 37.83 35.74 2kui s LYS 453 CO -0.01 -0.27 0.41 -1.14 -0.76 0.00 0.00 175.35 173.58 2kui s GLN 454 N 1.94 4.19 0.08 1.68 0.74 -1.25 0.31 119.66 127.34 2kui s GLN 454 Ca 0.00 0.24 0.10 0.00 0.05 0.00 0.00 55.36 55.74 2kui s GLN 454 Cb -0.12 -3.53 -0.03 0.00 1.10 0.00 0.00 33.01 30.42 2kui s GLN 454 CO -0.05 -0.03 -0.25 0.00 -0.55 0.00 0.00 175.29 174.41 2kui s ALA 455 N 1.28 2.38 -0.07 1.58 0.00 0.34 -4.96 121.76 122.31 2kui s ALA 455 Ca 0.20 -1.35 0.05 0.00 0.00 0.00 0.00 51.96 50.87 2kui s ALA 455 Cb -0.15 -0.49 -0.01 0.00 0.00 0.00 0.00 23.12 22.48 2kui s ALA 455 CO 0.08 0.55 -0.24 -0.80 0.00 0.00 0.00 175.76 175.35 2kui s ASN 456 N -1.66 2.98 -0.01 0.00 0.02 -1.26 0.09 114.94 115.11 2kui s ASN 456 Ca 0.14 -0.51 0.02 0.00 -1.02 0.00 0.00 52.86 51.48 2kui s ASN 456 Cb -0.10 -1.01 -0.00 0.00 0.02 0.00 0.00 41.25 40.16 2kui s ASN 456 CO 0.05 0.21 -0.05 -0.55 0.02 0.00 0.00 177.10 176.77 2kui s SER 457 N 0.03 0.65 0.10 -1.22 0.15 -1.02 -4.94 113.70 107.44 2kui s SER 457 Ca -0.09 -0.10 -0.31 0.00 0.70 0.00 0.00 55.95 56.15 2kui s SER 457 Cb -0.15 -0.09 -0.08 0.00 -1.71 0.00 0.00 66.02 63.99 2kui s SER 457 CO 0.05 0.06 1.56 -2.16 1.20 0.00 0.00 173.24 173.95 2kui s PRO 458 N -0.07 4.23 0.36 5.44 0.04 -1.24 -0.40 135.00 143.35 2kui s PRO 458 Ca 0.01 2.26 -0.01 0.00 0.04 0.00 0.00 61.00 63.30 2kui s PRO 458 Cb -0.03 -3.40 0.00 0.00 0.04 0.00 0.00 34.50 31.11 2kui s PRO 458 CO -0.00 -0.63 0.48 -1.12 0.04 0.00 0.00 177.00 175.77 2kui s SER 459 N 1.75 1.06 0.28 6.66 0.01 0.70 -4.86 113.70 119.30 2kui s SER 459 Ca 0.70 -1.54 -0.29 0.00 1.31 0.00 0.00 55.95 56.13 2kui s SER 459 Cb -0.40 0.68 -0.14 0.00 0.21 0.00 0.00 66.02 66.37 2kui s SER 459 CO 0.31 -1.32 1.05 1.07 0.41 0.00 0.00 173.24 174.76 2kui n THR 460 N -0.59 1.86 -0.15 1.44 5.66 -1.26 -4.50 114.28 116.73 2kui n THR 460 Ca 0.01 -0.46 0.28 0.00 -3.05 0.00 0.00 64.05 60.83 2kui n THR 460 Cb 0.61 -1.02 0.72 0.00 -1.55 0.00 0.00 70.33 69.09 2kui n THR 460 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2kui h PRO 461 N 2.22 0.00 0.00 1.09 0.13 -1.93 0.15 132.00 133.66 2kui h PRO 461 Ca -0.40 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.66 2kui h PRO 461 Cb 1.34 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.46 2kui h PRO 461 CO 0.62 0.00 -0.33 1.05 -0.23 0.00 0.00 178.00 179.11 2kui h GLU 462 N 0.00 0.00 -0.01 0.86 4.11 -1.98 -2.95 114.58 114.61 2kui h GLU 462 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.83 2kui h GLU 462 Cb 1.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.89 2kui h GLU 462 CO -0.00 0.33 -0.43 1.28 0.07 0.00 0.00 179.01 180.26 2kui n LEU 463 N -3.44 1.62 -4.71 3.06 7.99 0.40 -4.93 117.00 117.00 2kui n LEU 463 Ca 0.00 -0.73 -0.42 0.00 -0.01 0.00 0.00 56.01 54.85 2kui n LEU 463 Cb 0.51 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.79 2kui n LEU 463 CO 0.36 0.31 1.42 -0.69 -1.51 0.00 0.00 177.39 177.28 2kui s VAL 464 N -2.12 2.27 0.00 4.08 1.01 -0.48 -1.44 120.40 123.72 2kui s VAL 464 Ca 0.14 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.15 2kui s VAL 464 Cb 0.14 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.50 2kui s VAL 464 CO 0.48 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.19 2kui n GLY 465 N 4.10 0.75 3.30 4.51 0.00 0.10 -4.90 105.19 113.05 2kui n GLY 465 Ca 0.17 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.50 1.23 0.20 1.61 3.01 -0.52 -4.84 119.74 119.93 2kui s LYS 466 Ca 0.00 -1.58 -0.30 0.00 -1.01 0.00 0.00 55.97 53.07 2kui s LYS 466 Cb 0.00 -0.64 -0.09 0.00 -1.01 0.00 0.00 37.83 36.09 2kui s LYS 466 CO 0.00 -0.02 1.41 0.08 0.51 0.00 0.00 175.35 177.33 2kui s VAL 467 N -3.36 2.91 -0.11 3.17 1.01 0.12 0.25 120.40 124.39 2kui s VAL 467 Ca 0.24 0.73 0.20 0.00 0.00 0.00 0.00 61.98 63.14 2kui s VAL 467 Cb 0.04 -3.46 -0.27 0.00 0.00 0.00 0.00 36.38 32.69 2kui s VAL 467 CO 0.05 0.10 0.40 -0.38 0.00 0.00 0.00 175.10 175.27 2kui n ILE 468 N 2.88 0.67 0.00 2.22 5.41 0.11 -4.71 119.36 125.94 2kui n ILE 468 Ca 0.08 -0.65 0.00 0.00 1.00 0.00 0.00 62.75 63.18 2kui n ILE 468 Cb 0.41 -0.27 0.00 0.00 -0.71 0.00 0.00 39.64 39.07 2kui n ILE 468 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2kui n GLY 469 N 1.45 1.63 3.38 7.39 0.00 -1.20 -5.02 105.19 112.81 2kui n GLY 469 Ca -0.15 -1.02 -0.32 0.00 0.00 0.00 0.00 46.02 44.53 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 2.59 0.02 2.61 -1.32 -1.26 -1.38 115.64 114.89 2kui s THR 470 Ca 0.00 -0.89 -0.26 0.00 -1.21 0.00 0.00 61.69 59.33 2kui s THR 470 Cb 0.00 -1.98 -0.17 0.00 -1.51 0.00 0.00 72.50 68.84 2kui s THR 470 CO 0.00 0.58 1.36 -1.13 -2.21 0.00 0.00 174.62 173.21 2kui h ASN 471 N 5.68 -0.29 -2.97 8.08 -1.24 -1.53 -3.39 115.58 119.91 2kui h ASN 471 Ca -0.40 -0.17 -0.56 0.00 0.71 0.00 0.00 56.30 55.88 2kui h ASN 471 Cb 1.16 0.07 -0.03 0.00 0.73 0.00 0.00 38.32 40.25 2kui h ASN 471 CO 0.49 0.02 0.82 -2.84 -1.29 0.00 0.00 177.43 174.64 2kui s PRO 472 N -4.98 4.28 0.35 6.67 0.02 -1.26 -4.98 135.00 135.10 2kui s PRO 472 Ca -0.15 1.70 -0.29 0.00 0.02 0.00 0.00 61.00 62.29 2kui s PRO 472 Cb 0.03 -3.68 -0.11 0.00 0.02 0.00 0.00 34.50 30.77 2kui s PRO 472 CO 0.59 -0.60 1.44 -2.14 -0.33 0.00 0.00 177.00 175.96 2kui s PRO 473 N 2.93 4.19 0.00 5.54 0.02 -1.26 -4.86 135.00 141.56 2kui s PRO 473 Ca 0.56 2.46 0.00 0.00 0.02 0.00 0.00 61.00 64.04 2kui s PRO 473 Cb -0.24 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.27 2kui s PRO 473 CO 0.19 -0.44 0.67 0.00 -0.33 0.00 0.00 177.00 177.09 2kui n ALA 474 N 0.82 2.21 0.48 -1.55 0.00 -1.26 -1.22 120.51 120.00 2kui n ALA 474 Ca 0.02 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.51 2kui n ALA 474 Cb 0.40 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.85 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 -0.40 1.25 -4.71 0.00 5.03 -1.26 -4.21 