#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kui s ILE 356 N 0.00 3.80 0.60 -0.61 1.10 -1.26 -5.00 121.20 119.83 2kui s ILE 356 Ca 0.00 1.03 -0.20 0.00 -0.51 0.00 0.00 60.65 60.97 2kui s ILE 356 Cb 0.00 -3.43 -0.03 0.00 0.15 0.00 0.00 42.46 39.15 2kui s ILE 356 CO 0.00 -0.33 1.30 -0.89 -2.11 0.00 0.00 174.94 172.91 2kui s THR 357 N -2.14 2.16 -1.08 4.00 2.01 -1.26 -4.92 115.64 114.40 2kui s THR 357 Ca 0.66 0.10 -0.04 0.00 0.31 0.00 0.00 61.69 62.72 2kui s THR 357 Cb -0.16 -3.05 0.31 0.00 0.01 0.00 0.00 72.50 69.61 2kui s THR 357 CO 0.26 -0.01 1.46 0.54 -0.69 0.00 0.00 174.62 176.17 2kui n ARG 358 N -1.52 4.41 -3.83 4.92 3.00 -1.26 -4.98 116.66 117.40 2kui n ARG 358 Ca 0.13 -4.55 -0.33 0.00 -0.01 0.00 0.00 57.85 53.09 2kui n ARG 358 Cb 0.47 -2.51 -0.05 0.00 0.00 0.00 0.00 32.46 30.37 2kui n ARG 358 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2kui s ASP 359 N -1.57 6.42 0.06 0.55 1.01 -1.26 -4.63 116.67 117.25 2kui s ASP 359 Ca 0.31 0.44 0.08 0.00 0.71 0.00 0.00 52.55 54.09 2kui s ASP 359 Cb 0.04 -2.04 -0.03 0.00 1.01 0.00 0.00 42.92 41.90 2kui s ASP 359 CO 0.09 0.23 -0.20 0.68 0.21 0.00 0.00 175.17 176.18 2kui s VAL 360 N -1.37 2.63 -0.25 -1.27 -7.23 0.79 -4.69 120.40 109.01 2kui s VAL 360 Ca 0.30 -1.31 -0.15 0.00 -1.81 0.00 0.00 61.98 59.01 2kui s VAL 360 Cb -0.13 -2.11 -0.04 0.00 0.56 0.00 0.00 36.38 34.67 2kui s VAL 360 CO 0.19 0.30 0.38 -1.58 -0.31 0.00 0.00 175.10 174.08 2kui s GLN 361 N -1.53 4.06 -0.26 4.82 -0.44 -1.26 -0.40 119.66 124.65 2kui s GLN 361 Ca 0.14 0.08 -0.13 0.00 -2.50 0.00 0.00 55.36 52.96 2kui s GLN 361 Cb -0.10 -3.62 -0.04 0.00 -1.64 0.00 0.00 33.01 27.60 2kui s GLN 361 CO 0.05 -0.21 0.29 0.08 0.50 0.00 0.00 175.29 176.00 2kui s VAL 362 N 1.86 5.25 0.82 1.34 1.01 -0.14 -4.99 120.40 125.54 2kui s VAL 362 Ca 0.16 0.42 -0.12 0.00 0.00 0.00 0.00 61.98 62.44 2kui s VAL 362 Cb -0.15 -3.62 0.09 0.00 0.00 0.00 0.00 36.38 32.69 2kui s VAL 362 CO 0.09 0.23 1.15 -2.84 0.00 0.00 0.00 175.10 173.73 2kui s PRO 363 N 1.71 1.67 0.40 2.72 0.02 -1.26 -3.70 135.00 136.56 2kui s PRO 363 Ca 0.12 1.51 0.08 0.00 0.02 0.00 0.00 61.00 62.73 2kui s PRO 363 Cb -0.15 -1.80 -0.01 0.00 0.02 0.00 0.00 34.50 32.56 2kui s PRO 363 CO 0.09 -2.14 0.45 0.34 -0.33 0.00 0.00 177.00 175.41 2kui s ASP 364 N -2.67 5.41 0.00 2.53 -1.08 -1.26 -4.93 116.67 114.68 2kui s ASP 364 Ca 0.67 -0.53 0.00 0.00 -0.52 0.00 0.00 52.55 52.18 2kui s ASP 364 Cb -0.23 -0.73 0.00 0.00 -1.46 0.00 0.00 42.92 40.50 2kui s ASP 364 CO 0.53 -0.63 0.41 0.52 0.52 0.00 0.00 175.17 176.53 2kui n VAL 365 N -1.65 0.15 -1.72 1.11 0.31 -1.26 -5.07 118.33 110.20 2kui n VAL 365 Ca 0.04 -0.36 -0.40 0.00 -0.01 0.00 0.00 64.34 63.62 2kui n VAL 365 Cb 0.60 1.25 0.03 0.00 -0.91 0.00 0.00 33.84 34.80 2kui n VAL 365 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 2kui n ARG 366 N -0.07 1.82 0.00 5.55 1.85 -1.26 -2.81 116.66 121.73 2kui n ARG 366 Ca 0.00 0.66 0.00 0.00 -1.00 0.00 0.00 57.85 57.51 2kui n ARG 366 Cb 0.17 -2.48 0.00 0.00 -1.05 0.00 0.00 32.46 29.10 2kui n ARG 366 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2kui n GLY 367 N 0.79 0.35 0.00 2.89 0.00 0.23 -4.98 105.19 104.48 2kui n GLY 367 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2kui n GLY 367 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kui n GLN 368 N -1.66 0.00 -3.44 1.61 6.02 -1.13 -4.87 117.38 113.91 2kui n GLN 368 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 2kui n GLN 368 Cb 0.00 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.24 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 -0.02 -0.55 0.21 1.08 1.04 -1.26 -3.95 113.70 110.25 2kui s SER 369 Ca 0.00 0.01 -0.08 0.00 0.48 0.00 0.00 55.95 56.35 2kui s SER 369 Cb 0.00 0.59 0.15 0.00 0.10 0.00 0.00 66.02 66.85 2kui s SER 369 CO 0.00 -0.94 1.78 -1.28 0.98 0.00 0.00 173.24 173.77 2kui h SER 370 N 2.08 1.06 -0.22 7.02 0.87 -0.99 -1.77 113.55 121.61 2kui h SER 370 Ca -0.34 -0.17 -0.02 0.00 -1.23 0.00 0.00 61.79 60.04 2kui h SER 370 Cb 1.30 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.97 2kui h SER 370 CO 0.39 0.94 0.07 0.00 -0.53 0.00 0.00 176.83 177.69 2kui h ALA 371 N 1.16 0.28 -0.23 6.23 0.00 -1.96 0.18 119.26 124.93 2kui h ALA 371 Ca 0.26 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 2kui h ALA 371 Cb 0.20 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2kui h ALA 371 CO -0.02 -0.10 -0.43 0.22 0.00 0.00 0.00 179.25 178.92 2kui h ASP 372 N 0.18 0.60 0.10 0.00 3.58 -1.94 0.11 116.42 119.04 2kui h ASP 372 Ca 0.07 -0.27 -0.00 0.00 0.42 0.00 0.00 57.03 57.24 2kui h ASP 372 Cb 0.23 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.11 2kui h ASP 372 CO -0.00 0.95 -0.05 0.00 -2.88 0.00 0.00 179.24 177.26 2kui h ALA 373 N 1.08 -0.13 -0.35 -0.78 0.00 -1.16 -1.34 119.26 116.57 2kui h ALA 373 Ca 0.03 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2kui h ALA 373 Cb 0.93 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 2kui h ALA 373 CO 0.08 -0.45 0.21 0.82 0.00 0.00 0.00 179.25 179.91 2kui h ILE 374 N -0.37 1.12 -0.59 0.00 2.04 -0.54 -2.49 117.51 116.69 2kui h ILE 374 Ca -0.01 -0.29 0.02 0.00 1.00 0.00 0.00 64.86 65.58 2kui h ILE 374 Cb 0.31 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 37.03 2kui h ILE 374 CO 0.02 0.12 0.36 0.00 0.00 0.00 0.00 178.15 178.66 2kui h ALA 375 N 1.09 0.76 -0.06 1.87 0.00 -0.71 0.13 119.26 122.34 2kui h ALA 375 Ca 0.13 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2kui h ALA 375 Cb 0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2kui h ALA 375 CO -0.02 0.10 -0.02 1.15 0.00 0.00 0.00 179.25 180.46 2kui h THR 376 N 0.72 1.30 -0.66 0.00 2.02 -1.11 -2.15 112.91 113.03 2kui h THR 376 Ca 0.23 -0.95 -0.07 0.00 0.77 0.00 0.00 66.41 66.39 2kui h THR 376 Cb 0.01 1.83 -0.03 0.00 -1.74 0.00 0.00 68.15 68.22 2kui h THR 376 CO -0.09 0.26 0.12 -0.07 0.37 0.00 0.00 175.52 176.10 2kui h LEU 377 N -0.25 1.04 -0.84 2.58 -0.00 -1.26 -2.23 115.31 114.34 2kui h LEU 377 Ca 0.01 -0.25 -0.09 0.00 -0.00 0.00 0.00 57.88 57.55 2kui h LEU 377 Cb 0.42 -0.27 -0.02 0.00 -0.00 0.00 0.00 40.66 40.79 2kui h LEU 377 CO 0.01 1.03 -0.14 -0.61 -0.00 0.00 0.00 178.44 178.72 2kui h GLN 378 N 1.00 0.71 0.00 1.13 5.75 -0.97 0.12 115.11 122.86 2kui h GLN 378 Ca 0.20 -0.24 -0.05 0.00 -0.15 0.00 0.00 58.65 58.41 2kui h GLN 378 Cb 0.42 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.91 2kui h GLN 378 CO 0.01 0.82 -0.24 -0.91 -2.65 0.00 0.00 178.83 175.86 2kui h ASN 379 N 0.64 0.00 0.57 -0.69 2.35 -1.10 -2.27 115.58 115.07 2kui h ASN 379 Ca 0.11 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 2kui h ASN 379 Cb 0.61 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.98 2kui h ASN 379 CO 0.04 0.24 -0.30 0.54 -1.65 0.00 0.00 177.43 176.30 2kui n ARG 380 N -3.49 0.19 -0.11 0.81 5.12 -0.66 -4.91 116.66 113.62 2kui n ARG 380 Ca -0.00 -0.09 0.00 0.00 -1.93 0.00 0.00 57.85 55.83 2kui n ARG 380 Cb 0.41 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.21 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 1.45 0.72 3.81 -0.13 0.00 -0.66 -4.73 105.19 105.64 2kui n GLY 381 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.13 3.42 -0.12 1.61 0.40 0.34 -4.60 117.98 116.90 2kui s PHE 382 Ca 0.00 1.66 -0.14 0.00 -0.60 0.00 0.00 56.93 57.85 2kui s PHE 382 Cb 0.00 -2.88 -0.05 0.00 0.51 0.00 0.00 43.02 40.61 2kui s PHE 382 CO 0.00 -0.03 0.34 0.15 0.70 0.00 0.00 175.22 176.38 2kui s LYS 383 N -2.86 4.15 -0.10 0.44 -0.14 0.67 -3.80 119.74 118.10 2kui s LYS 383 Ca 0.59 0.21 0.04 0.00 -1.36 0.00 0.00 55.97 55.44 2kui s LYS 383 Cb -0.12 -3.37 -0.00 0.00 -1.68 0.00 0.00 37.83 32.65 2kui s LYS 383 CO 0.16 0.35 -0.22 0.96 -0.76 0.00 0.00 175.35 175.84 2kui s ILE 384 N 0.10 2.26 -0.15 2.17 -5.25 -1.26 0.09 121.20 119.15 2kui s ILE 384 Ca 0.20 -0.96 -0.01 0.00 -0.99 0.00 0.00 60.65 58.89 2kui s ILE 384 Cb -0.14 -1.87 -0.01 0.00 2.95 0.00 0.00 42.46 43.38 2kui s ILE 384 CO 0.07 0.56 -0.10 -0.60 -1.79 0.00 0.00 174.94 173.07 2kui s ARG 385 N 0.24 3.41 -0.12 0.37 3.52 0.73 -4.94 118.95 122.16 2kui s ARG 385 Ca -0.14 -0.65 0.03 0.00 -0.13 0.00 0.00 55.73 54.83 2kui s ARG 385 Cb -0.17 -2.75 0.00 0.00 -1.56 0.00 0.00 34.95 30.48 2kui s ARG 385 CO 0.07 0.12 -0.22 0.99 -0.81 0.00 0.00 175.30 175.45 2kui s THR 386 N 0.61 2.16 -0.23 4.11 2.01 -1.26 0.14 115.64 123.19 2kui s THR 386 Ca -0.06 -0.97 -0.04 0.00 0.31 0.00 0.00 61.69 60.93 2kui s THR 386 Cb -0.15 -1.85 -0.01 0.00 0.01 0.00 0.00 72.50 70.50 2kui s THR 386 CO 0.03 0.55 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.72 2kui s LEU 387 N 0.52 2.98 -0.26 4.42 2.01 0.97 -4.96 118.68 124.37 2kui s LEU 387 Ca -0.14 -0.39 -0.10 0.00 0.01 0.00 0.00 54.13 53.51 2kui s LEU 387 Cb -0.17 -1.76 -0.05 0.00 0.01 0.00 0.00 46.19 44.22 2kui s LEU 387 CO 0.05 -0.03 0.16 0.00 1.01 0.00 0.00 176.35 177.54 2kui s GLN 388 N 1.49 3.99 -0.07 1.70 0.00 -1.26 -0.22 119.66 125.29 2kui s GLN 388 Ca 0.06 -0.31 0.05 0.00 -0.00 0.00 0.00 55.36 55.16 2kui s GLN 388 Cb -0.14 -3.56 -0.01 0.00 0.00 0.00 0.00 33.01 29.29 2kui s GLN 388 CO -0.02 -0.05 -0.24 0.15 0.00 0.00 0.00 175.29 175.12 2kui s LYS 389 N 1.37 2.66 0.68 9.60 1.02 0.37 -4.95 119.74 130.49 2kui s LYS 389 Ca 0.07 -0.89 -0.13 0.00 0.02 0.00 0.00 55.97 55.04 2kui s LYS 389 Cb -0.15 -2.21 0.00 0.00 -0.52 0.00 0.00 37.83 34.96 2kui s LYS 389 CO 0.07 0.35 1.08 -2.14 -0.92 0.00 0.00 175.35 173.79 2kui s PRO 390 N -0.08 2.86 0.00 -1.68 0.02 -1.26 -0.10 135.00 134.76 2kui s PRO 390 Ca -0.06 1.16 0.00 0.00 0.02 0.00 0.00 61.00 62.12 2kui s PRO 390 Cb -0.14 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.40 2kui s PRO 390 CO 0.05 -1.17 0.00 -3.47 -0.33 0.00 0.00 177.00 172.07 2kui n ASP 391 N -2.76 0.00 -1.43 2.53 2.03 -0.97 -4.81 116.55 111.14 2kui n ASP 391 Ca 0.09 0.00 0.10 0.00 0.52 0.00 0.00 54.79 55.50 2kui n ASP 391 Cb 0.53 0.43 0.33 0.00 -0.72 0.00 0.00 41.12 41.69 2kui n ASP 391 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2kui n SER 392 N -0.95 4.35 0.16 1.67 7.64 -1.26 -3.96 113.62 121.27 2kui n SER 392 Ca 0.00 -2.29 0.03 0.00 1.01 0.00 0.00 58.87 57.63 2kui n SER 392 Cb 0.00 -0.52 0.17 0.00 -1.01 0.00 0.00 64.21 62.85 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 3.95 0.94 -3.54 0.44 2.02 -1.96 -3.43 112.91 111.33 2kui h THR 393 Ca 0.00 -1.96 -0.52 0.00 0.77 0.00 0.00 66.41 64.70 2kui h THR 393 Cb 1.25 2.21 -0.03 0.00 -1.74 0.00 0.00 68.15 69.84 2kui h THR 393 CO 0.14 0.47 -0.03 0.27 0.37 0.00 0.00 175.52 176.74 2kui s ILE 394 N -3.27 4.82 0.24 3.11 -0.00 -1.25 -5.03 121.20 119.82 2kui s ILE 394 Ca 0.02 0.69 -0.30 0.00 -0.00 0.00 0.00 60.65 61.06 2kui s ILE 394 Cb 0.09 -3.63 -0.11 0.00 -0.00 0.00 0.00 42.46 38.82 2kui s ILE 394 CO 0.72 -0.08 1.53 -2.16 -0.00 0.00 0.00 174.94 174.95 2kui s PRO 395 N -2.79 4.20 1.01 0.37 0.04 -1.26 -4.58 135.00 131.99 2kui s PRO 395 Ca 0.49 2.42 -0.13 0.00 0.04 0.00 0.00 61.00 63.82 2kui s PRO 395 Cb -0.11 -3.09 0.12 0.00 0.04 0.00 0.00 34.50 31.45 2kui s PRO 395 CO 0.20 -0.55 0.62 -2.30 0.04 0.00 0.00 177.00 175.01 2kui n PRO 396 N 2.74 -0.89 0.00 0.56 -0.02 -1.26 0.03 135.00 136.16 2kui n PRO 396 Ca 0.09 -0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 2kui n PRO 396 Cb 0.39 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 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 -2.71 0.00 -4.54 2.55 5.75 -1.25 -3.92 116.55 112.43 2kui n ASP 397 Ca 0.07 0.33 -0.42 0.00 -0.01 0.00 0.00 54.79 54.76 2kui n ASP 397 Cb 0.55 -0.33 -0.03 0.00 -1.03 0.00 0.00 41.12 40.27 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 -2.63 2.62 -0.02 2.11 3.76 -1.26 -0.26 115.29 119.60 2kui s HIS 398 Ca 0.00 0.06 -0.30 0.00 -0.15 0.00 0.00 55.06 54.68 2kui s HIS 398 Cb 0.00 -4.35 -0.07 0.00 1.11 0.00 0.00 32.58 29.28 2kui s HIS 398 CO 0.00 -1.60 1.75 0.14 -0.85 0.00 0.00 174.74 174.18 2kui s VAL 399 N 4.62 3.40 -0.16 -0.90 -7.23 -1.25 -4.86 120.40 114.01 2kui s VAL 399 Ca 0.34 0.50 0.17 0.00 -1.81 0.00 0.00 61.98 61.19 2kui s VAL 399 Cb -0.10 -3.32 -0.25 0.00 0.56 0.00 0.00 36.38 33.26 2kui s VAL 399 CO 0.20 -0.04 0.21 0.00 -0.31 0.00 0.00 175.10 175.15 2kui n ILE 400 N 5.47 1.33 -3.89 -0.62 0.13 -1.26 0.77 119.36 121.29 2kui n ILE 400 Ca 0.18 -0.82 -0.09 0.00 -1.10 0.00 0.00 62.75 60.92 2kui n ILE 400 Cb 0.42 -0.53 -0.08 0.00 -0.84 0.00 0.00 39.64 38.61 2kui n ILE 400 CO 0.00 0.00 0.00 -0.83 2.80 0.00 0.00 176.55 178.52 2kui s GLY 401 N -5.35 0.12 0.27 4.50 0.00 -1.26 -4.32 107.32 101.28 2kui s GLY 401 Ca -0.09 -0.58 0.06 0.00 0.00 0.00 0.00 44.72 44.11 2kui s GLY 401 CO 0.83 -0.75 0.22 -1.30 0.00 0.00 0.00 173.10 172.10 2kui n THR 402 N 0.26 0.00 -3.87 0.90 -2.24 -1.26 -4.87 114.28 103.20 2kui n THR 402 Ca -0.16 -1.92 -0.35 0.00 -2.27 0.00 0.00 64.05 59.34 2kui n THR 402 Cb 0.61 0.95 -0.08 0.00 -2.10 0.00 0.00 70.33 69.71 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 -2.85 6.09 0.00 3.42 -1.08 -1.26 -4.98 116.67 116.01 2kui s ASP 403 Ca 0.31 0.26 0.00 0.00 -0.52 0.00 0.00 52.55 52.60 2kui s ASP 403 Cb 0.01 -2.02 0.00 0.00 -1.46 0.00 0.00 42.92 39.45 2kui s ASP 403 CO 0.22 0.26 0.37 -2.65 0.52 0.00 0.00 175.17 173.88 2kui n PRO 404 N 2.99 0.39 -0.09 4.34 -0.02 -1.26 -3.59 135.00 137.76 2kui n PRO 404 Ca -0.17 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.24 2kui n PRO 404 Cb 0.53 -1.02 0.01 0.00 -0.02 0.00 0.00 33.50 33.00 2kui n PRO 404 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kui h ALA 405 N 1.74 0.29 -0.04 3.55 0.00 -1.93 -0.00 119.26 122.86 2kui h ALA 405 Ca 0.00 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 2kui h ALA 405 Cb 0.02 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2kui h ALA 405 CO 0.00 -0.41 -0.48 0.00 0.00 0.00 0.00 179.25 178.36 2kui h ALA 406 N 1.28 1.13 0.00 0.00 0.00 -1.86 -2.58 119.26 117.23 2kui h ALA 406 Ca 0.16 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2kui h ALA 406 Cb 0.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2kui h ALA 406 CO -0.26 0.62 0.00 0.09 0.00 0.00 0.00 179.25 179.70 2kui n ASN 407 N -3.97 0.00 -4.91 0.00 5.03 -0.46 -0.96 115.26 110.00 2kui n ASN 407 Ca -0.02 0.05 -0.25 0.00 0.87 0.00 0.00 54.58 55.24 2kui n ASN 407 Cb 0.51 -0.33 -0.04 0.00 -1.02 0.00 0.00 39.78 38.90 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 -2.67 5.06 -0.36 3.41 2.01 -0.14 -4.82 115.64 118.14 2kui s THR 408 Ca 0.21 -0.87 -0.29 0.00 0.31 0.00 0.00 61.69 61.06 2kui s THR 408 Cb 0.17 -3.63 0.00 0.00 0.01 0.00 0.00 72.50 69.05 2kui s THR 408 CO 0.40 -0.15 1.41 -0.44 -0.69 0.00 0.00 174.62 175.16 2kui s SER 409 N -3.35 6.43 0.21 3.53 0.01 -1.26 -4.05 113.70 115.22 2kui s SER 409 Ca 0.33 1.04 0.06 0.00 1.31 0.00 0.00 55.95 58.69 2kui s SER 409 Cb -0.10 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.54 2kui s SER 409 CO 0.27 -1.32 -0.09 0.68 0.41 0.00 0.00 173.24 173.19 2kui s VAL 410 N 5.14 1.46 0.17 3.43 -7.23 0.47 -4.66 120.40 119.17 2kui s VAL 410 Ca 0.61 -2.13 -0.31 0.00 -1.81 0.00 0.00 61.98 58.35 2kui s VAL 410 Cb -0.16 -2.15 -0.09 0.00 0.56 0.00 0.00 36.38 34.54 2kui s VAL 410 CO 0.29 -0.51 1.44 -0.44 -0.31 0.00 0.00 175.10 175.57 2kui s SER 411 N -3.31 6.74 0.33 4.85 0.01 -1.26 -0.15 113.70 120.91 2kui s SER 411 Ca 0.24 2.48 -0.29 0.00 1.31 0.00 0.00 55.95 59.69 2kui s SER 411 Cb 0.02 -2.60 -0.11 0.00 0.21 0.00 0.00 66.02 63.54 2kui s SER 411 CO 0.07 -0.69 1.57 0.00 0.41 0.00 0.00 173.24 174.60 2kui n ALA 412 N 3.44 2.56 -1.13 1.44 0.00 -1.26 -3.73 120.51 121.83 2kui n ALA 412 Ca 0.10 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.90 2kui n ALA 412 Cb 0.41 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.40 2kui n ALA 412 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 413 N 1.52 0.50 1.46 0.00 0.00 -1.26 -5.04 105.19 102.37 2kui n GLY 413 Ca 0.06 -0.27 -0.08 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.47 1.11 -4.38 1.61 -0.08 -1.24 -4.73 116.55 108.37 2kui n ASP 414 Ca 0.00 -1.63 -0.36 0.00 -1.51 0.00 0.00 54.79 51.29 2kui n ASP 414 Cb 0.28 -0.11 -0.13 0.00 2.34 0.00 0.00 41.12 43.50 2kui n ASP 414 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2kui s GLU 415 N -2.94 3.52 -0.21 -0.67 2.02 -1.26 -0.24 118.70 118.93 2kui s GLU 415 Ca 0.19 -0.55 -0.04 0.00 0.02 0.00 0.00 54.97 54.59 2kui s GLU 415 Cb -0.01 -3.15 -0.02 0.00 0.10 0.00 0.00 34.13 31.05 2kui s GLU 415 CO 0.12 -0.16 -0.03 0.42 0.02 0.00 0.00 175.26 175.62 2kui s ILE 416 N 1.47 3.58 -0.18 -1.63 -1.09 0.11 -4.97 121.20 118.49 2kui s ILE 416 Ca 0.05 -0.43 -0.09 0.00 -2.23 0.00 0.00 60.65 57.96 2kui s ILE 416 Cb -0.15 -2.62 -0.05 0.00 -1.58 0.00 0.00 42.46 38.07 2kui s ILE 416 CO 0.00 0.43 0.10 -0.89 -1.23 0.00 0.00 174.94 173.36 2kui s THR 417 N 1.22 5.18 -0.04 2.92 2.01 -1.26 -0.19 115.64 125.48 2kui s THR 417 Ca 0.03 0.10 0.04 0.00 0.31 0.00 0.00 61.69 62.17 2kui s THR 417 Cb -0.14 -3.34 -0.00 0.00 0.01 0.00 0.00 72.50 69.02 2kui s THR 417 CO -0.00 0.47 -0.16 0.54 -0.69 0.00 0.00 174.62 174.77 2kui s VAL 418 N 0.20 1.37 -0.17 3.82 0.11 0.12 -4.48 120.40 121.37 2kui s VAL 418 Ca 0.07 -0.69 -0.01 0.00 -2.93 0.00 0.00 61.98 58.41 2kui s VAL 418 Cb -0.12 -1.17 -0.01 0.00 -1.53 0.00 0.00 36.38 33.55 2kui s VAL 418 CO -0.01 0.40 -0.10 0.54 -3.33 0.00 0.00 175.10 172.60 2kui s ASN 419 N -0.01 4.05 0.11 3.54 2.20 -1.26 -0.02 114.94 123.55 2kui s ASN 419 Ca -0.02 -0.38 0.08 0.00 -0.94 0.00 0.00 52.86 51.60 2kui s ASN 419 Cb -0.11 -1.65 -0.04 0.00 -2.00 0.00 0.00 41.25 37.46 2kui s ASN 419 CO 0.02 0.08 -0.21 0.68 -2.94 0.00 0.00 177.10 174.73 2kui s VAL 420 N 0.85 1.76 0.19 3.54 -7.23 0.69 -4.79 120.40 115.41 2kui s VAL 420 Ca -0.03 -1.58 -0.15 0.00 -1.81 0.00 0.00 61.98 58.41 2kui s VAL 420 Cb -0.15 -1.60 -0.07 0.00 0.56 0.00 0.00 36.38 35.11 2kui s VAL 420 CO 0.00 -0.06 0.61 -0.55 -0.31 0.00 0.00 175.10 174.79 2kui s SER 421 N -1.96 6.87 0.24 4.85 0.15 0.10 -0.48 113.70 123.47 2kui s SER 421 Ca 0.07 1.17 0.11 0.00 0.70 0.00 0.00 55.95 58.00 2kui s SER 421 Cb -0.10 -2.32 -0.05 0.00 -1.71 0.00 0.00 66.02 61.84 2kui s SER 421 