115.26 110.95 2kui n ASN 475 Ca 0.00 -1.13 -0.26 0.00 0.87 0.00 0.00 54.58 54.06 2kui n ASN 475 Cb 0.03 0.48 -0.08 0.00 -1.02 0.00 0.00 39.78 39.19 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 -1.44 2.15 -0.13 3.52 -1.52 -0.35 -4.96 119.66 116.93 2kui s GLN 476 Ca 0.09 -1.96 -0.08 0.00 -1.95 0.00 0.00 55.36 51.45 2kui s GLN 476 Cb 0.09 -1.86 -0.04 0.00 -0.22 0.00 0.00 33.01 30.97 2kui s GLN 476 CO 0.28 -0.14 0.17 0.99 -0.25 0.00 0.00 175.29 176.33 2kui s THR 477 N -2.66 5.44 0.09 -0.19 2.01 -1.26 -2.13 115.64 116.94 2kui s THR 477 Ca 0.37 0.27 0.07 0.00 0.31 0.00 0.00 61.69 62.71 2kui s THR 477 Cb 0.05 -3.45 -0.03 0.00 0.01 0.00 0.00 72.50 69.08 2kui s THR 477 CO 0.20 0.57 -0.19 -0.94 -0.69 0.00 0.00 174.62 173.57 2kui s SER 478 N -0.70 2.33 0.74 3.53 1.04 0.90 -4.89 113.70 116.65 2kui s SER 478 Ca 0.14 -0.64 -0.11 0.00 0.48 0.00 0.00 55.95 55.82 2kui s SER 478 Cb -0.12 -0.13 0.04 0.00 0.10 0.00 0.00 66.02 65.91 2kui s SER 478 CO 0.04 0.04 1.08 0.00 0.98 0.00 0.00 173.24 175.38 2kui s ALA 479 N -1.12 2.44 -0.34 5.32 0.00 -1.26 -0.44 121.76 126.35 2kui s ALA 479 Ca 0.05 0.11 0.27 0.00 0.00 0.00 0.00 51.96 52.39 2kui s ALA 479 Cb -0.10 -3.20 1.01 0.00 0.00 0.00 0.00 23.12 20.83 2kui s ALA 479 CO 0.03 -1.51 1.80 0.82 0.00 0.00 0.00 175.76 176.90 2kui h ILE 480 N -0.94 0.00 -0.32 0.00 5.03 -1.91 -1.64 117.51 117.73 2kui h ILE 480 Ca -0.44 -0.43 0.00 0.00 -0.12 0.00 0.00 64.86 63.87 2kui h ILE 480 Cb 1.23 1.31 0.00 0.00 -3.03 0.00 0.00 36.82 36.33 2kui h ILE 480 CO 0.55 0.00 0.00 1.07 -0.68 0.00 0.00 178.15 179.09 2kui n THR 481 N -2.59 0.41 -3.27 -0.27 5.66 -1.26 -3.86 114.28 109.11 2kui n THR 481 Ca 0.02 -0.61 -0.39 0.00 -3.05 0.00 0.00 64.05 60.03 2kui n THR 481 Cb 0.31 0.74 -0.06 0.00 -1.55 0.00 0.00 70.33 69.78 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 -1.48 6.99 -0.21 1.09 3.84 -0.62 -5.06 114.94 119.49 2kui s ASN 482 Ca 0.36 1.18 -0.08 0.00 0.21 0.00 0.00 52.86 54.54 2kui s ASN 482 Cb 0.21 -2.35 -0.04 0.00 -0.55 0.00 0.00 41.25 38.52 2kui s ASN 482 CO 0.29 0.20 0.07 0.54 -2.79 0.00 0.00 177.10 175.41 2kui s VAL 483 N -0.68 4.65 -0.27 -5.21 0.11 -1.26 -4.44 120.40 113.31 2kui s VAL 483 Ca 0.29 -0.07 -0.15 0.00 -2.93 0.00 0.00 61.98 59.12 2kui s VAL 483 Cb -0.19 -3.13 -0.04 0.00 -1.53 0.00 0.00 36.38 31.50 2kui s VAL 483 CO 0.17 0.41 0.37 -0.69 -3.33 0.00 0.00 175.10 172.03 2kui s VAL 484 N 0.87 5.18 -0.24 2.04 1.01 0.49 -4.91 120.40 124.84 2kui s VAL 484 Ca 0.04 0.56 -0.09 0.00 0.00 0.00 0.00 61.98 62.48 2kui s VAL 484 Cb -0.14 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 2kui s VAL 484 CO 0.03 0.16 0.12 -0.51 0.00 0.00 0.00 175.10 174.90 2kui s ILE 485 N 2.06 4.99 -0.11 2.22 -1.16 -1.26 -0.57 121.20 127.37 2kui s ILE 485 Ca 0.15 0.05 0.03 0.00 -0.51 0.00 0.00 60.65 60.37 2kui s ILE 485 Cb -0.16 -3.32 0.00 0.00 0.61 0.00 0.00 42.46 39.59 2kui s ILE 485 CO 0.10 0.35 -0.23 -0.63 -2.81 0.00 0.00 174.94 171.72 2kui s ILE 486 N 1.17 2.04 -0.23 2.00 1.01 0.15 -1.15 121.20 126.20 2kui s ILE 486 Ca 0.06 -1.00 -0.09 0.00 0.00 0.00 0.00 60.65 59.62 2kui s ILE 486 Cb -0.14 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 2kui s ILE 486 CO 0.05 0.55 0.12 -0.51 0.00 0.00 0.00 174.94 175.15 2kui s ILE 487 N 0.53 5.05 -0.06 2.92 2.07 -0.48 -0.51 121.20 130.71 2kui s ILE 487 Ca -0.14 0.07 0.03 0.00 -1.41 0.00 0.00 60.65 59.19 2kui s ILE 487 Cb -0.17 -3.34 -0.03 0.00 0.13 0.00 0.00 42.46 39.05 2kui s ILE 487 CO 0.05 0.37 -0.12 -0.69 -1.91 0.00 0.00 174.94 172.63 2kui s VAL 488 N 1.02 3.23 0.56 4.00 1.01 0.11 0.05 120.40 130.37 2kui s VAL 488 Ca 0.06 -0.66 -0.17 0.00 0.00 0.00 0.00 61.98 61.22 2kui s VAL 488 Cb -0.14 -2.29 -0.05 0.00 0.00 0.00 0.00 36.38 33.90 2kui s VAL 488 CO 0.04 0.59 1.04 -0.83 0.00 0.00 0.00 175.10 175.93 2kui s GLY 489 N -0.65 2.18 0.07 4.51 0.00 0.14 -2.43 107.32 111.14 2kui s GLY 489 Ca 0.10 0.39 -0.02 0.00 0.00 0.00 0.00 44.72 45.18 2kui s GLY 489 CO 0.01 0.70 0.02 -0.56 0.00 0.00 0.00 173.10 173.27 2kui s SER 490 N -2.69 0.40 0.00 1.64 0.01 0.46 0.02 113.70 113.55 2kui s SER 490 Ca 0.63 -0.97 0.00 0.00 1.31 0.00 0.00 55.95 56.93 2kui s SER 490 Cb -0.15 0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.32 2kui s SER 490 CO 0.33 -0.64 0.00 0.61 0.41 0.00 0.00 173.24 173.95 2kui n GLY 491 N 0.06 1.02 3.96 3.44 0.00 -1.26 -0.21 105.19 112.18 2kui n GLY 491 Ca -0.13 -0.50 -0.23 0.00 0.00 0.00 0.00 46.02 45.16 2kui n GLY 491 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2kui s PRO 492 N 1.32 2.89 -0.59 1.61 0.04 -1.26 -5.04 135.00 133.96 2kui s PRO 492 Ca 0.00 -0.53 -0.18 0.00 0.04 0.00 0.00 61.00 60.32 2kui s PRO 492 Cb 0.00 -2.51 0.11 0.00 0.04 0.00 0.00 34.50 32.14 2kui s PRO 492 CO 0.00 -0.45 0.67 0.00 0.04 0.00 0.00 177.00 177.26 2kui s ALA 493 N -2.66 3.45 0.02 8.56 0.00 -1.26 -4.88 121.76 124.99 2kui s ALA 493 Ca 0.52 -2.29 0.07 0.00 0.00 0.00 0.00 51.96 50.26 2kui s ALA 493 Cb -0.10 -3.49 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 2kui s ALA 493 CO 0.39 -2.30 -0.22 0.95 0.00 0.00 0.00 175.76 174.58 2kui s THR 494 N 2.50 2.48 0.03 0.00 -4.23 -1.26 -0.90 115.64 114.26 2kui s THR 494 Ca 0.10 -1.16 -0.07 0.00 -1.18 0.00 0.00 61.69 59.38 2kui s THR 494 Cb -0.25 -1.97 -0.01 0.00 1.34 0.00 0.00 72.50 71.61 2kui s THR 494 CO 0.06 0.44 0.13 -0.54 -0.54 0.00 0.00 174.62 174.16 2kui s LYS 495 N -1.09 0.61 -0.06 3.99 -0.14 -0.07 -4.93 119.74 118.04 2kui s LYS 495 Ca 0.12 -0.67 -0.14 0.00 -1.36 0.00 0.00 55.97 53.92 2kui s LYS 495 Cb -0.10 0.24 -0.05 0.00 -1.68 0.00 0.00 37.83 36.24 2kui s LYS 495 CO 0.02 -0.16 0.36 0.16 -0.76 0.00 0.00 175.35 174.97 2kui s ASP 496 N -2.02 6.66 0.21 2.83 -4.77 -1.26 -0.59 116.67 117.73 2kui s ASP 496 Ca -0.06 0.78 -0.30 0.00 -3.30 0.00 0.00 52.55 49.67 2kui s ASP 496 Cb -0.02 -2.22 -0.08 0.00 -1.09 0.00 0.00 42.92 39.51 2kui s ASP 496 CO -0.04 0.25 1.08 0.27 0.70 0.00 0.00 175.17 177.44 2kui s ILE 497 N -0.53 3.78 0.02 2.11 -4.36 -0.59 -4.80 121.20 116.82 2kui s ILE 497 Ca 0.21 1.63 -0.00 0.00 -0.26 0.00 0.00 60.65 62.23 2kui s ILE 497 Cb -0.15 -4.04 0.00 0.00 1.25 0.00 0.00 42.46 39.53 2kui s ILE 497 CO 0.10 0.32 0.02 -0.81 0.24 0.00 0.00 174.94 174.81 2kui n PRO 498 N 1.96 0.35 -3.38 0.37 -0.04 -1.26 -0.34 135.00 132.65 2kui n PRO 498 Ca 0.01 -0.05 -0.39 0.00 -0.04 0.00 0.00 63.50 63.04 2kui n PRO 498 Cb 0.46 -0.02 -0.08 0.00 -0.04 0.00 0.00 33.50 33.82 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 -1.08 6.36 0.00 3.54 1.47 -1.26 -4.65 116.67 121.05 2kui s ASP 499 Ca 0.01 0.43 0.08 0.00 1.18 0.00 0.00 52.55 54.25 2kui s ASP 499 Cb -0.00 -2.22 0.18 0.00 -0.34 0.00 0.00 42.92 40.53 2kui s ASP 499 CO 0.01 -0.13 1.08 0.55 0.68 0.00 0.00 175.17 177.36 2kui n VAL 500 N 4.68 0.76 -2.35 2.11 3.14 -1.26 -4.98 118.33 120.42 2kui n VAL 500 Ca -0.08 -0.88 -0.43 0.00 -2.96 0.00 0.00 64.34 59.99 2kui n VAL 500 Cb 0.51 0.66 -0.02 0.00 -1.06 0.00 0.00 33.84 33.93 2kui n VAL 500 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kui s ALA 501 N -0.92 3.63 0.00 1.55 0.00 -1.26 -2.44 121.76 122.32 2kui s ALA 501 Ca 0.15 0.58 0.00 0.00 0.00 0.00 0.00 51.96 52.69 2kui s ALA 501 Cb 0.08 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.58 2kui s ALA 501 CO 0.11 -1.12 0.00 0.41 0.00 0.00 0.00 175.76 175.16 2kui n GLY 502 N 3.65 1.81 3.98 0.00 0.00 -0.59 -4.97 105.19 109.07 2kui n GLY 502 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 2kui n GLY 502 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kui s GLN 503 N 0.00 2.39 0.39 1.61 -0.21 -1.02 -4.80 119.66 118.02 2kui s GLN 503 Ca 0.00 -0.95 -0.08 0.00 0.02 0.00 0.00 55.36 54.35 2kui s GLN 503 Cb 0.00 -2.50 -0.06 0.00 1.00 0.00 0.00 33.01 31.46 2kui s GLN 503 CO 0.00 -0.82 0.73 0.99 -2.12 0.00 0.00 175.29 174.07 2kui s THR 504 N -2.79 4.86 0.26 -0.19 2.01 -1.26 -0.27 115.64 118.26 2kui s THR 504 Ca 0.59 0.42 -0.02 0.00 0.31 0.00 0.00 61.69 62.99 2kui s THR 504 Cb -0.09 -3.76 0.24 0.00 0.01 0.00 0.00 72.50 68.90 2kui s THR 504 CO 0.39 -0.53 1.80 1.62 -0.69 0.00 0.00 174.62 177.21 2kui h VAL 505 N 1.00 0.86 -0.75 3.82 3.04 -1.23 0.22 116.25 123.20 2kui h VAL 505 Ca -0.47 -0.27 -0.00 0.00 -1.01 0.00 0.00 66.70 64.95 2kui h VAL 505 Cb 1.19 0.01 -0.04 0.00 -2.01 0.00 0.00 31.29 30.44 2kui h VAL 505 CO 0.64 0.14 0.46 -0.78 -1.01 0.00 0.00 177.57 177.02 2kui h ASP 506 N 0.78 0.89 -0.10 3.17 3.58 -1.94 -0.13 116.42 122.68 2kui h ASP 506 Ca 0.44 -0.06 -0.22 0.00 0.42 0.00 0.00 57.03 57.61 2kui h ASP 506 Cb 0.48 -0.22 0.01 0.00 1.72 0.00 0.00 39.33 41.32 2kui h ASP 506 CO -0.28 0.69 -0.81 0.58 -2.88 0.00 0.00 179.24 176.54 2kui h VAL 507 N 1.02 1.30 -0.05 2.25 2.07 -1.68 -2.69 116.25 118.47 2kui h VAL 507 Ca 0.27 -2.03 -0.00 0.00 0.82 0.00 0.00 66.70 65.76 2kui h VAL 507 Cb -0.05 2.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2kui h VAL 507 CO -0.05 0.63 0.03 0.00 0.02 0.00 0.00 177.57 178.20 2kui h ALA 508 N 0.48 0.06 -0.43 1.67 0.00 -0.27 -0.91 119.26 119.86 2kui h ALA 508 Ca -0.07 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 2kui h ALA 508 Cb 1.45 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 2kui h ALA 508 CO 0.16 -0.43 0.01 -0.56 0.00 0.00 0.00 179.25 178.44 2kui h GLN 509 N 0.03 0.70 -0.26 0.00 3.07 -1.08 -2.01 115.11 115.56 2kui h GLN 509 Ca 0.02 -0.17 -0.00 0.00 0.09 0.00 0.00 58.65 58.58 2kui h GLN 509 Cb 0.03 -0.09 -0.01 0.00 0.08 0.00 0.00 27.48 27.49 2kui h GLN 509 CO -0.00 0.70 0.14 -0.22 0.09 0.00 0.00 178.83 179.54 2kui h LYS 510 N 0.66 0.36 -0.16 0.06 3.64 -1.11 0.63 116.57 120.65 2kui h LYS 510 Ca 0.14 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2kui h LYS 510 Cb 0.39 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2kui h LYS 510 CO 0.01 0.31 0.08 -0.91 -2.27 0.00 0.00 179.45 176.68 2kui h ASN 511 N 0.31 0.21 -0.42 4.20 2.35 -0.76 0.24 115.58 121.71 2kui h ASN 511 Ca 0.09 -0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2kui h ASN 511 Cb 0.06 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 2kui h ASN 511 CO -0.02 0.25 0.26 -0.07 -1.65 0.00 0.00 177.43 176.20 2kui h LEU 512 N 0.15 0.50 -0.99 1.61 -0.00 -1.24 -1.95 115.31 113.40 2kui h LEU 512 Ca 0.06 -0.05 -0.04 0.00 -0.00 0.00 0.00 57.88 57.85 2kui h LEU 512 Cb 0.09 -0.13 -0.03 0.00 -0.00 0.00 0.00 40.66 40.60 2kui h LEU 512 CO -0.01 0.40 0.23 0.78 -0.00 0.00 0.00 178.44 179.84 2kui h ASN 513 N 0.56 0.89 -0.10 -0.43 -0.26 -0.51 -0.22 115.58 115.51 2kui h ASN 513 Ca 0.15 -0.14 -0.06 0.00 -0.56 0.00 0.00 56.30 55.69 2kui h ASN 513 Cb -0.01 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 37.00 2kui h ASN 513 CO -0.03 0.81 -0.12 0.58 -1.06 0.00 0.00 177.43 177.62 2kui h VAL 514 N 0.94 1.21 0.00 2.81 2.07 -0.67 -2.46 116.25 120.15 2kui h VAL 514 Ca 0.21 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.80 2kui h VAL 514 Cb 0.23 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 2kui h VAL 514 CO -0.01 0.30 0.00 -1.22 0.02 0.00 0.00 177.57 176.66 2kui n TYR 515 N -4.23 0.00 0.00 1.57 4.01 -0.54 -4.87 117.16 113.11 2kui n TYR 515 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2kui n TYR 515 Cb 0.30 -0.47 0.00 0.00 -0.31 0.00 0.00 39.34 38.86 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 1.41 2.44 3.58 2.72 0.00 -0.90 -4.97 105.19 109.47 2kui n GLY 516 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 2kui n GLY 516 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kui s PHE 517 N -2.19 2.60 -1.14 1.61 0.08 -0.21 -4.66 117.98 114.08 2kui s PHE 517 Ca 0.00 -1.15 0.26 0.00 0.12 0.00 0.00 56.93 56.16 2kui s PHE 517 Cb 0.00 -4.62 0.72 0.00 -0.57 0.00 0.00 43.02 38.54 2kui s PHE 517 CO 0.00 -1.74 1.56 0.25 -0.10 0.00 0.00 175.22 175.19 2kui n THR 518 N 6.71 0.00 -3.76 0.64 -2.24 -1.26 -2.44 114.28 111.93 2kui n THR 518 Ca 0.46 -0.02 -0.37 0.00 -2.27 0.00 0.00 64.05 61.85 2kui n THR 518 Cb 0.47 0.11 -0.13 0.00 -2.10 0.00 0.00 70.33 68.69 2kui n THR 518 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2kui s LYS 519 N -2.90 3.17 0.13 -0.78 1.02 -1.26 -4.93 119.74 114.18 2kui s LYS 519 Ca 0.14 -0.81 0.05 0.00 0.02 0.00 0.00 55.97 55.38 2kui s LYS 519 Cb 0.18 -3.37 -0.04 0.00 -0.52 0.00 0.00 37.83 34.09 2kui s LYS 519 CO 0.63 -0.41 -0.12 -0.59 -0.92 0.00 0.00 175.35 173.94 2kui s PHE 520 N 1.52 1.32 -0.00 3.18 -0.12 -1.26 -0.67 117.98 121.94 2kui s PHE 520 Ca 0.03 -0.62 0.03 0.00 -0.05 0.00 0.00 56.93 56.32 2kui s PHE 520 Cb -0.17 -0.68 -0.01 0.00 -0.63 0.00 0.00 43.02 41.53 2kui s PHE 520 CO 0.03 0.11 -0.10 -1.12 -0.05 0.00 0.00 175.22 174.09 2kui s SER 521 N -2.67 1.17 -0.04 1.98 0.01 0.16 -4.89 113.70 109.42 2kui s SER 521 Ca 0.11 -0.21 0.06 0.00 1.31 0.00 0.00 55.95 57.22 2kui s SER 521 Cb -0.02 -0.12 -0.02 0.00 0.21 0.00 0.00 66.02 66.06 2kui s SER 521 CO 0.02 0.10 -0.21 0.00 0.41 0.00 0.00 173.24 173.56 2kui s GLN 522 N -0.34 2.33 -0.17 12.44 0.00 -1.26 -0.33 119.66 132.33 2kui s GLN 522 Ca 0.03 -0.83 -0.00 0.00 -0.00 0.00 0.00 55.36 54.56 2kui s GLN 522 Cb -0.04 -2.20 -0.00 0.00 0.00 0.00 0.00 33.01 30.77 2kui s GLN 522 CO -0.00 0.56 -0.14 0.00 0.00 0.00 0.00 175.29 175.71 2kui s ALA 523 N -0.60 2.53 -0.36 2.60 0.00 0.37 -4.95 121.76 121.35 2kui s ALA 523 Ca 0.09 -1.07 -0.22 0.00 0.00 0.00 0.00 51.96 50.76 2kui s ALA 523 Cb -0.11 -1.29 0.01 0.00 0.00 0.00 0.00 23.12 21.73 2kui s ALA 523 CO 0.00 -0.10 0.70 -1.12 0.00 0.00 0.00 175.76 175.24 2kui s SER 524 N 0.93 6.48 0.34 0.00 0.01 -1.26 -0.29 113.70 119.91 2kui s SER 524 Ca -0.03 0.24 0.08 0.00 1.31 0.00 0.00 55.95 57.55 2kui s SER 524 Cb -0.15 -2.36 -0.07 0.00 0.21 0.00 0.00 66.02 63.66 2kui s SER 524 CO -0.02 -0.65 -0.06 0.68 0.41 0.00 0.00 173.24 173.59 2kui s VAL 525 N 2.88 2.05 -0.12 3.43 -7.23 0.45 -4.96 120.40 116.90 2kui s VAL 525 Ca 0.27 -2.15 -0.04 0.00 -1.81 0.00 0.00 61.98 58.25 2kui s VAL 525 Cb -0.14 -2.68 -0.04 0.00 0.56 0.00 0.00 36.38 34.09 2kui s VAL 525 CO 0.16 -0.18 0.05 1.51 -0.31 0.00 0.00 175.10 176.33 2kui s ASP 526 N -3.59 5.62 0.37 4.85 -4.77 -1.26 -0.79 116.67 117.09 2kui s ASP 526 Ca 0.33 0.21 -0.05 0.00 -3.30 0.00 0.00 52.55 49.74 2kui s ASP 526 Cb 0.04 -1.75 0.02 0.00 -1.09 0.00 0.00 42.92 40.14 2kui s ASP 526 CO 0.16 0.34 0.58 -0.44 0.70 0.00 0.00 175.17 176.50 2kui s SER 527 N -0.61 0.80 0.00 2.11 0.01 0.78 -4.83 113.70 111.96 2kui s SER 527 Ca 0.11 -1.47 0.30 0.00 1.31 0.00 0.00 55.95 56.20 2kui s SER 527 Cb -0.12 0.74 1.41 0.00 0.21 0.00 0.00 66.02 68.26 2kui s SER 527 CO 0.02 -1.45 2.00 -2.65 0.41 0.00 0.00 173.24 171.57 2kui n PRO 528 N -0.59 0.30 -2.89 12.44 -0.02 -1.26 -3.97 135.00 139.01 2kui n PRO 528 Ca -0.02 -0.01 -0.40 0.00 -2.02 0.00 0.00 63.50 61.05 2kui n PRO 528 Cb 0.61 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.54 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 -2.70 4.63 0.93 -0.52 1.81 -1.26 -4.83 118.95 117.00 2kui s ARG 529 Ca 0.24 1.25 -0.11 0.00 -1.72 0.00 0.00 55.73 55.39 2kui s ARG 529 Cb 0.20 -3.32 0.14 0.00 -0.45 0.00 0.00 34.95 31.52 2kui s ARG 529 CO 0.49 0.41 1.03 -2.30 -0.68 0.00 0.00 175.30 174.25 2kui n PRO 530 N 2.15 -0.49 -1.96 3.54 -0.02 -1.26 -2.07 135.00 134.88 2kui n PRO 530 Ca -0.03 -0.08 -0.43 0.00 -2.02 0.00 0.00 63.50 60.95 2kui n PRO 530 Cb 0.49 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.65 2kui n PRO 530 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kui s ALA 531 N -2.60 3.13 0.00 3.55 0.00 -1.23 -1.70 121.76 122.91 2kui s ALA 531 Ca 0.65 0.57 0.00 0.00 0.00 0.00 0.00 51.96 53.19 2kui s ALA 531 Cb -0.23 -3.92 0.00 0.00 0.00 0.00 0.00 23.12 18.97 2kui s ALA 531 CO 0.60 -2.19 0.00 0.41 0.00 0.00 0.00 175.76 174.58 2kui n GLY 532 N 4.99 2.35 3.74 0.00 0.00 -0.54 -4.95 105.19 110.78 2kui n GLY 532 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.14 4.57 -0.09 1.61 2.12 -0.69 -0.67 118.70 125.41 2kui s GLU 533 Ca 0.00 1.20 -0.29 0.00 0.36 0.00 0.00 54.97 56.24 2kui s GLU 533 Cb 0.00 -3.37 -0.02 0.00 0.26 0.00 0.00 34.13 31.01 2kui s GLU 533 CO 0.00 0.26 0.98 0.08 -0.54 0.00 0.00 175.26 176.05 2kui s VAL 534 N -0.05 4.81 -0.53 3.70 1.01 0.63 -0.73 120.40 129.25 2kui s VAL 534 Ca 0.41 2.01 0.24 0.00 0.00 0.00 0.00 61.98 64.64 2kui s VAL 534 Cb -0.21 -4.30 0.28 0.00 0.00 0.00 0.00 36.38 32.15 2kui s VAL 534 CO 0.25 0.04 1.61 0.00 0.00 0.00 0.00 175.10 177.01 2kui h THR 535 N 5.03 0.00 0.00 3.92 1.03 -1.03 -1.56 112.91 120.30 2kui h THR 535 Ca -0.33 -0.80 0.00 0.00 -0.01 0.00 0.00 66.41 65.27 2kui h THR 535 Cb 1.16 1.75 0.00 0.00 -1.07 0.00 0.00 68.15 69.99 2kui h THR 535 CO 0.83 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 176.95 2kui n GLY 536 N 1.19 0.32 3.54 2.99 0.00 -1.21 -4.75 105.19 107.28 2kui n GLY 536 Ca 0.04 -1.58 -0.24 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.92 2.85 -0.01 2.61 -4.23 -1.26 -1.09 115.64 111.59 2kui s THR 537 Ca 0.00 -2.20 -0.23 0.00 -1.18 0.00 0.00 61.69 58.08 2kui s THR 537 Cb 0.00 -2.53 -0.15 0.00 1.34 0.00 0.00 72.50 71.15 2kui s THR 537 CO 0.00 -0.38 1.07 -1.13 -0.54 0.00 0.00 174.62 173.64 2kui h ASN 538 N 2.10 -0.34 -3.39 3.99 -1.24 -1.73 -3.42 115.58 111.55 2kui h ASN 538 Ca -0.42 -0.20 -0.52 0.00 0.71 0.00 0.00 56.30 55.87 2kui h ASN 538 Cb 1.26 0.09 0.03 0.00 0.73 0.00 0.00 38.32 40.42 2kui h ASN 538 CO 0.61 0.09 0.62 -2.16 -1.29 0.00 0.00 177.43 175.29 2kui s PRO 539 N -4.18 4.42 0.77 6.67 0.04 -1.26 -5.01 135.00 136.45 2kui s PRO 539 Ca -0.13 1.98 -0.12 0.00 0.04 0.00 0.00 61.00 62.77 2kui s PRO 539 Cb 0.01 -3.22 0.06 0.00 0.04 0.00 0.00 34.50 