CO 0.04 0.05 -0.14 0.42 1.20 0.00 0.00 173.24 174.82 2kui s THR 422 N -1.54 2.84 1.00 6.45 -4.23 0.85 -3.84 115.64 117.16 2kui s THR 422 Ca 0.41 -2.07 -0.19 0.00 -1.18 0.00 0.00 61.69 58.67 2kui s THR 422 Cb -0.15 -2.46 -0.13 0.00 1.34 0.00 0.00 72.50 71.10 2kui s THR 422 CO 0.20 -0.28 -0.79 0.61 -0.54 0.00 0.00 174.62 173.81 2kui n GLY 423 N -0.40 -4.03 3.63 3.99 0.00 -1.26 -2.28 105.19 104.85 2kui n GLY 423 Ca -0.08 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 44.94 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 1.91 0.05 -2.47 1.61 -0.04 -1.26 -2.60 135.00 132.20 2kui n PRO 424 Ca -0.01 0.09 -0.26 0.00 -0.04 0.00 0.00 63.50 63.28 2kui n PRO 424 Cb 0.59 -2.30 0.03 0.00 -0.04 0.00 0.00 33.50 31.79 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 -3.99 2.83 0.43 0.54 2.02 -1.26 -4.76 118.70 114.51 2kui s GLU 425 Ca 0.70 -0.15 -0.04 0.00 0.02 0.00 0.00 54.97 55.50 2kui s GLU 425 Cb -0.28 -2.31 -0.04 0.00 0.10 0.00 0.00 34.13 31.60 2kui s GLU 425 CO 0.54 -0.70 0.71 -0.65 0.02 0.00 0.00 175.26 175.18 2kui s GLN 426 N -4.94 3.55 0.01 1.61 -0.21 -1.26 -4.62 119.66 113.80 2kui s GLN 426 Ca 0.54 0.06 0.08 0.00 0.02 0.00 0.00 55.36 56.06 2kui s GLN 426 Cb -0.10 -2.47 -0.02 0.00 1.00 0.00 0.00 33.01 31.41 2kui s GLN 426 CO 0.44 -0.07 -0.25 1.03 -2.12 0.00 0.00 175.29 174.32 2kui s ARG 427 N -4.48 1.85 0.01 2.91 1.81 0.82 -4.80 118.95 117.06 2kui s ARG 427 Ca 0.45 -0.97 -0.27 0.00 -1.72 0.00 0.00 55.73 53.23 2kui s ARG 427 Cb -0.10 -1.89 -0.04 0.00 -0.45 0.00 0.00 34.95 32.46 2kui s ARG 427 CO 0.41 0.51 0.84 -1.83 -0.68 0.00 0.00 175.30 174.54 2kui s GLU 428 N -0.89 4.53 -0.12 3.54 -1.05 -1.26 0.09 118.70 123.54 2kui s GLU 428 Ca 0.10 1.18 -0.21 0.00 -0.15 0.00 0.00 54.97 55.89 2kui s GLU 428 Cb -0.10 -3.42 -0.03 0.00 -0.44 0.00 0.00 34.13 30.14 2kui s GLU 428 CO 0.00 0.11 0.63 0.42 0.95 0.00 0.00 175.26 177.37 2kui s ILE 429 N 0.53 5.07 0.36 1.83 1.01 -0.54 -4.95 121.20 124.52 2kui s ILE 429 Ca 0.44 1.26 -0.26 0.00 0.00 0.00 0.00 60.65 62.08 2kui s ILE 429 Cb -0.20 -3.96 -0.09 0.00 0.01 0.00 0.00 42.46 38.22 2kui s ILE 429 CO 0.24 0.22 1.16 -2.16 0.00 0.00 0.00 174.94 174.40 2kui s PRO 430 N 1.15 4.24 -0.32 2.79 0.04 -1.26 -4.12 135.00 137.51 2kui s PRO 430 Ca 0.32 1.84 -0.29 0.00 0.04 0.00 0.00 61.00 62.92 2kui s PRO 430 Cb -0.16 -2.83 0.01 0.00 0.04 0.00 0.00 34.50 31.56 2kui s PRO 430 CO 0.14 -0.16 1.20 0.34 0.04 0.00 0.00 177.00 178.55 2kui s ASP 431 N -1.04 6.77 0.03 6.66 -1.08 -1.26 -4.87 116.67 121.89 2kui s ASP 431 Ca 0.53 1.08 0.03 0.00 -0.52 0.00 0.00 52.55 53.67 2kui s ASP 431 Cb -0.31 -2.54 -0.04 0.00 -1.46 0.00 0.00 42.92 38.57 2kui s ASP 431 CO 0.40 -1.01 -0.04 -0.69 0.52 0.00 0.00 175.17 174.34 2kui s VAL 432 N 4.09 3.83 0.64 1.11 1.01 -1.26 -5.10 120.40 124.72 2kui s VAL 432 Ca 0.51 -0.83 -0.16 0.00 0.00 0.00 0.00 61.98 61.50 2kui s VAL 432 Cb -0.14 -2.73 -0.01 0.00 0.00 0.00 0.00 36.38 33.51 2kui s VAL 432 CO 0.21 0.30 1.15 -0.94 0.00 0.00 0.00 175.10 175.82 2kui s SER 433 N -1.73 5.03 0.38 3.32 1.04 -1.26 -4.94 113.70 115.53 2kui s SER 433 Ca 0.20 2.18 0.10 0.00 0.48 0.00 0.00 55.95 58.91 2kui s SER 433 Cb -0.11 -2.57 0.75 0.00 0.10 0.00 0.00 66.02 64.18 2kui s SER 433 CO 0.11 -1.69 1.88 0.71 0.98 0.00 0.00 173.24 175.23 2kui h THR 434 N 0.32 1.20 0.00 2.02 1.35 -1.99 -1.41 112.91 114.39 2kui h THR 434 Ca -0.48 -0.91 0.00 0.00 -0.55 0.00 0.00 66.41 64.47 2kui h THR 434 Cb 1.27 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 69.01 2kui h THR 434 CO 0.54 0.28 -0.12 0.00 -0.25 0.00 0.00 175.52 175.97 2kui n LEU 435 N -4.23 0.24 -2.54 3.87 -0.00 -1.26 -0.26 117.00 112.82 2kui n LEU 435 Ca -0.01 0.41 -0.35 0.00 -0.00 0.00 0.00 56.01 56.06 2kui n LEU 435 Cb 0.31 -0.41 0.05 0.00 -0.00 0.00 0.00 43.42 43.36 2kui n LEU 435 CO 0.38 -0.01 1.24 0.41 -0.00 0.00 0.00 177.39 179.42 2kui n THR 436 N -1.64 3.39 -0.31 1.47 -1.04 -0.53 -4.72 114.28 110.89 2kui n THR 436 Ca 0.06 -3.79 0.14 0.00 -2.04 0.00 0.00 64.05 58.42 2kui n THR 436 Cb 0.36 -1.20 0.37 0.00 -1.82 0.00 0.00 70.33 68.04 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 2.46 0.91 -0.73 -1.42 3.20 -1.69 -0.84 116.97 118.85 2kui h TYR 437 Ca 0.54 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.44 2kui h TYR 437 Cb 0.59 -0.28 -0.04 0.00 1.54 0.00 0.00 36.73 38.54 2kui h TYR 437 CO 1.22 0.26 0.49 0.00 -1.64 0.00 0.00 178.16 178.48 2kui h ALA 438 N 1.61 0.93 -0.18 1.82 0.00 -1.94 -1.27 119.26 120.23 2kui h ALA 438 Ca 0.52 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.23 2kui h ALA 438 Cb 0.88 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2kui h ALA 438 CO -0.28 0.35 -0.52 1.49 0.00 0.00 0.00 179.25 180.29 2kui h GLU 439 N 1.00 0.51 -0.06 0.00 4.81 -1.62 -2.81 114.58 116.40 2kui h GLU 439 Ca 0.27 -0.31 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2kui h GLU 439 Cb -0.11 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.30 2kui h GLU 439 CO -0.06 0.91 0.04 0.00 -0.73 0.00 0.00 179.01 179.17 2kui h ALA 440 N 1.03 0.08 -0.60 2.92 0.00 -0.40 0.12 119.26 122.42 2kui h ALA 440 Ca 0.01 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2kui h ALA 440 Cb 1.05 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2kui h ALA 440 CO 0.10 -0.42 0.00 -0.39 0.00 0.00 0.00 179.25 178.53 2kui h VAL 441 N 0.07 1.26 -0.22 0.00 -1.51 -1.28 -1.36 116.25 113.22 2kui h VAL 441 Ca 0.02 -1.14 -0.11 0.00 -1.23 0.00 0.00 66.70 64.24 2kui h VAL 441 Cb 0.00 0.80 -0.01 0.00 -2.13 0.00 0.00 31.29 29.95 2kui h VAL 441 CO -0.00 0.41 -0.33 0.07 -1.23 0.00 0.00 177.57 176.49 2kui h LYS 442 N 0.95 0.47 -0.66 5.19 5.09 -1.22 -2.17 116.57 124.22 2kui h LYS 442 Ca 0.17 -0.20 -0.06 0.00 0.09 0.00 0.00 60.65 60.65 2kui h LYS 442 Cb 0.55 -0.01 -0.03 0.00 0.10 0.00 0.00 32.23 32.84 2kui h LYS 442 CO 0.03 0.74 0.18 0.87 -2.09 0.00 0.00 179.45 179.18 2kui h LYS 443 N 0.40 1.04 -0.76 0.07 1.79 -0.42 -0.02 116.57 118.66 2kui h LYS 443 Ca 0.05 -0.23 -0.05 0.00 -2.18 0.00 0.00 60.65 58.24 2kui h LYS 443 Cb 0.77 -0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 31.24 2kui h LYS 443 CO 0.06 0.91 0.28 -0.07 -1.08 0.00 0.00 179.45 179.55 2kui h LEU 444 N 0.99 1.07 -0.36 2.94 3.38 -1.02 -1.24 115.31 121.08 2kui h LEU 444 Ca 0.21 -0.18 -0.18 0.00 0.09 0.00 0.00 57.88 57.83 2kui h LEU 444 Cb 0.32 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2kui h LEU 444 CO -0.00 0.97 -0.51 0.74 0.09 0.00 0.00 178.44 179.72 2kui h THR 445 N 1.12 1.28 0.00 0.22 2.02 -0.95 -0.69 112.91 115.92 2kui h THR 445 Ca 0.25 -1.70 -0.01 0.00 0.77 0.00 0.00 66.41 65.73 2kui h THR 445 Cb 0.25 1.59 -0.00 0.00 -1.74 0.00 0.00 68.15 68.24 2kui h THR 445 CO -0.02 0.55 -0.04 0.00 0.37 0.00 0.00 175.52 176.38 2kui h ALA 446 N 0.76 1.02 -0.12 6.16 0.00 -0.72 -2.03 119.26 124.34 2kui h ALA 446 Ca 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2kui h ALA 446 Cb 1.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2kui h ALA 446 CO 0.11 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.42 2kui n ALA 447 N -2.12 2.54 0.00 0.00 0.00 -0.49 -4.97 120.51 115.46 2kui n ALA 447 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.08 2kui n ALA 447 Cb 0.30 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.61 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 0.96 1.75 0.25 0.00 0.00 -0.76 -4.65 105.19 102.74 2kui n GLY 448 Ca 0.14 -0.70 -0.06 0.00 0.00 0.00 0.00 46.02 45.39 2kui n GLY 448 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2kui n PHE 449 N 0.00 -0.26 -2.08 1.61 1.16 -1.25 -4.82 117.46 111.82 2kui n PHE 449 Ca 0.00 0.73 -0.19 0.00 -1.87 0.00 0.00 57.45 56.12 2kui n PHE 449 Cb 0.00 -0.52 -0.04 0.00 -1.61 0.00 0.00 39.48 37.31 2kui n PHE 449 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2kui n GLY 450 N -1.15 0.39 3.37 4.97 0.00 -0.29 -4.90 105.19 107.59 2kui n GLY 450 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 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 -4.51 2.85 0.03 1.61 1.81 -1.26 -4.71 118.95 114.77 2kui s ARG 451 Ca 0.00 -1.06 -0.01 0.00 -1.72 0.00 0.00 55.73 52.94 2kui s ARG 451 Cb 0.00 -3.67 -0.02 0.00 -0.45 0.00 0.00 34.95 30.81 2kui s ARG 451 CO 0.00 -0.66 -0.01 -0.59 -0.68 0.00 0.00 175.30 173.36 2kui s PHE 452 N 1.53 0.29 -0.05 -0.53 -0.12 -1.26 -0.66 117.98 117.19 2kui s PHE 452 Ca 0.02 -0.61 -0.01 0.00 -0.05 0.00 0.00 56.93 56.28 2kui s PHE 452 Cb -0.19 -0.22 0.03 0.00 -0.63 0.00 0.00 43.02 42.01 2kui s PHE 452 CO 0.06 -0.25 0.02 0.15 -0.05 0.00 0.00 175.22 175.15 2kui s LYS 453 N -2.06 0.24 -0.13 1.99 -0.14 -0.26 -4.90 119.74 114.48 2kui s LYS 453 Ca -0.10 0.21 -0.23 0.00 -1.36 0.00 0.00 55.97 54.49 2kui s LYS 453 Cb -0.05 -0.64 -0.03 0.00 -1.68 0.00 0.00 37.83 35.43 2kui s LYS 453 CO -0.03 -0.26 0.69 -1.14 -0.76 0.00 0.00 175.35 173.85 2kui s GLN 454 N 1.76 4.33 0.06 1.68 0.74 -1.26 0.52 119.66 127.49 2kui s GLN 454 Ca 0.00 0.80 0.08 0.00 0.05 0.00 0.00 55.36 56.29 2kui s GLN 454 Cb -0.13 -3.51 -0.03 0.00 1.10 0.00 0.00 33.01 30.44 2kui s