31.40 2kui s PRO 539 CO 0.49 -0.21 1.14 -1.25 0.04 0.00 0.00 177.00 177.21 2kui s PRO 540 N -0.04 2.02 0.28 0.56 0.04 -1.26 -4.94 135.00 131.66 2kui s PRO 540 Ca 0.56 1.46 -0.30 0.00 0.04 0.00 0.00 61.00 62.76 2kui s PRO 540 Cb -0.35 -1.85 -0.11 0.00 0.04 0.00 0.00 34.50 32.23 2kui s PRO 540 CO 0.37 -1.86 1.55 0.00 0.04 0.00 0.00 177.00 177.10 2kui s ALA 541 N -2.50 3.72 0.00 8.56 0.00 -1.26 -2.24 121.76 128.04 2kui s ALA 541 Ca 0.67 1.50 0.00 0.00 0.00 0.00 0.00 51.96 54.13 2kui s ALA 541 Cb -0.22 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.27 2kui s ALA 541 CO 0.51 -0.92 0.00 0.41 0.00 0.00 0.00 175.76 175.76 2kui n GLY 542 N 2.22 1.38 3.66 0.00 0.00 0.54 -4.99 105.19 108.01 2kui n GLY 542 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2kui n GLY 542 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kui s THR 543 N -2.21 3.89 -0.19 2.61 2.01 -0.95 -4.71 115.64 116.09 2kui s THR 543 Ca 0.00 1.11 -0.23 0.00 0.31 0.00 0.00 61.69 62.88 2kui s THR 543 Cb 0.00 -3.72 -0.02 0.00 0.01 0.00 0.00 72.50 68.78 2kui s THR 543 CO 0.00 -0.08 0.74 -0.89 -0.69 0.00 0.00 174.62 173.70 2kui s THR 544 N 3.54 4.93 0.08 -0.82 2.01 -1.26 -1.55 115.64 122.57 2kui s THR 544 Ca 0.64 1.42 0.02 0.00 0.31 0.00 0.00 61.69 64.09 2kui s THR 544 Cb -0.28 -4.05 -0.03 0.00 0.01 0.00 0.00 72.50 68.15 2kui s THR 544 CO 0.23 0.05 -0.08 0.68 -0.69 0.00 0.00 174.62 174.81 2kui s VAL 545 N 2.17 0.70 0.50 3.82 -7.23 0.24 -4.92 120.40 115.68 2kui s VAL 545 Ca 0.33 -1.53 -0.20 0.00 -1.81 0.00 0.00 61.98 58.77 2kui s VAL 545 Cb -0.16 -1.19 -0.08 0.00 0.56 0.00 0.00 36.38 35.51 2kui s VAL 545 CO 0.11 -0.60 1.07 -2.84 -0.31 0.00 0.00 175.10 172.52 2kui s PRO 546 N -2.70 3.69 0.64 4.82 0.02 -1.26 -0.89 135.00 139.33 2kui s PRO 546 Ca 0.02 1.45 0.42 0.00 0.02 0.00 0.00 61.00 62.90 2kui s PRO 546 Cb -0.03 -2.09 2.29 0.00 0.02 0.00 0.00 34.50 34.69 2kui s PRO 546 CO -0.02 -0.54 2.29 -0.39 -0.33 0.00 0.00 177.00 178.02 2kui h VAL 547 N 1.49 0.00 -0.02 3.83 -1.51 -1.35 -1.14 116.25 117.55 2kui h VAL 547 Ca -0.50 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 2kui h VAL 547 Cb 1.23 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.33 2kui h VAL 547 CO 0.59 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 177.40 2kui n ASP 548 N -3.00 0.20 -4.66 4.19 9.92 -1.26 -3.88 116.55 118.06 2kui n ASP 548 Ca -0.03 -1.39 -0.25 0.00 -0.53 0.00 0.00 54.79 52.59 2kui n ASP 548 Cb 0.09 -0.01 0.11 0.00 -0.64 0.00 0.00 41.12 40.66 2kui n ASP 548 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 2kui s SER 549 N -1.64 4.31 -0.22 -2.24 1.04 -0.44 -4.98 113.70 109.52 2kui s SER 549 Ca 0.31 -0.01 -0.03 0.00 0.48 0.00 0.00 55.95 56.70 2kui s SER 549 Cb 0.15 -0.42 -0.00 0.00 0.10 0.00 0.00 66.02 65.85 2kui s SER 549 CO 0.24 -1.90 -0.05 -0.69 0.98 0.00 0.00 173.24 171.83 2kui s VAL 550 N -3.28 3.27 -0.17 5.02 1.01 -1.26 -4.12 120.40 120.88 2kui s VAL 550 Ca 0.65 -0.58 -0.12 0.00 0.00 0.00 0.00 61.98 61.93 2kui s VAL 550 Cb -0.07 -2.51 -0.05 0.00 0.00 0.00 0.00 36.38 33.75 2kui s VAL 550 CO 0.45 0.39 0.21 -0.63 0.00 0.00 0.00 175.10 175.52 2kui s ILE 551 N 1.45 5.36 -0.29 2.22 1.09 0.15 -4.92 121.20 126.26 2kui s ILE 551 Ca 0.05 0.37 -0.10 0.00 -1.10 0.00 0.00 60.65 59.87 2kui s ILE 551 Cb -0.15 -3.54 -0.02 0.00 -1.06 0.00 0.00 42.46 37.69 2kui s ILE 551 CO -0.04 0.44 0.15 -0.70 -0.10 0.00 0.00 174.94 174.69 2kui s GLU 552 N 0.24 3.59 -0.16 2.79 2.12 -1.26 -0.67 118.70 125.35 2kui s GLU 552 Ca 0.13 -0.55 -0.10 0.00 0.36 0.00 0.00 54.97 54.81 2kui s GLU 552 Cb -0.12 -3.55 -0.05 0.00 0.26 0.00 0.00 34.13 30.67 2kui s GLU 552 CO 0.02 -0.30 0.18 -0.51 -0.54 0.00 0.00 175.26 174.10 2kui s LEU 553 N 1.66 4.27 -0.30 2.70 2.01 0.55 -1.79 118.68 127.80 2kui s LEU 553 Ca 0.06 0.38 -0.11 0.00 0.01 0.00 0.00 54.13 54.47 2kui s LEU 553 Cb -0.16 -2.17 -0.04 0.00 0.01 0.00 0.00 46.19 43.83 2kui s LEU 553 CO 0.07 0.23 0.20 -1.10 1.01 0.00 0.00 176.35 176.75 2kui s GLN 554 N -0.02 3.79 -0.17 1.70 1.11 -0.25 -0.48 119.66 125.35 2kui s GLN 554 Ca 0.12 -0.43 -0.07 0.00 0.01 0.00 0.00 55.36 55.00 2kui s GLN 554 Cb -0.12 -3.68 -0.04 0.00 -1.01 0.00 0.00 33.01 28.16 2kui s GLN 554 CO 0.01 -0.26 0.05 0.08 0.01 0.00 0.00 175.29 175.18 2kui s VAL 555 N 1.74 4.68 0.28 1.09 1.01 0.60 -0.37 120.40 129.43 2kui s VAL 555 Ca 0.07 -0.08 0.01 0.00 0.00 0.00 0.00 61.98 61.97 2kui s VAL 555 Cb -0.16 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 2kui s VAL 555 CO 0.10 0.48 0.47 -0.44 0.00 0.00 0.00 175.10 175.72 2kui s SER 556 N 0.20 6.33 0.08 3.32 0.01 0.10 -0.41 113.70 123.33 2kui s SER 556 Ca 0.03 0.39 0.07 0.00 1.31 0.00 0.00 55.95 57.75 2kui s SER 556 Cb -0.12 -2.00 -0.04 0.00 0.21 0.00 0.00 66.02 64.07 2kui s SER 556 CO 0.01 -0.18 -0.12 -1.59 0.41 0.00 0.00 173.24 171.77 2kui s LYS 557 N -3.93 2.13 0.43 12.44 -2.85 0.03 -1.46 119.74 126.53 2kui s LYS 557 Ca 0.39 -0.99 0.24 0.00 -1.00 0.00 0.00 55.97 54.60 2kui s LYS 557 Cb -0.10 -2.29 0.70 0.00 -2.06 0.00 0.00 37.83 34.08 2kui s LYS 557 CO 0.32 0.52 1.73 0.78 0.10 0.00 0.00 175.35 178.81 2kui h GLY 558 N 3.93 0.00 -0.01 0.59 0.00 -1.54 0.22 103.07 106.26 2kui h GLY 558 Ca -0.49 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 2kui h GLY 558 CO 0.51 0.00 -0.00 0.70 0.00 0.00 0.00 176.54 177.74 2kui n ASN 559 N -3.22 -3.94 -4.14 0.19 3.02 -1.26 -4.51 115.26 101.40 2kui n ASN 559 Ca 0.02 0.01 -0.23 0.00 -0.03 0.00 0.00 54.58 54.35 2kui n ASN 559 Cb 0.49 -1.47 -0.15 0.00 -0.61 0.00 0.00 39.78 38.04 2kui n ASN 559 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2kui s GLN 560 N -0.71 1.19 0.05 3.52 0.74 -1.26 -0.11 119.66 123.08 2kui s GLN 560 Ca 0.00 -0.60 0.00 0.00 0.05 0.00 0.00 55.36 54.81 2kui s GLN 560 Cb 0.00 -1.17 -0.03 0.00 1.10 0.00 0.00 33.01 32.91 2kui s GLN 560 CO 0.00 0.31 -0.04 -0.59 -0.55 0.00 0.00 175.29 174.42 2kui s PHE 561 N -0.46 0.51 0.18 1.67 -0.71 -0.39 -4.90 117.98 113.88 2kui s PHE 561 Ca 0.05 -0.78 -0.31 0.00 -1.04 0.00 0.00 56.93 54.85 2kui s PHE 561 Cb -0.06 -0.34 -0.10 0.00 -1.21 0.00 0.00 43.02 41.30 2kui s PHE 561 CO -0.00 -0.24 1.58 0.54 -1.34 0.00 0.00 175.22 175.76 2kui s VAL 562 N -2.66 2.51 -0.19 -2.49 0.11 -1.26 -0.28 120.40 116.14 2kui s VAL 562 Ca -0.03 0.37 -0.15 0.00 -2.93 0.00 0.00 61.98 59.24 2kui s VAL 562 Cb -0.01 -3.24 -0.04 0.00 -1.53 0.00 0.00 36.38 31.56 2kui s VAL 562 CO -0.05 0.03 0.37 -0.32 -3.33 0.00 0.00 175.10 171.81 2kui s MET 563 N 0.97 4.19 1.14 1.54 1.75 0.70 -4.85 119.30 124.75 2kui s MET 563 Ca 0.70 0.18 -0.13 0.00 -1.25 0.00 0.00 55.69 55.18 2kui s MET 563 Cb -0.45 -3.51 0.27 0.00 2.84 0.00 0.00 34.83 33.98 2kui s MET 563 CO 0.33 0.03 1.04 -2.14 -0.65 0.00 0.00 175.02 173.63 2kui s PRO 564 N 1.11 -0.69 0.13 4.11 0.02 -1.26 -1.47 135.00 136.95 2kui s PRO 564 Ca 0.18 0.72 -0.30 0.00 0.02 0.00 0.00 61.00 61.63 2kui s PRO 564 Cb -0.14 -1.59 -0.07 0.00 0.02 0.00 0.00 34.50 32.72 2kui s PRO 564 CO 0.07 -3.54 1.13 0.16 -0.33 0.00 0.00 177.00 174.49 2kui s ASP 565 N -2.76 7.20 -0.02 2.53 -4.77 -1.26 -4.67 116.67 112.92 2kui s ASP 565 Ca 0.68 2.05 0.20 0.00 -3.30 0.00 0.00 52.55 52.18 2kui s ASP 565 Cb -0.23 -2.59 0.35 0.00 -1.09 0.00 0.00 42.92 39.35 2kui s ASP 565 CO 0.63 -0.31 1.14 0.18 0.70 0.00 0.00 175.17 177.51 2kui n LEU 566 N 2.95 1.01 -4.71 2.11 4.77 -1.26 -5.09 117.00 116.78 2kui n LEU 566 Ca 0.05 -2.03 -0.42 0.00 -0.03 0.00 0.00 56.01 53.58 2kui n LEU 566 Cb 0.46 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 2kui n LEU 566 CO 0.54 0.55 0.75 -0.44 -1.33 0.00 0.00 177.39 177.46 2kui s SER 567 N -1.96 7.27 -0.91 -1.43 0.01 -1.26 -3.57 113.70 111.86 2kui s SER 567 Ca 0.28 1.80 -0.05 0.00 1.31 0.00 0.00 55.95 59.30 2kui s SER 567 Cb 0.32 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.98 2kui s SER 567 CO -0.13 -0.33 0.60 0.61 0.41 0.00 0.00 173.24 174.41 2kui n GLY 568 N 2.97 -0.02 4.00 3.44 0.00 -1.26 -5.01 105.19 109.30 2kui n GLY 568 Ca 0.07 -0.14 -0.18 0.00 0.00 0.00 0.00 46.02 45.77 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 -5.60 2.88 0.07 1.61 0.00 -1.23 -4.90 119.30 112.13 2kui s MET 569 Ca 0.30 -1.14 0.03 0.00 0.00 0.00 0.00 55.69 54.87 2kui s MET 569 Cb -0.13 -2.75 -0.04 0.00 0.00 0.00 0.00 34.83 31.91 2kui s MET 569 CO 0.37 -0.22 0.04 -0.06 0.00 0.00 0.00 175.02 175.15 2kui s PHE 570 N -2.34 3.12 0.51 3.16 0.08 -1.26 -1.63 117.98 119.62 2kui s PHE 570 Ca 0.53 0.05 0.29 0.00 0.12 0.00 0.00 56.93 57.92 2kui s PHE 570 Cb -0.10 -1.61 1.65 0.00 -0.57 0.00 0.00 43.02 42.39 2kui s PHE 570 CO 0.33 0.50 2.17 2.35 -0.10 0.00 0.00 175.22 180.47 2kui h TRP 571 N 3.53 0.00 0.00 0.36 2.91 -0.39 0.06 115.95 122.42 2kui h TRP 571 Ca -0.47 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 59.53 2kui h TRP 571 Cb 1.17 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 29.81 2kui h TRP 571 CO 0.61 0.06 -0.08 -0.24 -1.03 0.00 0.00 178.44 177.76 2kui h VAL 572 N 0.00 0.23 0.00 2.65 3.04 -1.95 -0.81 116.25 119.41 2kui h VAL 572 Ca -0.00 -0.63 -0.34 0.00 -1.01 0.00 0.00 66.70 64.73 2kui h VAL 572 Cb 0.16 1.51 -0.06 0.00 -2.01 0.00 0.00 31.29 30.88 2kui h VAL 572 CO 0.01 0.07 -2.29 0.47 -1.01 0.00 0.00 177.57 174.82 2kui n ASP 573 N -3.25 0.32 0.03 3.17 8.00 -0.25 -4.50 116.55 120.07 2kui n ASP 573 Ca -0.00 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.38 2kui n ASP 573 Cb 0.31 0.99 -0.07 0.00 -0.02 0.00 0.00 41.12 42.32 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 0.96 0.01 -0.01 2.24 0.00 -0.60 -2.76 119.26 119.10 2kui h ALA 574 Ca -0.50 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.40 2kui h ALA 574 Cb 2.14 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.88 2kui h ALA 574 CO 0.03 -0.45 -0.24 0.93 0.00 0.00 0.00 179.25 179.51 2kui h GLU 575 N -0.08 -0.36 -0.65 0.00 5.08 -1.40 0.18 114.58 117.35 2kui h GLU 575 Ca 0.00 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.48 2kui h GLU 575 Cb 0.08 0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.34 2kui h GLU 575 CO -0.00 -0.24 0.27 -1.35 -1.00 0.00 0.00 179.01 176.69 2kui h PRO 576 N -0.37 0.46 -0.65 2.33 0.11 -1.78 -0.71 132.00 131.38 2kui h PRO 576 Ca 0.07 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.10 2kui h PRO 576 Cb 0.46 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.44 2kui h PRO 576 CO -0.23 0.30 0.20 0.00 -0.21 0.00 0.00 178.00 178.07 2kui h ARG 577 N 0.47 1.01 -0.06 1.05 2.47 -1.14 -0.37 114.38 117.81 2kui h ARG 577 Ca 0.33 -0.22 -0.00 0.00 -1.26 0.00 0.00 59.98 58.83 2kui h ARG 577 Cb 0.40 -0.15 -0.00 0.00 -1.65 0.00 0.00 29.97 28.57 2kui h ARG 577 CO -0.30 0.88 0.02 1.25 0.56 0.00 0.00 179.97 182.38 2kui h LEU 578 N 0.94 0.08 -0.70 3.04 6.46 0.06 0.26 115.31 125.45 2kui h LEU 578 Ca 0.21 -0.18 -0.11 0.00 -0.12 0.00 0.00 57.88 57.68 2kui h LEU 578 Cb 0.29 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.19 2kui h LEU 578 CO -0.01 0.24 -0.17 0.08 -0.62 0.00 0.00 178.44 177.97 2kui h ARG 579 N -0.09 0.83 -0.33 1.25 0.11 -1.09 -1.49 114.38 113.57 2kui h ARG 579 Ca 0.02 -0.31 -0.16 0.00 0.10 0.00 0.00 59.98 59.62 2kui h ARG 579 Cb 0.19 -0.05 -0.00 0.00 1.11 0.00 0.00 29.97 31.21 2kui h ARG 579 CO -0.00 0.94 -0.44 0.00 0.10 0.00 0.00 179.97 180.56 2kui h ALA 580 N 1.08 0.59 -0.01 0.08 0.00 -0.76 -2.91 119.26 117.33 2kui h ALA 580 Ca 0.11 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2kui h ALA 580 Cb 0.68 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2kui h ALA 580 CO 0.05 0.68 -0.03 1.47 0.00 0.00 0.00 179.25 181.42 2kui n LEU 581 N -4.03 0.64 -2.56 0.00 -0.00 0.05 -4.91 117.00 106.18 2kui n LEU 581 Ca -0.03 -0.17 -0.12 0.00 -0.00 0.00 0.00 56.01 55.69 2kui n LEU 