GLN 454 CO -0.03 -0.11 -0.20 0.00 -0.55 0.00 0.00 175.29 174.40 2kui s ALA 455 N 1.42 2.54 -0.02 1.58 0.00 0.12 -4.93 121.76 122.48 2kui s ALA 455 Ca 0.34 -1.25 0.08 0.00 0.00 0.00 0.00 51.96 51.13 2kui s ALA 455 Cb -0.17 -0.66 -0.02 0.00 0.00 0.00 0.00 23.12 22.28 2kui s ALA 455 CO 0.14 0.57 -0.26 -0.80 0.00 0.00 0.00 175.76 175.41 2kui s ASN 456 N -1.56 3.05 -0.12 0.00 0.01 -1.26 -0.17 114.94 114.89 2kui s ASN 456 Ca 0.15 -0.48 -0.07 0.00 -0.71 0.00 0.00 52.86 51.75 2kui s ASN 456 Cb -0.10 -0.34 0.04 0.00 0.41 0.00 0.00 41.25 41.26 2kui s ASN 456 CO 0.05 0.32 0.28 -0.44 -1.51 0.00 0.00 177.10 175.80 2kui s SER 457 N -0.64 -0.31 0.03 -1.22 0.01 -0.91 -4.94 113.70 105.71 2kui s SER 457 Ca 0.10 0.60 -0.30 0.00 1.31 0.00 0.00 55.95 57.65 2kui s SER 457 Cb -0.10 0.51 -0.08 0.00 0.21 0.00 0.00 66.02 66.57 2kui s SER 457 CO -0.01 -0.15 1.70 -2.84 0.41 0.00 0.00 173.24 172.35 2kui s PRO 458 N 1.00 4.18 0.28 12.44 0.02 -1.25 -0.66 135.00 151.01 2kui s PRO 458 Ca -0.07 2.33 -0.00 0.00 0.02 0.00 0.00 61.00 63.28 2kui s PRO 458 Cb -0.08 -3.80 -0.02 0.00 0.02 0.00 0.00 34.50 30.62 2kui s PRO 458 CO -0.07 -0.80 0.30 -1.12 -0.33 0.00 0.00 177.00 174.98 2kui s SER 459 N 3.00 0.79 0.26 2.53 0.01 0.92 -4.85 113.70 116.36 2kui s SER 459 Ca 0.76 -1.48 -0.29 0.00 1.31 0.00 0.00 55.95 56.26 2kui s SER 459 Cb -0.38 0.53 -0.15 0.00 0.21 0.00 0.00 66.02 66.23 2kui s SER 459 CO 0.33 -1.06 0.92 1.07 0.41 0.00 0.00 173.24 174.91 2kui n THR 460 N -0.47 1.87 -0.14 1.44 5.66 -1.26 -4.52 114.28 116.87 2kui n THR 460 Ca 0.03 -0.47 0.27 0.00 -3.05 0.00 0.00 64.05 60.84 2kui n THR 460 Cb 0.63 -0.76 0.72 0.00 -1.55 0.00 0.00 70.33 69.37 2kui n THR 460 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2kui h PRO 461 N 1.92 0.00 0.00 1.09 0.13 -1.96 0.53 132.00 133.71 2kui h PRO 461 Ca -0.37 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.73 2kui h PRO 461 Cb 1.36 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.49 2kui h PRO 461 CO 0.61 0.00 -0.13 1.05 -0.23 0.00 0.00 178.00 179.29 2kui h GLU 462 N 0.00 0.00 -0.00 0.86 4.11 -2.00 -2.70 114.58 114.84 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 1.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.89 2kui h GLU 462 CO -0.00 0.13 -0.70 1.28 0.07 0.00 0.00 179.01 179.79 2kui n LEU 463 N -3.35 0.98 -4.70 3.06 7.99 0.14 -4.89 117.00 116.24 2kui n LEU 463 Ca -0.00 -0.55 -0.42 0.00 -0.01 0.00 0.00 56.01 55.02 2kui n LEU 463 Cb 0.34 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.62 2kui n LEU 463 CO 0.30 0.22 1.41 -0.69 -1.51 0.00 0.00 177.39 177.13 2kui s VAL 464 N -2.47 2.38 0.00 4.08 1.01 -1.00 -1.23 120.40 123.17 2kui s VAL 464 Ca 0.08 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.15 2kui s VAL 464 Cb 0.13 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.45 2kui s VAL 464 CO 0.64 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.35 2kui n GLY 465 N 4.10 2.50 3.83 4.51 0.00 0.42 -4.92 105.19 115.62 2kui n GLY 465 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.60 2.61 0.33 1.61 3.01 -0.36 -4.88 119.74 121.44 2kui s LYS 466 Ca 0.00 -1.40 -0.27 0.00 -1.01 0.00 0.00 55.97 53.29 2kui s LYS 466 Cb 0.00 -2.38 -0.09 0.00 -1.01 0.00 0.00 37.83 34.34 2kui s LYS 466 CO 0.00 0.04 1.02 0.08 0.51 0.00 0.00 175.35 177.01 2kui s VAL 467 N -2.37 3.81 -0.18 3.17 1.01 0.64 -1.15 120.40 125.34 2kui s VAL 467 Ca 0.41 1.59 0.16 0.00 0.00 0.00 0.00 61.98 64.14 2kui s VAL 467 Cb -0.04 -3.92 -0.24 0.00 0.00 0.00 0.00 36.38 32.17 2kui s VAL 467 CO 0.26 0.21 0.15 -0.38 0.00 0.00 0.00 175.10 175.34 2kui n ILE 468 N 0.65 1.44 0.00 2.22 5.41 0.97 -4.76 119.36 125.29 2kui n ILE 468 Ca 0.02 -0.82 0.00 0.00 1.00 0.00 0.00 62.75 62.94 2kui n ILE 468 Cb 0.48 -0.65 0.00 0.00 -0.71 0.00 0.00 39.64 38.76 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 1.76 -0.82 3.44 7.39 0.00 -1.18 -5.04 105.19 110.74 2kui n GLY 469 Ca -0.31 -1.20 -0.32 0.00 0.00 0.00 0.00 46.02 44.19 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 -2.00 2.81 0.05 2.61 -4.23 -1.26 -1.49 115.64 112.13 2kui s THR 470 Ca 0.00 -0.86 -0.24 0.00 -1.18 0.00 0.00 61.69 59.40 2kui s THR 470 Cb 0.00 -2.09 -0.17 0.00 1.34 0.00 0.00 72.50 71.58 2kui s THR 470 CO 0.00 0.56 1.55 -1.13 -0.54 0.00 0.00 174.62 175.06 2kui h ASN 471 N 5.27 -0.03 -3.54 3.99 -1.24 -1.21 -3.42 115.58 115.39 2kui h ASN 471 Ca -0.46 -0.18 -0.51 0.00 0.71 0.00 0.00 56.30 55.87 2kui h ASN 471 Cb 1.15 0.01 -0.01 0.00 0.73 0.00 0.00 38.32 40.19 2kui h ASN 471 CO 0.49 0.16 0.01 -2.16 -1.29 0.00 0.00 177.43 174.64 2kui s PRO 472 N -5.45 3.80 0.11 6.67 0.05 -1.26 -5.03 135.00 133.89 2kui s PRO 472 Ca -0.14 0.37 -0.31 0.00 0.05 0.00 0.00 61.00 60.97 2kui s PRO 472 Cb 0.04 -2.50 -0.09 0.00 0.05 0.00 0.00 34.50 32.00 2kui s PRO 472 CO 0.66 0.13 1.66 -1.25 0.05 0.00 0.00 177.00 178.24 2kui s PRO 473 N -3.41 4.19 -0.07 0.56 0.04 -1.26 -4.87 135.00 130.18 2kui s PRO 473 Ca 0.49 2.39 0.13 0.00 0.04 0.00 0.00 61.00 64.06 2kui s PRO 473 Cb -0.11 -3.44 0.51 0.00 0.04 0.00 0.00 34.50 31.50 2kui s PRO 473 CO 0.26 -0.71 1.38 0.00 0.04 0.00 0.00 177.00 177.97 2kui n ALA 474 N 5.06 2.88 0.50 8.56 0.00 -1.26 -3.32 120.51 132.92 2kui n ALA 474 Ca 0.16 -1.10 0.06 0.00 0.00 0.00 0.00 53.44 52.56 2kui n ALA 474 Cb 0.39 -1.02 0.03 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 0.76 1.70 -4.87 0.00 4.13 -1.26 -4.13 115.26 111.60 2kui n ASN 475 Ca 0.18 -1.35 -0.24 0.00 1.68 0.00 0.00 54.58 54.85 2kui n ASN 475 Cb 0.65 0.20 -0.02 0.00 -1.54 0.00 0.00 39.78 39.06 2kui n ASN 475 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2kui s GLN 476 N -1.20 2.32 -0.37 3.52 -1.52 -1.21 -4.64 119.66 116.57 2kui s GLN 476 Ca 0.12 -1.86 -0.24 0.00 -1.95 0.00 0.00 55.36 51.43 2kui s GLN 476 Cb 0.10 -2.15 0.01 0.00 -0.22 0.00 0.00 33.01 30.74 2kui s GLN 476 CO 0.21 -0.41 0.83 0.99 -0.25 0.00 0.00 175.29 176.65 2kui s THR 477 N -2.66 4.68 0.06 -0.19 2.01 -1.26 -1.47 115.64 116.82 2kui s THR 477 Ca 0.39 0.98 0.04 0.00 0.31 0.00 0.00 61.69 63.41 2kui s THR 477 Cb -0.01 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.21 2kui s THR 477 CO 0.23 -0.47 -0.02 -0.44 -0.69 0.00 0.00 174.62 173.23 2kui s SER 478 N 1.86 4.91 0.73 3.53 0.01 0.11 -4.75 113.70 120.10 2kui s SER 478 Ca 0.33 -0.16 -0.12 0.00 1.31 0.00 0.00 55.95 57.31 2kui s SER 478 Cb -0.13 -1.16 0.04 0.00 0.21 0.00 0.00 66.02 64.98 2kui s SER 478 CO 0.18 0.21 1.11 0.00 0.41 0.00 0.00 173.24 175.14 2kui s ALA 479 N -1.21 2.29 -0.24 1.44 0.00 -1.26 -0.13 121.76 122.66 2kui s ALA 479 Ca 0.23 0.42 0.28 0.00 0.00 0.00 0.00 51.96 52.89 2kui s ALA 479 Cb -0.11 -3.31 1.06 0.00 0.00 0.00 0.00 23.12 20.76 2kui s ALA 479 CO 0.15 -1.63 1.83 0.82 0.00 0.00 0.00 175.76 176.93 2kui h ILE 480 N -0.67 0.00 -0.41 0.00 1.08 -1.93 -1.35 117.51 114.23 2kui h ILE 480 Ca -0.45 -0.48 0.00 0.00 -0.39 0.00 0.00 64.86 63.54 2kui h ILE 480 Cb 1.24 1.39 0.00 0.00 -3.07 0.00 0.00 36.82 36.38 2kui h ILE 480 CO 0.52 0.00 0.00 0.35 -0.69 0.00 0.00 178.15 178.33 2kui n THR 481 N -2.73 0.53 -2.94 -0.27 -2.24 -1.26 -3.93 114.28 101.44 2kui n THR 481 Ca 0.02 -0.76 -0.40 0.00 -2.27 0.00 0.00 64.05 60.64 2kui n THR 481 Cb 0.32 0.92 -0.04 0.00 -2.10 0.00 0.00 70.33 69.43 2kui n THR 481 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2kui s ASN 482 N -1.45 7.10 -0.26 3.42 3.84 -0.51 -5.03 114.94 122.04 2kui s ASN 482 Ca 0.40 1.33 -0.09 0.00 0.21 0.00 0.00 52.86 54.70 2kui s ASN 482 Cb 0.23 -2.46 -0.04 0.00 -0.55 0.00 0.00 41.25 38.43 2kui s ASN 482 CO 0.32 -0.16 0.14 -0.69 -2.79 0.00 0.00 177.10 173.92 2kui s VAL 483 N 0.87 4.92 -0.27 -5.21 1.01 -1.26 -4.42 120.40 116.03 2kui s VAL 483 Ca 0.42 0.04 -0.11 0.00 0.00 0.00 0.00 61.98 62.33 2kui s VAL 483 Cb -0.19 -3.32 -0.05 0.00 0.00 0.00 0.00 36.38 32.82 2kui s VAL 483 CO 0.21 0.30 0.17 0.68 0.00 0.00 0.00 175.10 176.46 2kui s VAL 484 N 1.62 5.21 -0.17 2.92 -7.23 0.16 -4.95 120.40 117.97 2kui s VAL 484 Ca 0.07 0.13 -0.15 0.00 -1.81 0.00 0.00 61.98 60.23 2kui s VAL 484 Cb -0.15 -3.47 -0.04 0.00 0.56 0.00 0.00 36.38 33.27 2kui s VAL 484 CO 0.08 0.28 0.33 -0.51 -0.31 0.00 0.00 175.10 174.96 2kui s ILE 485 N 1.62 5.28 -0.11 -0.62 -1.16 -1.26 -1.10 121.20 123.84 2kui s ILE 485 Ca 0.07 0.61 0.03 0.00 -0.51 0.00 0.00 60.65 60.85 2kui s ILE 485 Cb -0.15 -3.67 0.00 0.00 0.61 0.00 0.00 42.46 39.25 2kui s ILE 485 CO 0.09 0.35 -0.23 -0.63 -2.81 0.00 0.00 174.94 171.72 2kui s ILE 486 N 0.67 2.02 -0.22 2.00 1.01 0.19 -0.54 121.20 126.32 2kui s ILE 486 Ca 0.18 -0.98 -0.10 0.00 0.00 0.00 0.00 60.65 59.75 2kui s ILE 486 Cb -0.14 -1.76 -0.05 0.00 0.01 0.00 0.00 42.46 40.52 2kui s ILE 486 CO 0.05 0.55 0.13 -0.51 0.00 0.00 0.00 174.94 175.16 2kui s ILE 487 N 0.53 5.24 0.14 2.92 2.07 -0.56 0.14 121.20 131.69 2kui s ILE 487 Ca -0.14 0.13 0.08 0.00 -1.41 0.00 0.00 60.65 59.31 2kui s ILE 487 Cb -0.17 -3.42 -0.04 0.00 0.13 0.00 0.00 42.46 38.96 2kui s ILE 487 CO 0.05 0.39 -0.08 0.68 -1.91 0.00 0.00 174.94 174.07 2kui s VAL 488 N 0.75 3.37 0.01 4.00 -7.23 0.76 -0.02 120.40 122.03 2kui s VAL 488 Ca 0.07 -1.42 -0.29 0.00 -1.81 0.00 0.00 61.98 58.53 2kui s VAL 488 Cb -0.13 -2.62 -0.04 0.00 0.56 0.00 0.00 36.38 34.15 2kui s VAL 488 CO 0.02 0.00 0.92 -0.83 -0.31 0.00 0.00 175.10 174.90 2kui s GLY 489 N -2.53 2.87 0.27 2.32 0.00 -0.30 -2.14 107.32 107.81 2kui s GLY 489 Ca 0.23 0.47 0.10 0.00 0.00 0.00 0.00 44.72 45.53 2kui s GLY 489 CO 0.15 1.55 -0.05 -0.45 0.00 0.00 0.00 173.10 174.29 2kui s SER 490 N 0.77 4.30 -0.32 1.64 0.15 0.17 -0.43 113.70 119.98 2kui s SER 490 Ca 0.48 -0.75 -0.08 0.00 0.70 0.00 0.00 55.95 56.31 2kui s SER 490 Cb -0.21 -0.70 0.19 0.00 -1.71 0.00 0.00 66.02 63.58 2kui s SER 490 CO 0.27 0.01 0.98 -0.83 1.20 0.00 0.00 173.24 174.86 2kui s GLY 491 N -3.63 -1.22 0.09 9.45 0.00 -1.26 -0.06 107.32 110.69 2kui s GLY 491 Ca 0.31 1.56 -0.29 0.00 0.00 0.00 0.00 44.72 46.29 2kui s GLY 491 CO 0.19 4.11 0.94 -4.14 0.00 0.00 0.00 173.10 174.20 2kui s PRO 492 N 2.48 4.66 -0.15 2.90 0.02 -1.26 -4.96 135.00 138.70 2kui s PRO 492 Ca 0.20 1.40 0.17 0.00 0.02 0.00 0.00 61.00 62.80 2kui s PRO 492 Cb -0.01 -3.38 0.44 0.00 0.02 0.00 0.00 34.50 31.57 2kui s PRO 492 CO -0.19 0.20 1.19 0.00 -0.33 0.00 0.00 177.00 177.87 2kui n ALA 493 N 2.87 3.26 -2.38 -1.55 0.00 -1.26 -5.03 120.51 116.42 2kui n ALA 493 Ca 0.02 -2.97 -0.31 0.00 0.00 0.00 0.00 53.44 50.18 2kui n ALA 493 Cb 0.49 -0.54 -0.14 0.00 0.00 0.00 0.00 19.45 19.26 2kui n ALA 493 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2kui s THR 494 N -2.33 2.41 0.10 0.00 -4.23 -1.26 -1.36 115.64 108.98 2kui s THR 494 Ca 0.37 -1.12 -0.01 0.00 -1.18 0.00 0.00 61.69 59.75 2kui s THR 494 Cb 0.38 -1.92 -0.04 0.00 1.34 0.00 0.00 72.50 72.25 2kui s THR 494 CO -0.09 0.48 0.02 -0.54 -0.54 0.00 0.00 174.62 173.95 2kui s LYS 495 N -0.96 0.82 0.11 3.99 -0.14 0.95 -4.89 119.74 119.61 2kui s LYS 495 Ca 0.12 -1.36 -0.24 0.00 -1.36 0.00 0.00 55.97 53.13 2kui s LYS 495 Cb -0.10 0.20 -0.07 0.00 -1.68 0.00 0.00 37.83 36.17 2kui s LYS 495 CO 0.01 -0.19 0.71 0.16 -0.76 0.00 0.00 175.35 175.28 2kui s ASP 496 N -3.01 7.26 -0.02 2.83 -4.77 -1.26 -0.24 116.67 117.46 2kui s ASP 496 Ca 0.18 1.49 -0.21 0.00 -3.30 0.00 0.00 52.55 50.70 2kui s ASP 496 Cb 0.08 -2.45 -0.05 0.00 -1.09 0.00 0.00 42.92 39.40 2kui s ASP 496 CO -0.03 0.19 0.63 0.27 0.70 0.00 0.00 175.17 176.93 2kui s ILE 497 N -0.90 4.93 0.77 2.11 -4.36 0.01 -4.94 121.20 118.81 2kui s ILE 497 Ca 0.34 1.31 -0.06 0.00 -0.26 0.00 0.00 60.65 61.98 2kui s ILE 497 Cb -0.22 -3.97 0.12 0.00 1.25 0.00 0.00 42.46 39.65 2kui s ILE 497 CO 0.23 0.38 1.07 -2.16 0.24 0.00 0.00 174.94 174.70 2kui s PRO 498 N 0.05 1.60 0.33 0.37 0.04 -1.26 -0.32 135.00 135.81 2kui s PRO 498 Ca 0.33 -0.67 -0.03 0.00 0.04 0.00 0.00 61.00 60.67 2kui s PRO 498 Cb -0.18 -2.17 -0.04 0.00 0.04 0.00 0.00 34.50 32.15 2kui s PRO 498 CO 0.18 -1.60 0.57 0.16 0.04 0.00 0.00 177.00 176.35 2kui s ASP 499 N -4.70 6.37 0.00 6.66 -4.77 -1.26 -4.67 116.67 114.30 2kui s ASP 499 Ca 0.66 0.63 0.00 0.00 -3.30 0.00 0.00 52.55 50.54 2kui s ASP 499 Cb -0.07 -2.11 0.00 0.00 -1.09 0.00 0.00 42.92 39.65 2kui s ASP 499 CO 0.46 -0.27 0.12 0.55 0.70 0.00 0.00 175.17 176.74 2kui n VAL 500 N -1.39 0.00 -2.28 2.11 3.14 -1.26 -5.07 118.33 113.57 2kui n VAL 500 Ca -0.03 0.00 -0.37 0.00 -2.96 0.00 0.00 64.34 60.99 2kui n VAL 500 Cb 0.55 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 33.29 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 0.00 2.30 0.00 1.55 0.00 -1.26 -2.61 121.76 121.74 2kui s ALA 501 Ca 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 50.54 2kui s ALA 501 Cb 0.00 -4.41 0.00 0.00 0.00 0.00 0.00 23.12 18.71 2kui s ALA 501 CO 0.00 -3.93 0.00 0.41 0.00 0.00 0.00 175.76 172.24 2kui n GLY 502 N 6.20 0.15 3.15 0.00 0.00 -0.81 -4.92 105.19 108.96 2kui n GLY 502 Ca 0.24 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.10 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 0.00 0.71 -2.31 1.61 3.00 -1.07 -4.81 117.38 114.50 2kui n GLN 503 Ca 0.00 -2.59 -0.30 0.00 -0.01 0.00 0.00 57.00 54.11 2kui n GLN 503 Cb 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 30.24 30.15 2kui n GLN 503 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 2kui s THR 504 N -1.98 4.78 0.28 5.09 -4.23 -1.26 -0.37 115.64 117.94 2kui s THR 504 Ca 0.44 0.63 0.01 0.00 -1.18 0.00 0.00 61.69 61.59 2kui s THR 504 Cb -0.04 -3.84 0.27 0.00 1.34 0.00 0.00 72.50 70.23 2kui s THR 504 CO 0.28 -0.93 1.79 1.62 -0.54 0.00 0.00 174.62 176.85 2kui h VAL 505 N 0.15 0.80 -0.83 2.29 3.04 -1.19 -1.02 116.25 119.48 2kui h VAL 505 Ca -0.46 -0.27 0.05 0.00 -1.01 0.00 0.00 66.70 65.02 2kui h VAL 505 Cb 1.19 -0.06 -0.06 0.00 -2.01 0.00 0.00 31.29 30.36 2kui h VAL 505 CO 0.62 0.14 0.52 0.44 -1.01 0.00 0.00 177.57 178.28 2kui h ASP 506 N 0.79 0.82 -0.30 3.17 5.19 -1.93 0.52 116.42 124.68 2kui h ASP 506 Ca 0.50 0.01 -0.14 0.00 -0.62 0.00 0.00 57.03 56.78 2kui h ASP 506 Cb 0.64 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.97 2kui h ASP 506 CO -0.33 0.54 -0.31 0.58 -3.12 0.00 0.00 179.24 176.60 2kui h VAL 507 N 0.96 1.28 -0.49 -1.35 2.07 -1.60 -2.41 116.25 114.71 2kui h VAL 507 Ca 0.35 -1.47 -0.02 0.00 0.82 0.00 0.00 66.70 66.38 2kui h VAL 507 Cb 0.12 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 2kui h VAL 507 CO -0.16 0.49 0.21 0.00 0.02 0.00 0.00 177.57 178.13 2kui h ALA 508 N 0.95 0.63 -0.96 1.67 0.00 -0.32 -0.19 119.26 121.04 2kui h ALA 508 Ca 0.07 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2kui h ALA 508 Cb 0.86 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 2kui h ALA 508 CO 0.08 0.22 0.62 1.96 0.00 0.00 0.00 179.25 182.13 2kui h GLN 509 N 0.64 1.27 0.04 0.00 4.20 -0.76 0.34 115.11 120.85 2kui h GLN 509 Ca 0.16 -0.08 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 2kui h GLN 509 Cb 0.17 -0.28 0.00 0.00 0.30 0.00 0.00 27.48 27.67 2kui h GLN 509 CO -0.02 0.85 -0.02 0.87 -0.67 0.00 0.00 178.83 179.84 2kui h LYS 510 N 1.30 -0.06 -0.81 1.46 6.56 -1.04 -2.02 116.57 121.96 2kui h LYS 510 Ca 0.35 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.92 2kui h LYS 510 Cb -0.13 0.01 -0.04 0.00 -0.57 0.00 0.00 32.23 31.50 2kui h LYS 510 CO -0.07 0.24 0.42 -0.91 -2.06 0.00 0.00 179.45 177.07 2kui h ASN 511 N -0.35 1.03 -0.44 0.86 2.35 -0.65 -0.41 115.58 117.97 2kui h ASN 511 Ca -0.01 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.61 2kui h ASN 511 Cb 0.32 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 2kui h ASN 511 CO 0.01 0.85 0.20 -0.07 -1.65 0.00 0.00 177.43 176.77 2kui h LEU 512 N 1.13 0.59 -0.84 1.61 3.38 -0.97 -2.79 115.31 117.42 2kui h LEU 512 Ca 0.28 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2kui h LEU 512 Cb 0.06 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2kui h LEU 512 CO -0.04 0.57 0.53 -1.13 0.09 0.00 0.00 178.44 178.45 2kui h ASN 513 N 0.57 0.99 -0.73 -0.43 -0.00 -0.64 -0.80 115.58 114.53 2kui h ASN 513 Ca 0.15 -0.05 0.06 0.00 -0.00 0.00 0.00 56.30 56.46 2kui h ASN 513 Cb 0.15 -0.25 -0.04 0.00 -0.00 0.00 0.00 38.32 38.18 2kui h ASN 513 CO -0.02 0.74 0.48 0.58 -0.00 0.00 0.00 177.43 179.21 2kui h VAL 514 N 1.14 1.04 -0.02 2.57 2.07 -0.86 -1.04 116.25 121.15 2kui h VAL 514 Ca 0.30 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.55 2kui h VAL 514 Cb -0.09 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 29.87 2kui h VAL 514 CO -0.06 0.14 0.00 -1.22 0.02 0.00 0.00 177.57 176.45 2kui n TYR 515 N -4.47 0.01 -0.05 1.57 4.01 -0.73 -4.88 117.16 112.62 2kui n TYR 515 Ca 0.10 -0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.84 2kui n TYR 515 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.23 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 1.12 0.97 3.44 2.72 0.00 -0.39 -5.03 105.19 108.02 2kui n GLY 516 Ca 0.20 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2kui n GLY 516 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kui s PHE 517 N -2.00 3.24 -0.58 1.61 0.08 -0.38 -4.66 117.98 115.29 2kui s PHE 517 Ca 0.00 -0.67 0.22 0.00 0.12 0.00 0.00 56.93 56.61 2kui s PHE 517 Cb 0.00 -2.55 -0.08 0.00 -0.57 0.00 0.00 43.02 39.82 2kui s PHE 517 CO 0.00 -0.60 0.90 2.41 -0.10 0.00 0.00 175.22 177.83 2kui n THR 518 N 5.12 0.11 -3.76 0.64 -1.04 -1.25 -3.12 114.28 110.98 2kui n THR 518 Ca -0.11 -0.24 -0.37 0.00 -2.04 0.00 0.00 64.05 61.28 2kui n THR 518 Cb 0.47 0.33 -0.13 0.00 -1.82 0.00 0.00 70.33 69.18 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 -3.22 3.17 0.08 -2.82 1.02 -1.26 -5.04 119.74 111.67 2kui s LYS 519 Ca 0.02 -0.81 0.05 0.00 0.02 0.00 0.00 55.97 55.26 2kui s LYS 519 Cb 0.15 -3.37 -0.03 0.00 -0.52 0.00 0.00 37.83 34.06 2kui s LYS 519 CO 0.84 -0.41 -0.14 -0.59 -0.92 0.00 0.00 175.35 174.12 2kui s PHE 520 N 1.52 1.28 -0.00 3.18 -0.12 -1.26 -0.78 117.98 121.79 2kui s PHE 520 Ca 0.03 -0.48 0.01 0.00 -0.05 0.00 0.00 56.93 56.45 2kui s PHE 520 Cb -0.17 -0.71 -0.00 0.00 -0.63 0.00 0.00 43.02 41.51 2kui s PHE 520 CO 0.03 0.08 -0.05 -1.12 -0.05 0.00 0.00 175.22 174.11 2kui s SER 521 N -1.89 0.56 -0.12 1.98 0.01 