581 Cb 0.57 -0.05 0.06 0.00 -0.00 0.00 0.00 43.42 44.00 2kui n LEU 581 CO 0.49 0.11 0.09 0.61 -0.00 0.00 0.00 177.39 178.69 2kui n GLY 582 N 1.13 -0.06 3.70 1.47 0.00 -1.05 -4.93 105.19 105.45 2kui n GLY 582 Ca 0.20 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2kui n GLY 582 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2kui s TRP 583 N -3.23 2.64 -0.12 1.61 -0.00 -0.59 -4.88 118.94 114.38 2kui s TRP 583 Ca 0.10 0.38 0.14 0.00 -0.00 0.00 0.00 56.10 56.72 2kui s TRP 583 Cb -0.04 -3.99 0.30 0.00 -0.00 0.00 0.00 33.47 29.73 2kui s TRP 583 CO 0.47 -3.89 1.15 2.41 -0.00 0.00 0.00 176.95 177.10 2kui n THR 584 N 4.41 1.50 -2.25 5.86 -1.04 -1.25 -4.95 114.28 116.56 2kui n THR 584 Ca 0.15 -2.09 -0.00 0.00 -2.04 0.00 0.00 64.05 60.07 2kui n THR 584 Cb 0.39 0.01 0.00 0.00 -1.82 0.00 0.00 70.33 68.91 2kui n THR 584 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2kui n GLY 585 N -0.91 0.77 3.68 3.41 0.00 -0.51 -4.85 105.19 106.78 2kui n GLY 585 Ca 0.13 -1.96 -0.36 0.00 0.00 0.00 0.00 46.02 43.83 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 -2.44 4.13 -0.54 1.61 -1.94 -1.26 -4.98 119.30 113.88 2kui s MET 586 Ca 0.01 -0.15 -0.18 0.00 -1.71 0.00 0.00 55.69 53.67 2kui s MET 586 Cb -0.00 -3.51 0.09 0.00 2.01 0.00 0.00 34.83 33.42 2kui s MET 586 CO 0.01 0.10 0.58 -1.17 -0.01 0.00 0.00 175.02 174.53 2kui s LEU 587 N 0.93 5.52 -0.55 -0.03 2.96 -1.26 -4.44 118.68 121.80 2kui s LEU 587 Ca 0.10 -1.38 -0.18 0.00 -0.22 0.00 0.00 54.13 52.46 2kui s LEU 587 Cb -0.13 -2.29 0.10 0.00 0.50 0.00 0.00 46.19 44.37 2kui s LEU 587 CO 0.04 -0.92 0.61 -0.62 -1.32 0.00 0.00 176.35 174.14 2kui s ASP 588 N 3.21 6.19 -0.33 3.68 2.15 -1.26 -5.01 116.67 125.31 2kui s ASP 588 Ca 0.09 -1.42 -0.10 0.00 0.43 0.00 0.00 52.55 51.55 2kui s ASP 588 Cb -0.24 -2.27 0.00 0.00 -0.30 0.00 0.00 42.92 40.11 2kui s ASP 588 CO 0.07 -0.97 0.17 -0.75 -0.17 0.00 0.00 175.17 173.51 2kui s LYS 589 N 2.32 3.21 0.00 4.34 2.36 -1.26 -4.61 119.74 126.09 2kui s LYS 589 Ca 0.09 -0.81 0.00 0.00 -2.55 0.00 0.00 55.97 52.70 2kui s LYS 589 Cb -0.25 -3.61 0.00 0.00 -1.05 0.00 0.00 37.83 32.92 2kui s LYS 589 CO 0.06 -0.49 0.02 0.41 1.55 0.00 0.00 175.35 176.90 2kui n GLY 590 N 4.99 0.96 3.32 5.54 0.00 -1.26 -5.01 105.19 113.73 2kui n GLY 590 Ca -0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.60 1.92 0.23 4.61 0.00 -1.26 -5.12 121.76 118.55 2kui s ALA 591 Ca 0.00 -1.44 -0.26 0.00 0.00 0.00 0.00 51.96 50.25 2kui s ALA 591 Cb 0.00 -0.18 -0.09 0.00 0.00 0.00 0.00 23.12 22.86 2kui s ALA 591 CO 0.00 0.23 0.86 0.16 0.00 0.00 0.00 175.76 177.01 2kui s ASP 592 N -2.57 7.42 -0.18 0.00 1.47 -1.26 -4.89 116.67 116.66 2kui s ASP 592 Ca 0.14 1.75 0.01 0.00 1.18 0.00 0.00 52.55 55.63 2kui s ASP 592 Cb -0.06 -2.54 0.04 0.00 -0.34 0.00 0.00 42.92 40.01 2kui s ASP 592 CO 0.06 0.11 -0.12 -0.69 0.68 0.00 0.00 175.17 175.22 2kui s VAL 593 N -1.30 1.63 -0.49 2.11 1.01 -0.43 -4.92 120.40 118.00 2kui s VAL 593 Ca 0.41 -0.88 -0.22 0.00 0.00 0.00 0.00 61.98 61.28 2kui s VAL 593 Cb -0.22 -1.64 0.04 0.00 0.00 0.00 0.00 36.38 34.55 2kui s VAL 593 CO 0.27 0.27 0.79 1.51 0.00 0.00 0.00 175.10 177.94 2kui s ASP 594 N 1.42 6.34 0.00 3.32 -4.77 -1.26 -1.77 116.67 119.96 2kui s ASP 594 Ca 0.01 -0.36 0.00 0.00 -3.30 0.00 0.00 52.55 48.90 2kui s ASP 594 Cb -0.15 -2.38 0.00 0.00 -1.09 0.00 0.00 42.92 39.30 2kui s ASP 594 CO -0.09 -1.00 0.80 0.00 0.70 0.00 0.00 175.17 175.58 2kui n ALA 595 N 6.81 1.64 0.00 2.11 0.00 -1.26 -5.03 120.51 124.77 2kui n ALA 595 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 52.64 2kui n ALA 595 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 2kui n ALA 595 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 596 N -0.31 2.87 0.19 0.00 0.00 -1.26 -4.71 105.19 101.97 2kui n GLY 596 Ca 0.00 -1.96 -0.05 0.00 0.00 0.00 0.00 46.02 44.01 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 0.61 2.00 -0.02 0.00 -2.00 -1.49 103.07 102.17 2kui h GLY 597 Ca 0.00 -0.14 -0.06 0.00 0.00 0.00 0.00 47.33 47.13 2kui h GLY 597 CO 0.00 0.08 -0.28 0.23 0.00 0.00 0.00 176.54 176.57 2kui h SER 598 N 0.41 0.00 0.05 0.19 0.87 -2.02 -2.58 113.55 110.47 2kui h SER 598 Ca 0.20 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 2kui h SER 598 Cb 0.13 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 2kui h SER 598 CO -0.16 0.28 -0.04 0.00 -0.53 0.00 0.00 176.83 176.39 2kui n GLN 599 N -4.16 1.33 0.00 2.24 1.13 -0.60 -3.95 117.38 113.38 2kui n GLN 599 Ca -0.02 -0.63 0.00 0.00 -1.94 0.00 0.00 57.00 54.41 2kui n GLN 599 Cb 0.34 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.20 2kui n GLN 599 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2kui n HIS 600 N -0.28 0.00 -0.79 1.08 8.25 -0.97 -2.59 115.22 119.92 2kui n HIS 600 Ca 0.19 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.45 2kui n HIS 600 Cb 0.29 -0.41 0.13 0.00 1.12 0.00 0.00 29.99 31.12 2kui n HIS 600 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2kui n ASN 601 N -1.73 3.99 -4.73 0.41 0.23 -1.26 -2.06 115.26 110.10 2kui n ASN 601 Ca 0.00 -3.28 -0.35 0.00 -0.53 0.00 0.00 54.58 50.41 2kui n ASN 601 Cb 0.00 -0.79 -0.09 0.00 -2.08 0.00 0.00 39.78 36.82 2kui n ASN 601 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 2kui s ARG 602 N -2.62 3.09 0.24 -3.83 1.81 -1.25 0.42 118.95 116.81 2kui s ARG 602 Ca 0.45 -0.34 -0.30 0.00 -1.72 0.00 0.00 55.73 53.82 2kui s ARG 602 Cb 0.38 -2.89 -0.09 0.00 -0.45 0.00 0.00 34.95 31.90 2kui s ARG 602 CO 0.08 0.72 1.13 0.08 -0.68 0.00 0.00 175.30 176.63 2kui s VAL 603 N -0.93 3.52 -0.24 3.52 1.01 -0.64 -2.76 120.40 123.88 2kui s VAL 603 Ca 0.14 1.43 -0.18 0.00 0.00 0.00 0.00 61.98 63.37 2kui s VAL 603 Cb -0.12 -3.91 -0.15 0.00 0.00 0.00 0.00 36.38 32.20 2kui s VAL 603 CO 0.03 0.30 -0.06 0.52 0.00 0.00 0.00 175.10 175.90 2kui n