0.41 -4.88 113.70 109.76 2kui s SER 521 Ca 0.01 -0.11 0.02 0.00 1.31 0.00 0.00 55.95 57.18 2kui s SER 521 Cb -0.09 -0.06 0.01 0.00 0.21 0.00 0.00 66.02 66.10 2kui s SER 521 CO 0.02 0.04 -0.18 0.00 0.41 0.00 0.00 173.24 173.53 2kui s GLN 522 N -0.19 2.56 -0.23 12.44 -2.07 -1.26 0.05 119.66 130.96 2kui s GLN 522 Ca 0.01 -0.69 -0.01 0.00 -1.82 0.00 0.00 55.36 52.86 2kui s GLN 522 Cb -0.02 -2.12 0.02 0.00 -1.09 0.00 0.00 33.01 29.80 2kui s GLN 522 CO -0.00 -0.04 -0.10 0.00 -1.32 0.00 0.00 175.29 173.83 2kui s ALA 523 N 0.91 2.62 -0.12 2.60 0.00 0.32 -4.96 121.76 123.14 2kui s ALA 523 Ca -0.07 -1.39 -0.18 0.00 0.00 0.00 0.00 51.96 50.32 2kui s ALA 523 Cb -0.15 -1.56 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 2kui s ALA 523 CO -0.02 -0.69 0.48 -1.54 0.00 0.00 0.00 175.76 173.99 2kui s SER 524 N 1.32 6.69 0.24 0.00 1.04 -1.26 -0.23 113.70 121.50 2kui s SER 524 Ca 0.01 0.82 0.11 0.00 0.48 0.00 0.00 55.95 57.37 2kui s SER 524 Cb -0.16 -2.29 -0.05 0.00 0.10 0.00 0.00 66.02 63.63 2kui s SER 524 CO -0.06 0.00 -0.19 0.68 0.98 0.00 0.00 173.24 174.65 2kui s VAL 525 N 0.60 2.24 0.24 5.02 -7.23 0.57 -4.91 120.40 116.92 2kui s VAL 525 Ca 0.26 -2.25 -0.30 0.00 -1.81 0.00 0.00 61.98 57.88 2kui s VAL 525 Cb -0.15 -2.17 -0.09 0.00 0.56 0.00 0.00 36.38 34.53 2kui s VAL 525 CO 0.10 -0.38 1.15 1.51 -0.31 0.00 0.00 175.10 177.17 2kui s ASP 526 N -3.24 7.17 0.25 4.85 -4.77 -1.26 -0.51 116.67 119.15 2kui s ASP 526 Ca 0.25 2.27 -0.09 0.00 -3.30 0.00 0.00 52.55 51.69 2kui s ASP 526 Cb -0.05 -2.62 -0.01 0.00 -1.09 0.00 0.00 42.92 39.15 2kui s ASP 526 CO 0.12 -0.26 0.39 -0.44 0.70 0.00 0.00 175.17 175.67 2kui s SER 527 N -0.40 0.09 0.04 2.11 0.01 0.57 -4.79 113.70 111.35 2kui s SER 527 Ca 0.48 -1.12 0.28 0.00 1.31 0.00 0.00 55.95 56.91 2kui s SER 527 Cb -0.32 0.54 1.03 0.00 0.21 0.00 0.00 66.02 67.48 2kui s SER 527 CO 0.40 -1.09 1.81 -0.81 0.41 0.00 0.00 173.24 173.96 2kui n PRO 528 N -0.38 0.06 -2.84 12.44 -0.04 -1.26 -4.29 135.00 138.70 2kui n PRO 528 Ca -0.00 0.04 -0.36 0.00 -0.04 0.00 0.00 63.50 63.14 2kui n PRO 528 Cb 0.63 -1.56 -0.06 0.00 -0.04 0.00 0.00 33.50 32.46 2kui n PRO 528 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2kui s ARG 529 N -3.03 4.47 0.66 0.54 0.52 -1.26 -4.92 118.95 115.94 2kui s ARG 529 Ca 0.13 1.22 -0.17 0.00 -0.52 0.00 0.00 55.73 56.38 2kui s ARG 529 Cb 0.17 -2.71 0.00 0.00 0.52 0.00 0.00 34.95 32.94 2kui s ARG 529 CO 0.57 0.24 1.24 -1.25 0.02 0.00 0.00 175.30 176.13 2kui s PRO 530 N -2.24 2.51 -0.20 3.54 0.04 -1.26 -2.74 135.00 134.66 2kui s PRO 530 Ca 0.51 1.90 -0.28 0.00 0.04 0.00 0.00 61.00 63.17 2kui s PRO 530 Cb -0.17 -1.86 -0.05 0.00 0.04 0.00 0.00 34.50 32.46 2kui s PRO 530 CO 0.22 -1.59 2.05 0.00 0.04 0.00 0.00 177.00 177.72 2kui s ALA 531 N -1.65 2.94 0.00 8.56 0.00 -1.24 -2.50 121.76 127.87 2kui s ALA 531 Ca 0.78 0.75 0.00 0.00 0.00 0.00 0.00 51.96 53.49 2kui s ALA 531 Cb -0.33 -4.01 0.00 0.00 0.00 0.00 0.00 23.12 18.79 2kui s ALA 531 CO 0.40 -2.49 0.00 0.41 0.00 0.00 0.00 175.76 174.08 2kui n GLY 532 N 5.40 1.34 3.79 0.00 0.00 -0.59 -4.93 105.19 110.20 2kui n GLY 532 Ca 0.26 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.90 2kui n GLY 532 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kui s GLU 533 N 0.00 4.52 -0.16 1.61 2.12 -1.04 -0.65 118.70 125.10 2kui s GLU 533 Ca 0.00 1.16 -0.28 0.00 0.36 0.00 0.00 54.97 56.21 2kui s GLU 533 Cb 0.00 -3.04 -0.01 0.00 0.26 0.00 0.00 34.13 31.34 2kui s GLU 533 CO 0.00 0.44 0.94 0.08 -0.54 0.00 0.00 175.26 176.18 2kui s VAL 534 N -1.38 4.80 -0.13 3.70 1.01 0.50 0.17 120.40 129.08 2kui s VAL 534 Ca 0.42 1.86 0.22 0.00 0.00 0.00 0.00 61.98 64.48 2kui s VAL 534 Cb -0.20 -4.24 -0.22 0.00 0.00 0.00 0.00 36.38 31.72 2kui s VAL 534 CO 0.25 -0.03 0.69 1.07 0.00 0.00 0.00 175.10 177.08 2kui n THR 535 N 4.81 0.22 0.00 3.92 5.66 0.57 -1.93 114.28 127.52 2kui n THR 535 Ca 0.08 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.57 2kui n THR 535 Cb 0.48 -0.10 0.00 0.00 -1.55 0.00 0.00 70.33 69.16 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 1.24 -0.93 3.30 1.09 0.00 -1.05 -4.86 105.19 103.98 2kui n GLY 536 Ca -0.02 -1.03 -0.25 0.00 0.00 0.00 0.00 46.02 44.71 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 -2.00 1.81 -0.00 2.61 -4.23 -1.26 -0.00 115.64 112.56 2kui s THR 537 Ca 0.00 -1.57 -0.23 0.00 -1.18 0.00 0.00 61.69 58.71 2kui s THR 537 Cb 0.00 -1.63 -0.13 0.00 1.34 0.00 0.00 72.50 72.08 2kui s THR 537 CO 0.00 -0.02 0.97 -1.13 -0.54 0.00 0.00 174.62 173.89 2kui h ASN 538 N 4.07 -0.70 -3.30 3.99 -1.24 -0.90 -3.41 115.58 114.09 2kui h ASN 538 Ca -0.47 0.02 -0.53 0.00 0.71 0.00 0.00 56.30 56.02 2kui h ASN 538 Cb 1.18 0.18 -0.00 0.00 0.73 0.00 0.00 38.32 40.40 2kui h ASN 538 CO 0.40 -0.30 0.49 -2.16 -1.29 0.00 0.00 177.43 174.56 2kui s PRO 539 N -4.28 4.49 0.59 6.67 0.04 -1.26 -5.01 135.00 136.25 2kui s PRO 539 Ca -0.12 1.65 -0.18 0.00 0.04 0.00 0.00 61.00 62.38 2kui s PRO 539 Cb 0.01 -3.38 -0.03 0.00 0.04 0.00 0.00 34.50 31.14 2kui s PRO 539 CO 0.37 -0.15 1.18 -1.25 0.04 0.00 0.00 177.00 177.19 2kui s PRO 540 N 0.91 3.01 0.45 0.56 0.04 -1.26 -4.96 135.00 133.74 2kui s PRO 540 Ca 0.56 1.73 -0.25 0.00 0.04 0.00 0.00 61.00 63.07 2kui s PRO 540 Cb -0.27 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.24 2kui s PRO 540 CO 0.29 -1.15 1.39 0.00 0.04 0.00 0.00 177.00 177.57 2kui n ALA 541 N -1.65 1.84 0.00 8.56 0.00 -1.26 -2.40 120.51 125.59 2kui n ALA 541 Ca 0.13 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.82 2kui n ALA 541 Cb 0.50 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.59 2kui n ALA 541 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 542 N 0.64 2.49 3.70 0.00 0.00 0.56 -5.00 105.19 107.59 2kui n GLY 542 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.63 3.39 -0.22 2.61 2.01 -1.01 -4.68 115.64 115.12 2kui s THR 543 Ca 0.00 0.91 -0.18 0.00 0.31 0.00 0.00 61.69 62.73 2kui s THR 543 Cb 0.00 -3.59 -0.03 0.00 0.01 0.00 0.00 72.50 68.89 2kui s THR 543 CO 0.00 0.03 0.53 -0.89 -0.69 0.00 0.00 174.62 173.60 2kui s THR 544 N 1.81 5.09 0.10 -0.82 2.01 -1.26 -0.81 115.64 121.76 2kui s THR 544 Ca 0.66 0.96 0.01 0.00 0.31 0.00 0.00 61.69 63.62 2kui s THR 544 Cb -0.35 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.27 2kui s THR 544 CO 0.29 0.15 -0.03 0.68 -0.69 0.00 0.00 174.62 175.02 2kui s VAL 545 N 1.85 0.49 0.68 3.82 -7.23 0.66 -4.89 120.40 115.77 2kui s VAL 545 Ca 0.24 -1.90 -0.17 0.00 -1.81 0.00 0.00 61.98 58.34 2kui s VAL 545 Cb -0.15 -1.74 0.01 0.00 0.56 0.00 0.00 36.38 35.05 2kui s VAL 545 CO 0.09 -0.81 1.25 -2.16 -0.31 0.00 0.00 175.10 173.17 2kui s PRO 546 N -3.90 2.39 0.63 4.82 0.04 -1.26 -0.04 135.00 137.68 2kui s PRO 546 Ca 0.14 1.93 0.41 0.00 0.04 0.00 0.00 61.00 63.51 2kui s PRO 546 Cb 0.06 -1.84 2.07 0.00 0.04 0.00 0.00 34.50 34.83 2kui s PRO 546 CO -0.04 -1.69 2.25 -0.39 0.04 0.00 0.00 177.00 177.17 2kui h VAL 547 N 0.21 0.03 -0.17 -0.36 -1.51 -1.51 0.07 116.25 113.00 2kui h VAL 547 Ca -0.50 -0.18 0.00 0.00 -1.23 0.00 0.00 66.70 64.80 2kui h VAL 547 Cb 1.32 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 31.65 2kui h VAL 547 CO 0.52 0.00 0.00 -0.67 -1.23 0.00 0.00 177.57 176.19 2kui n ASP 548 N -3.12 1.78 -4.76 4.19 2.03 -1.26 -3.82 116.55 111.59 2kui n ASP 548 Ca -0.02 -1.72 -0.30 0.00 0.52 0.00 0.00 54.79 53.26 2kui n ASP 548 Cb 0.15 -0.11 0.10 0.00 -0.72 0.00 0.00 41.12 40.54 2kui n ASP 548 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2kui s SER 549 N -1.58 4.22 -0.27 1.67 0.15 0.01 -4.83 113.70 113.07 2kui s SER 549 Ca 0.33 1.60 -0.06 0.00 0.70 0.00 0.00 55.95 58.51 2kui s SER 549 Cb 0.18 -2.31 0.00 0.00 -1.71 0.00 0.00 66.02 62.18 2kui s SER 549 CO 0.27 -2.18 0.04 -0.69 1.20 0.00 0.00 173.24 171.87 2kui s VAL 550 N -2.97 3.80 -0.21 4.45 1.01 -1.26 -4.11 120.40 121.12 2kui s VAL 550 Ca 0.62 -0.60 -0.18 0.00 0.00 0.00 0.00 61.98 61.82 2kui s VAL 550 Cb -0.17 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 2kui s VAL 550 CO 0.56 0.20 0.51 -0.63 0.00 0.00 0.00 175.10 175.74 2kui s ILE 551 N 1.50 5.11 -0.26 2.22 1.09 0.04 -4.90 121.20 125.99 2kui s ILE 551 Ca 0.04 0.93 -0.09 0.00 -1.10 0.00 0.00 60.65 60.42 2kui s ILE 551 Cb -0.16 -3.83 -0.04 0.00 -1.06 0.00 0.00 42.46 37.37 2kui s ILE 551 CO 0.01 0.17 0.13 -0.70 -0.10 0.00 0.00 174.94 174.46 2kui s GLU 552 N 1.68 3.82 -0.12 2.79 2.12 -1.25 -0.45 118.70 127.28 2kui s GLU 552 Ca 0.23 -0.39 -0.12 0.00 0.36 0.00 0.00 54.97 55.05 2kui s GLU 552 Cb -0.15 -3.50 -0.05 0.00 0.26 0.00 0.00 34.13 30.69 2kui s GLU 552 CO 0.09 -0.18 0.27 -0.51 -0.54 0.00 0.00 175.26 174.40 2kui s LEU 553 N 1.67 4.32 -0.35 2.70 2.01 0.11 -0.16 118.68 128.98 2kui s LEU 553 Ca 0.07 0.58 -0.19 0.00 0.01 0.00 0.00 54.13 54.59 2kui s LEU 553 Cb -0.16 -2.33 -0.00 0.00 0.01 0.00 0.00 46.19 43.71 2kui s LEU 553 CO 0.07 0.22 0.56 -1.10 1.01 0.00 0.00 176.35 177.12 2kui s GLN 554 N -0.18 3.65 -0.09 1.70 1.11 1.00 -0.52 119.66 126.33 2kui s GLN 554 Ca 0.17 -0.06 -0.05 0.00 0.01 0.00 0.00 55.36 55.42 2kui s GLN 554 Cb -0.13 -3.81 -0.04 0.00 -1.01 0.00 0.00 33.01 28.02 2kui s GLN 554 CO 0.05 -0.68 0.14 0.08 0.01 0.00 0.00 175.29 174.89 2kui s VAL 555 N 2.52 5.37 0.19 1.09 1.01 0.68 -0.31 120.40 130.94 2kui s VAL 555 Ca 0.21 0.06 -0.28 0.00 0.00 0.00 0.00 61.98 61.97 2kui s VAL 555 Cb -0.15 -3.38 -0.08 0.00 0.00 0.00 0.00 36.38 32.77 2kui s VAL 555 CO 0.14 0.54 0.89 -0.44 0.00 0.00 0.00 175.10 176.22 2kui s SER 556 N -1.27 7.52 -0.09 3.32 0.01 0.13 -0.32 113.70 123.00 2kui s SER 556 Ca 0.18 1.81 0.01 0.00 1.31 0.00 0.00 55.95 59.25 2kui s SER 556 Cb -0.12 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.52 2kui s SER 556 CO 0.08 0.13 -0.10 -0.75 0.41 0.00 0.00 173.24 173.01 2kui s LYS 557 N -0.90 3.01 0.10 12.44 2.20 0.34 -1.54 119.74 135.38 2kui s LYS 557 Ca 0.40 -0.62 -0.14 0.00 -0.36 0.00 0.00 55.97 55.25 2kui s LYS 557 Cb -0.24 -2.60 -0.11 0.00 -1.51 0.00 0.00 37.83 33.37 2kui s LYS 557 CO 0.29 0.47 1.37 0.78 -0.36 0.00 0.00 175.35 177.90 2kui h GLY 558 N 5.89 0.79 0.00 5.54 0.00 -1.70 0.16 103.07 113.76 2kui h GLY 558 Ca -0.39 -0.91 0.00 0.00 0.00 0.00 0.00 47.33 46.03 2kui h GLY 558 CO 0.54 0.82 0.00 -2.01 0.00 0.00 0.00 176.54 175.89 2kui n ASN 559 N -4.17 -4.09 -4.65 0.19 5.15 -1.26 -4.61 115.26 101.82 2kui n ASN 559 Ca -0.05 0.00 -0.23 0.00 -0.60 0.00 0.00 54.58 53.70 2kui n ASN 559 Cb 0.55 -2.38 -0.07 0.00 -0.53 0.00 0.00 39.78 37.35 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 -1.23 2.23 0.02 1.20 -0.21 -1.26 -2.52 119.66 117.88 2kui s GLN 560 Ca 0.00 -1.54 0.01 0.00 0.02 0.00 0.00 55.36 53.85 2kui s GLN 560 Cb 0.00 -2.09 -0.01 0.00 1.00 0.00 0.00 33.01 31.91 2kui s GLN 560 CO 0.00 0.25 -0.05 -0.59 -2.12 0.00 0.00 175.29 172.78 2kui s PHE 561 N -2.40 0.44 -0.08 0.91 -0.71 -0.44 -4.85 117.98 110.84 2kui s PHE 561 Ca 0.34 -0.28 -0.30 0.00 -1.04 0.00 0.00 56.93 55.65 2kui s PHE 561 Cb -0.04 -0.27 -0.04 0.00 -1.21 0.00 0.00 43.02 41.46 2kui s PHE 561 CO 0.20 -0.06 1.34 0.08 -1.34 0.00 0.00 175.22 175.45 2kui s VAL 562 N -0.73 4.02 -0.07 -2.49 1.01 -1.26 -0.30 120.40 120.57 2kui s VAL 562 Ca -0.05 1.31 -0.30 0.00 0.00 0.00 0.00 61.98 62.94 2kui s VAL 562 Cb -0.06 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.46 2kui s VAL 562 CO -0.00 -0.06 1.08 -0.32 0.00 0.00 0.00 175.10 175.80 2kui s MET 563 N 2.98 4.42 1.01 2.72 1.75 -0.11 -4.91 119.30 127.16 2kui s MET 563 Ca 0.60 1.51 -0.12 0.00 -1.25 0.00 0.00 55.69 56.42 2kui s MET 563 Cb -0.27 -3.53 0.19 0.00 2.84 0.00 0.00 34.83 34.07 2kui s MET 563 CO 0.22 -0.33 1.09 -1.25 -0.65 0.00 0.00 175.02 174.10 2kui s PRO 564 N 1.92 0.35 -0.24 4.11 0.04 -1.26 -0.08 135.00 139.83 2kui s PRO 564 Ca 0.52 0.54 -0.26 0.00 0.04 0.00 0.00 61.00 61.84 2kui s PRO 564 Cb -0.21 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.60 2kui s PRO 564 CO 0.21 -2.79 0.91 0.16 0.04 0.00 0.00 177.00 175.53 2kui s ASP 565 N -3.40 6.92 -0.03 6.66 -4.77 -1.26 -4.64 116.67 116.14 2kui s ASP 565 Ca 0.65 1.14 0.05 0.00 -3.30 0.00 0.00 52.55 51.09 2kui s ASP 565 Cb -0.19 -2.48 0.07 0.00 -1.09 0.00 0.00 42.92 39.24 2kui s ASP 565 CO 0.58 -0.59 0.93 0.18 0.70 0.00 0.00 175.17 176.97 2kui n LEU 566 N 6.17 1.36 -4.72 2.11 4.77 -1.26 -5.06 117.00 120.36 2kui n LEU 566 Ca 0.08 -1.69 -0.42 0.00 -0.03 0.00 0.00 56.01 53.95 2kui n LEU 566 Cb 0.47 -0.11 -0.03 0.00 -2.33 0.00 0.00 43.42 41.42 2kui n LEU 566 CO 0.50 0.41 0.95 -0.44 -1.33 0.00 0.00 177.39 177.47 2kui s SER 567 N -1.26 6.98 0.00 -1.43 0.01 -1.26 -2.90 113.70 113.84 2kui s SER 567 Ca 0.08 2.16 0.00 0.00 1.31 0.00 0.00 55.95 59.51 2kui s SER 567 Cb 0.07 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.72 2kui s SER 567 CO 0.01 -0.53 0.00 0.61 0.41 0.00 0.00 173.24 173.74 2kui n GLY 568 N 3.18 0.61 3.42 3.44 0.00 -1.26 -5.05 105.19 109.52 2kui n GLY 568 Ca 0.09 -0.78 -0.28 0.00 0.00 0.00 0.00 46.02 45.05 2kui n GLY 568 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2kui n MET 569 N -2.24 0.82 -3.76 1.61 2.00 -1.14 -4.95 117.12 109.46 2kui n MET 569 Ca 0.00 -3.33 -0.28 0.00 0.00 0.00 0.00 57.70 54.08 2kui n MET 569 Cb 0.11 0.70 -0.04 0.00 0.00 0.00 0.00 33.22 33.99 2kui n MET 569 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 2kui s PHE 570 N -2.63 3.49 0.43 2.03 0.08 -1.26 -1.46 117.98 118.66 2kui s PHE 570 Ca 0.11 0.33 0.21 0.00 0.12 0.00 0.00 56.93 57.70 2kui s PHE 570 Cb -0.01 -1.84 1.20 0.00 -0.57 0.00 0.00 43.02 41.81 2kui s PHE 570 CO 0.07 0.44 2.02 2.35 -0.10 0.00 0.00 175.22 179.99 2kui h TRP 571 N 2.31 0.00 0.00 0.36 7.01 -0.47 0.21 115.95 125.38 2kui h TRP 571 Ca -0.47 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.53 2kui h TRP 571 Cb 1.18 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.24 2kui h TRP 571 CO 0.57 0.17 0.00 -0.24 -2.79 0.00 0.00 178.44 176.15 2kui h VAL 572 N 0.00 0.00 0.00 2.65 3.04 -1.94 -0.83 116.25 119.17 2kui h VAL 572 Ca -0.00 -0.38 -0.40 0.00 -1.01 0.00 0.00 66.70 64.91 2kui h VAL 572 Cb 0.36 1.23 -0.07 0.00 -2.01 0.00 0.00 31.29 30.80 2kui h VAL 572 CO 0.02 0.00 -2.43 0.47 -1.01 0.00 0.00 177.57 174.62 2kui n ASP 573 N -2.52 1.97 0.14 3.17 8.00 -0.25 -4.50 116.55 122.56 2kui n ASP 573 Ca 0.02 0.09 -0.14 0.00 0.71 0.00 0.00 54.79 55.47 2kui n ASP 573 Cb 0.29 -0.58 -0.08 0.00 -0.02 0.00 0.00 41.12 40.73 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 -0.31 -0.06 2.24 0.00 -0.54 -2.37 119.26 117.75 2kui h ALA 574 Ca -0.61 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.21 2kui h ALA 574 Cb 1.72 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.59 2kui h ALA 574 CO -0.24 -0.60 -0.15 1.49 0.00 0.00 0.00 179.25 179.74 2kui h GLU 575 N -0.46 -0.22 0.00 0.00 4.22 -1.39 -0.59 114.58 116.15 2kui h GLU 575 Ca -0.03 0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.41 2kui h GLU 575 Cb 0.35 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 2kui h GLU 575 CO 0.05 -0.14 -0.05 -1.35 -2.18 0.00 0.00 179.01 175.34 2kui h PRO 576 N -0.22 0.00 -0.58 0.92 0.11 -1.77 -2.55 132.00 127.90 2kui h PRO 576 Ca 0.07 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.08 2kui h PRO 576 Cb 0.32 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.41 2kui h PRO 576 CO -0.19 0.05 -0.02 0.00 -0.21 0.00 0.00 178.00 177.63 2kui h ARG 577 N 0.00 1.03 -0.48 1.05 2.47 -0.59 -1.85 114.38 116.01 2kui h ARG 577 Ca -0.00 -0.34 0.02 0.00 -1.26 0.00 0.00 59.98 58.40 2kui h ARG 577 Cb 0.10 -0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.30 2kui h ARG 577 CO 0.01 1.03 0.29 -0.07 0.56 0.00 0.00 179.97 181.79 2kui h LEU 578 N 0.92 0.48 -1.05 3.04 -0.00 -0.86 -1.71 115.31 116.14 2kui h LEU 578 Ca 0.16 -0.00 0.02 0.00 -0.00 0.00 0.00 57.88 58.06 2kui h LEU 578 Cb 0.58 -0.10 -0.05 0.00 -0.00 0.00 0.00 40.66 41.09 2kui h LEU 578 CO 0.03 0.34 0.64 0.03 -0.00 0.00 0.00 178.44 179.49 2kui h ARG 579 N 0.59 1.26 0.00 1.13 3.08 -1.36 -0.68 114.38 118.39 2kui h ARG 579 Ca 0.19 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 2kui h ARG 579 Cb -0.01 -0.28 -0.00 0.00 0.08 0.00 0.00 29.97 29.76 2kui h ARG 579 CO -0.07 0.83 -0.07 0.00 -1.07 0.00 0.00 179.97 179.59 2kui h ALA 580 N 1.40 1.02 -0.00 0.04 0.00 -0.63 -2.33 119.26 118.76 2kui h ALA 580 Ca 0.36 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2kui h ALA 580 Cb -0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2kui h ALA 580 CO -0.09 0.09 -0.09 1.28 0.00 0.00 0.00 179.25 180.44 2kui n LEU 581 N -3.21 0.22 0.00 0.00 4.77 -0.30 -4.89 117.00 113.60 2kui n LEU 581 Ca 0.00 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 2kui n LEU 581 Cb 0.34 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2kui n LEU 581 CO 0.29 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 2kui n GLY 582 N 1.35 0.64 3.71 -0.72 0.00 -0.88 -5.03 105.19 104.28 2kui n GLY 582 Ca 0.12 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 2kui n GLY 582 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2kui s TRP 583 N -2.00 3.30 -0.03 1.61 -0.00 -0.97 -4.90 118.94 115.94 2kui s TRP 583 Ca 0.00 1.07 0.05 0.00 -0.00 0.00 0.00 56.10 57.22 2kui s TRP 583 Cb 0.00 -3.59 0.07 0.00 -0.00 0.00 0.00 33.47 29.95 2kui s TRP 583 CO 0.00 -2.00 0.92 2.41 -0.00 0.00 0.00 176.95 178.28 2kui n THR 584 N 3.96 0.84 -0.76 5.86 -1.04 -1.26 -4.64 114.28 117.24 2kui n THR 584 Ca 0.11 -0.93 0.00 0.00 -2.04 0.00 0.00 64.05 61.18 2kui n THR 584 Cb 0.44 0.43 0.00 0.00 -1.82 0.00 0.00 70.33 69.38 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 -0.54 0.73 3.54 3.41 0.00 -0.89 -5.04 105.19 106.40 2kui n GLY 585 Ca 0.04 -1.77 -0.34 0.00 0.00 0.00 0.00 46.02 43.95 2kui n GLY 585 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2kui s MET 586 N 1.49 3.62 -0.20 1.61 -2.45 -1.26 -5.00 119.30 117.10 2kui s MET 586 Ca 0.00 -0.48 -0.09 0.00 -1.25 0.00 0.00 55.69 53.87 2kui s MET 586 Cb 0.00 -2.93 -0.05 0.00 1.25 0.00 0.00 34.83 33.10 2kui s MET 586 CO 0.00 0.31 0.11 -1.17 1.05 0.00 0.00 175.02 175.32 2kui s LEU 587 N 0.19 4.05 -0.23 4.11 1.98 -1.26 -2.83 118.68 124.69 2kui s LEU 587 