VAL 604 N 1.66 1.53 -3.84 2.92 0.31 0.11 -4.56 118.33 116.45 2kui n VAL 604 Ca 0.01 -0.17 -0.10 0.00 -0.01 0.00 0.00 64.34 64.07 2kui n VAL 604 Cb 0.45 -1.99 -0.08 0.00 -0.91 0.00 0.00 33.84 31.31 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 -2.43 0.07 -0.16 3.52 -0.85 -1.26 -4.95 117.35 111.28 2kui s TYR 605 Ca -0.33 -0.33 0.01 0.00 -0.52 0.00 0.00 57.07 55.91 2kui s TYR 605 Cb 0.10 -0.03 0.02 0.00 0.38 0.00 0.00 41.96 42.42 2kui s TYR 605 CO 0.53 -0.46 -0.20 1.14 -1.52 0.00 0.00 175.55 175.05 2kui s GLN 606 N -2.83 2.87 0.09 -3.49 -2.07 -1.26 -3.68 119.66 109.29 2kui s GLN 606 Ca -0.03 -0.79 -0.27 0.00 -1.82 0.00 0.00 55.36 52.45 2kui s GLN 606 Cb 0.00 -2.43 -0.14 0.00 -1.09 0.00 0.00 33.01 29.34 2kui s GLN 606 CO -0.05 -0.14 1.69 -0.97 -1.32 0.00 0.00 175.29 174.49 2kui h ASN 607 N 7.73 -0.37 -3.39 12.60 -0.73 -0.90 -3.39 115.58 127.14 2kui h ASN 607 Ca -0.40 0.03 -0.59 0.00 1.87 0.00 0.00 56.30 57.21 2kui h ASN 607 Cb 1.16 0.11 -0.09 0.00 0.27 0.00 0.00 38.32 39.77 2kui h ASN 607 CO 0.59 -0.24 0.20 -2.16 -0.37 0.00 0.00 177.43 175.46 2kui s PRO 608 N -6.13 4.23 0.76 6.67 0.05 -1.26 -5.01 135.00 134.31 2kui s PRO 608 Ca -0.15 0.73 -0.13 0.00 0.05 0.00 0.00 61.00 61.50 2kui s PRO 608 Cb 0.06 -3.58 0.06 0.00 0.05 0.00 0.00 34.50 31.08 2kui s PRO 608 CO 0.65 -0.28 1.17 -2.14 0.05 0.00 0.00 177.00 176.45 2kui s PRO 609 N 2.02 2.03 0.16 0.56 0.02 -1.26 -4.89 135.00 133.64 2kui s PRO 609 Ca 0.31 1.59 -0.32 0.00 0.02 0.00 0.00 61.00 62.60 2kui s PRO 609 Cb -0.16 -1.84 -0.12 0.00 0.02 0.00 0.00 34.50 32.41 2kui s PRO 609 CO 0.11 -1.88 1.75 0.00 -0.33 0.00 0.00 177.00 176.65 2kui n ALA 610 N -3.08 2.36 0.00 -1.55 0.00 -1.26 -1.49 120.51 115.49 2kui n ALA 610 Ca 0.12 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.93 2kui n ALA 610 Cb 0.51 -2.53 0.00 0.00 0.00 0.00 0.00 19.45 17.43 2kui n ALA 610 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 611 N 4.01 0.44 3.90 0.00 0.00 -0.54 -4.96 105.19 108.05 2kui n GLY 611 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 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 4.93 0.11 2.61 2.01 -0.56 -4.71 115.64 118.03 2kui s THR 612 Ca 0.00 0.19 -0.15 0.00 0.31 0.00 0.00 61.69 62.05 2kui s THR 612 Cb 0.00 -3.80 -0.07 0.00 0.01 0.00 0.00 72.50 68.65 2kui s THR 612 CO 0.00 -0.59 0.52 -0.83 -0.69 0.00 0.00 174.62 173.02 2kui s GLY 613 N -3.61 2.48 -0.02 4.40 0.00 -1.26 -0.21 107.32 109.11 2kui s GLY 613 Ca 0.47 -0.15 0.05 0.00 0.00 0.00 0.00 44.72 45.10 2kui s GLY 613 CO 0.36 0.16 -0.17 -1.34 0.00 0.00 0.00 173.10 172.11 2kui s VAL 614 N -1.35 2.82 1.19 1.40 -7.23 0.62 -4.86 120.40 112.98 2kui s VAL 614 Ca 0.34 -0.93 -0.20 0.00 -1.81 0.00 0.00 61.98 59.38 2kui s VAL 614 Cb -0.16 -2.11 0.29 0.00 0.56 0.00 0.00 36.38 34.96 2kui s VAL 614 CO 0.18 0.51 1.11 -0.46 -0.31 0.00 0.00 175.10 176.13 2kui n ASN 615 N 2.08 -1.87 -0.10 4.85 6.94 -1.26 -1.26 115.26 124.64 2kui n ASN 615 Ca -0.17 -1.20 0.00 0.00 -0.02 0.00 0.00 54.58 53.20 2kui n ASN 615 Cb 0.52 -1.00 0.27 0.00 -2.36 0.00 0.00 39.78 37.22 2kui n ASN 615 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 2kui h ARG 616 N 0.00 0.76 -0.77 -3.83 2.43 -0.88 0.40 114.38 112.48 2kui h ARG 616 Ca -0.41 -0.10 -0.05 0.00 -0.81 0.00 0.00 59.98 58.62 2kui h ARG 616 Cb 1.24 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.61 2kui h ARG 616 CO 0.27 0.60 0.30 0.22 -1.51 0.00 0.00 179.97 179.86 2kui h ASP 617 N 0.76 1.07 0.00 -3.80 3.58 -1.90 -3.45 116.42 112.68 2kui h ASP 617 Ca 0.19 -0.18 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2kui h ASP 617 Cb 0.11 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 40.88 2kui h ASP 617 CO -0.02 0.96 0.00 0.61 -2.88 0.00 0.00 179.24 177.90 2kui n GLY 618 N -0.86 0.71 3.65 -0.78 0.00 0.13 -1.43 105.19 106.61 2kui n GLY 618 Ca 0.07 -0.64 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 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 3.70 -0.06 -0.61 -1.16 -1.26 -4.67 121.20 115.14 2kui s ILE 619 Ca 0.00 0.83 0.02 0.00 -0.51 0.00 0.00 60.65 60.99 2kui s ILE 619 Cb 0.00 -3.59 0.01 0.00 0.61 0.00 0.00 42.46 39.49 2kui s ILE 619 CO 0.00 -0.14 -0.10 -0.51 -2.81 0.00 0.00 174.94 171.38 2kui s ILE 620 N 4.34 0.97 -0.31 2.00 -1.16 -1.26 -4.80 121.20 120.98 2kui s ILE 620 Ca 0.71 -0.39 -0.12 0.00 -0.51 0.00 0.00 60.65 60.34 2kui s ILE 620 Cb -0.29 -0.90 -0.03 0.00 0.61 0.00 0.00 42.46 41.85 2kui s ILE 620 CO 0.27 0.32 0.21 -0.89 -2.81 0.00 0.00 174.94 172.04 2kui s THR 621 N 0.68 5.17 0.03 4.00 2.01 -1.26 -4.72 115.64 121.56 2kui s THR 621 Ca -0.13 -0.11 0.00 0.00 0.31 0.00 0.00 61.69 61.77 2kui s THR 621 Cb -0.15 -3.58 -0.02 0.00 0.01 0.00 0.00 72.50 68.76 2kui s THR 621 CO 0.03 0.10 -0.04 -1.48 -0.69 0.00 0.00 174.62 172.54 2kui s LEU 622 N 1.72 2.26 0.06 4.42 2.34 -1.26 -0.11 118.68 128.11 2kui s LEU 622 Ca 0.06 -0.55 0.03 0.00 0.06 0.00 0.00 54.13 53.73 2kui s LEU 622 Cb -0.17 0.06 -0.03 0.00 -0.56 0.00 0.00 46.19 45.49 2kui s LEU 622 CO 0.10 -0.31 -0.09 -0.60 -1.06 0.00 0.00 176.35 174.39 2kui s ARG 623 N -1.67 0.66 0.35 1.48 3.52 -1.24 -4.71 118.95 117.33 2kui s ARG 623 Ca -0.13 -0.90 0.09 0.00 -0.13 0.00 0.00 55.73 54.65 2kui s ARG 623 Cb -0.09 -0.44 -0.07 0.00 -1.56 0.00 0.00 34.95 32.80 2kui s ARG 623 CO -0.01 0.08 -0.08 -0.59 -0.81 0.00 0.00 175.30 173.88 2kui s PHE 624 N -1.68 2.39 0.00 5.12 -0.71 -1.26 0.04 117.98 121.87 2kui s PHE 624 Ca -0.04 -0.53 0.00 0.00 -1.04 0.00 0.00 56.93 55.31 2kui s PHE 624 Cb -0.08 -1.41 0.00 0.00 -1.21 0.00 0.00 43.02 40.32 2kui s PHE 624 CO 0.00 0.55 0.00 0.41 -1.34 0.00 0.00 175.22 174.84 2kui n GLY 625 N -0.80 -0.09 0.61 1.99 0.00 -0.88 -4.43 105.19 101.60 2kui n GLY 625 Ca -0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.10 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14