Ca -0.01 0.15 -0.06 0.00 -2.89 0.00 0.00 54.13 51.32 2kui s LEU 587 Cb -0.13 -2.05 -0.03 0.00 0.66 0.00 0.00 46.19 44.64 2kui s LEU 587 CO 0.02 0.16 0.04 -1.81 -1.89 0.00 0.00 176.35 172.87 2kui s ASP 588 N 0.50 5.03 -0.06 3.68 1.01 -0.86 -5.01 116.67 120.97 2kui s ASP 588 Ca 0.06 -0.19 -0.19 0.00 0.71 0.00 0.00 52.55 52.94 2kui s ASP 588 Cb -0.12 -1.89 -0.05 0.00 1.01 0.00 0.00 42.92 41.88 2kui s ASP 588 CO -0.00 0.02 0.54 -0.75 0.21 0.00 0.00 175.17 175.18 2kui s LYS 589 N 1.30 4.30 0.85 8.23 2.20 -1.26 -2.08 119.74 133.28 2kui s LYS 589 Ca 0.04 0.60 -0.09 0.00 -0.36 0.00 0.00 55.97 56.16 2kui s LYS 589 Cb -0.15 -3.38 0.16 0.00 -1.51 0.00 0.00 37.83 32.96 2kui s LYS 589 CO 0.02 0.29 1.17 0.20 -0.36 0.00 0.00 175.35 176.67 2kui s GLY 590 N 0.15 1.77 0.40 5.54 0.00 0.05 -4.96 107.32 110.26 2kui s GLY 590 Ca 0.29 -1.42 -0.25 0.00 0.00 0.00 0.00 44.72 43.34 2kui s GLY 590 CO 0.14 -0.75 1.12 0.00 0.00 0.00 0.00 173.10 173.61 2kui s ALA 591 N -3.55 3.13 0.65 3.20 0.00 -1.26 -4.67 121.76 119.26 2kui s ALA 591 Ca 0.70 0.86 -0.17 0.00 0.00 0.00 0.00 51.96 53.34 2kui s ALA 591 Cb -0.05 -3.33 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 2kui s ALA 591 CO 0.49 -0.39 1.23 0.16 0.00 0.00 0.00 175.76 177.24 2kui s ASP 592 N -1.30 4.76 -0.09 0.00 -4.77 -1.26 -4.50 116.67 109.51 2kui s ASP 592 Ca 0.57 2.42 -0.03 0.00 -3.30 0.00 0.00 52.55 52.22 2kui s ASP 592 Cb -0.27 -2.60 0.04 0.00 -1.09 0.00 0.00 42.92 39.00 2kui s ASP 592 CO 0.34 -1.88 0.05 -0.69 0.70 0.00 0.00 175.17 173.69 2kui s VAL 593 N -1.68 0.07 -0.07 2.11 1.01 -1.18 -4.85 120.40 115.81 2kui s VAL 593 Ca 0.77 0.14 -0.30 0.00 0.00 0.00 0.00 61.98 62.60 2kui s VAL 593 Cb -0.31 -0.41 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 2kui s VAL 593 CO 0.38 0.07 1.26 1.51 0.00 0.00 0.00 175.10 178.32 2kui s ASP 594 N 2.09 6.99 0.00 3.32 -4.77 -1.26 -1.38 116.67 121.65 2kui s ASP 594 Ca 0.04 1.85 0.00 0.00 -3.30 0.00 0.00 52.55 51.14 2kui s ASP 594 Cb -0.13 -2.55 0.00 0.00 -1.09 0.00 0.00 42.92 39.14 2kui s ASP 594 CO -0.05 -0.65 0.14 0.00 0.70 0.00 0.00 175.17 175.31 2kui n ALA 595 N 5.55 1.28 0.00 2.11 0.00 -1.26 -4.99 120.51 123.20 2kui n ALA 595 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2kui n ALA 595 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 2kui n ALA 595 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 596 N 0.00 -0.31 0.11 0.00 0.00 -1.26 -4.35 105.19 99.38 2kui n GLY 596 Ca 0.00 -1.72 -0.10 0.00 0.00 0.00 0.00 46.02 44.20 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 0.27 2.00 -0.02 0.00 -1.99 0.07 103.07 103.40 2kui h GLY 597 Ca 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 2kui h GLY 597 CO 0.00 0.08 -0.03 1.76 0.00 0.00 0.00 176.54 178.35 2kui h SER 598 N 0.24 0.00 -0.01 0.19 0.02 -2.02 -1.27 113.55 110.70 2kui h SER 598 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2kui h SER 598 Cb -0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.53 2kui h SER 598 CO -0.04 0.03 -0.09 0.00 -1.14 0.00 0.00 176.83 175.60 2kui n GLN 599 N -3.80 1.24 -0.03 3.45 1.13 -1.02 -4.60 117.38 113.74 2kui n GLN 599 Ca -0.03 -1.13 -0.12 0.00 -1.94 0.00 0.00 57.00 53.78 2kui n GLN 599 Cb 0.12 -1.24 -0.10 0.00 0.11 0.00 0.00 30.24 29.13 2kui n GLN 599 CO 0.00 0.00 0.00 1.12 -1.44 0.00 0.00 177.06 176.74 2kui h HIS 600 N 2.32 -0.04 -0.36 1.08 2.07 0.27 -3.23 115.15 117.27 2kui h HIS 600 Ca 0.00 -0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2kui h HIS 600 Cb 0.54 0.01 0.00 0.00 2.57 0.00 0.00 27.41 30.53 2kui h HIS 600 CO 0.00 0.67 0.00 -1.71 -3.07 0.00 0.00 177.93 173.82 2kui n ASN 601 N -4.73 3.83 -4.82 3.10 2.85 -1.25 -0.02 115.26 114.21 2kui n ASN 601 Ca -0.08 -2.54 -0.38 0.00 -0.11 0.00 0.00 54.58 51.46 2kui n ASN 601 Cb 0.35 -0.60 -0.06 0.00 1.24 0.00 0.00 39.78 40.71 2kui n ASN 601 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 2kui s ARG 602 N -2.04 4.08 0.34 1.20 6.06 -1.22 0.31 118.95 127.68 2kui s ARG 602 Ca 0.33 0.59 -0.29 0.00 -2.50 0.00 0.00 55.73 53.87 2kui s ARG 602 Cb 0.25 -3.23 -0.10 0.00 0.06 0.00 0.00 34.95 31.92 2kui s ARG 602 CO 0.10 0.65 1.36 0.54 -2.50 0.00 0.00 175.30 175.46 2kui s VAL 603 N -1.06 2.52 -0.27 7.11 0.11 -0.53 -3.60 120.40 124.68 2kui s VAL 603 Ca 0.27 0.53 -0.09 0.00 -2.93 0.00 0.00 61.98 59.75 2kui s VAL 603 Cb -0.18 -3.34 -0.13 0.00 -1.53 0.00 0.00 36.38 31.20 2kui s VAL 603 CO 0.16 0.13 -0.32 0.52 -3.33 0.00 0.00 175.10 172.26 2kui n VAL 604 N 0.71 1.51 -3.57 2.04 0.31 0.19 -4.75 118.33 114.78 2kui n VAL 604 Ca 0.00 -0.44 -0.12 0.00 -0.01 0.00 0.00 64.34 63.77 2kui n VAL 604 Cb 0.41 -1.73 -0.04 0.00 -0.91 0.00 0.00 33.84 31.56 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 -2.51 -0.38 -0.07 3.52 1.13 -1.26 -5.01 117.35 112.78 2kui s TYR 605 Ca -0.37 0.27 0.04 0.00 -1.41 0.00 0.00 57.07 55.59 2kui s TYR 605 Cb 0.13 0.35 0.00 0.00 -1.10 0.00 0.00 41.96 41.35 2kui s TYR 605 CO 0.52 -0.70 -0.20 1.14 -2.51 0.00 0.00 175.55 173.81 2kui s GLN 606 N -3.08 2.37 0.12 -3.49 -2.07 -1.26 -3.08 119.66 109.17 2kui s GLN 606 Ca -0.02 -0.71 -0.31 0.00 -1.82 0.00 0.00 55.36 52.50 2kui s GLN 606 Cb -0.00 -1.90 -0.09 0.00 -1.09 0.00 0.00 33.01 29.93 2kui s GLN 606 CO -0.07 0.19 1.58 -0.97 -1.32 0.00 0.00 175.29 174.69 2kui h ASN 607 N 6.58 -1.40 -3.70 12.60 -0.73 -0.92 -3.37 115.58 124.64 2kui h ASN 607 Ca -0.27 0.17 -0.62 0.00 1.87 0.00 0.00 56.30 57.45 2kui h ASN 607 Cb 1.20 0.54 -0.14 0.00 0.27 0.00 0.00 38.32 40.19 2kui h ASN 607 CO 0.47 -0.48 -0.31 -2.16 -0.37 0.00 0.00 177.43 174.58 2kui s PRO 608 N -5.85 4.04 0.78 6.67 0.05 -1.26 -5.03 135.00 134.40 2kui s PRO 608 Ca -0.16 -0.03 -0.12 0.00 0.05 0.00 0.00 61.00 60.74 2kui s PRO 608 Cb 0.08 -3.62 0.07 0.00 0.05 0.00 0.00 34.50 31.07 2kui s PRO 608 CO 0.63 -0.18 1.12 -1.25 0.05 0.00 0.00 177.00 177.37 2kui s PRO 609 N 1.76 2.02 0.21 0.56 0.04 -1.26 -4.92 135.00 133.40 2kui s PRO 609 Ca 0.13 1.38 -0.31 0.00 0.04 0.00 0.00 61.00 62.24 2kui s PRO 609 Cb -0.15 -1.85 -0.11 0.00 0.04 0.00 0.00 34.50 32.42 2kui s PRO 609 CO 0.09 -1.85 1.64 0.00 0.04 0.00 0.00 177.00 176.92 2kui s ALA 610 N -2.62 3.85 0.00 8.56 0.00 -1.26 -2.17 121.76 128.11 2kui s ALA 610 Ca 0.65 1.50 0.00 0.00 0.00 0.00 0.00 51.96 54.11 2kui s ALA 610 Cb -0.21 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.25 2kui s ALA 610 CO 0.53 -0.87 0.00 0.41 0.00 0.00 0.00 175.76 175.82 2kui n GLY 611 N 3.58 0.50 3.88 0.00 0.00 0.88 -4.94 105.19 109.09 2kui n GLY 611 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 2kui n GLY 611 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kui s THR 612 N -2.00 5.04 -0.34 2.61 2.01 -0.92 -4.76 115.64 117.29 2kui s THR 612 Ca 0.00 0.37 -0.25 0.00 0.31 0.00 0.00 61.69 62.12 2kui s THR 612 Cb 0.00 -3.64 0.01 0.00 0.01 0.00 0.00 72.50 68.88 2kui s THR 612 CO 0.00 0.09 0.89 -0.83 -0.69 0.00 0.00 174.62 174.09 2kui s GLY 613 N -2.15 1.63 -0.05 4.40 0.00 -1.26 -0.94 107.32 108.95 2kui s GLY 613 Ca 0.40 -0.38 -0.04 0.00 0.00 0.00 0.00 44.72 44.71 2kui s GLY 613 CO 0.21 1.94 0.14 -1.34 0.00 0.00 0.00 173.10 174.06 2kui s VAL 614 N 3.28 5.30 1.02 1.40 -7.23 0.58 -4.74 120.40 120.02 2kui s VAL 614 Ca 0.37 -0.08 -0.21 0.00 -1.81 0.00 0.00 61.98 60.25 2kui s VAL 614 Cb -0.13 -3.40 -0.09 0.00 0.56 0.00 0.00 36.38 33.32 2kui s VAL 614 CO 0.16 0.44 -0.79 -0.46 -0.31 0.00 0.00 175.10 174.14 2kui n ASN 615 N 1.38 -3.42 0.23 4.85 6.94 -1.26 -1.33 115.26 122.65 2kui n ASN 615 Ca -0.15 0.05 0.16 0.00 -0.02 0.00 0.00 54.58 54.62 2kui n ASN 615 Cb 0.53 -0.75 0.83 0.00 -2.36 0.00 0.00 39.78 38.04 2kui n ASN 615 CO 0.00 0.00 0.00 0.08 -1.03 0.00 0.00 177.26 176.31 2kui h ARG 616 N -1.33 0.00 0.17 -3.83 -0.00 -1.86 0.72 114.38 108.26 2kui h ARG 616 Ca -0.44 0.00 -0.30 0.00 -0.00 0.00 0.00 59.98 59.24 2kui h ARG 616 Cb 1.35 0.00 0.02 0.00 -0.00 0.00 0.00 29.97 31.34 2kui h ARG 616 CO 0.27 0.00 -1.32 0.22 -0.00 0.00 0.00 179.97 179.14 2kui h ASP 617 N 0.00 0.62 0.00 0.08 3.58 -1.88 -3.46 116.42 115.37 2kui h ASP 617 Ca 0.06 -0.65 0.00 0.00 0.42 0.00 0.00 57.03 56.85 2kui h ASP 617 Cb 0.31 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.16 2kui h ASP 617 CO -0.00 1.51 0.00 0.61 -2.88 0.00 0.00 179.24 178.48 2kui n GLY 618 N 1.57 0.44 3.66 -0.78 0.00 0.25 -2.10 105.19 108.22 2kui n GLY 618 Ca -0.12 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 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 3.57 -0.08 -0.61 -1.16 -1.26 -4.75 121.20 114.91 2kui s ILE 619 Ca 0.00 0.69 0.01 0.00 -0.51 0.00 0.00 60.65 60.84 2kui s ILE 619 Cb 0.00 -3.45 0.02 0.00 0.61 0.00 0.00 42.46 39.64 2kui s ILE 619 CO 0.00 -0.07 -0.11 -0.51 -2.81 0.00 0.00 174.94 171.45 2kui s ILE 620 N 4.10 1.08 -0.23 2.00 -1.16 -1.13 -4.88 121.20 120.99 2kui s ILE 620 Ca 0.74 -0.41 -0.10 0.00 -0.51 0.00 0.00 60.65 60.37 2kui s ILE 620 Cb -0.33 -1.03 -0.05 0.00 0.61 0.00 0.00 42.46 41.66 2kui s ILE 620 CO 0.30 0.35 0.14 -0.89 -2.81 0.00 0.00 174.94 172.03 2kui s THR 621 N 1.01 5.22 0.08 4.00 2.01 -1.26 -2.02 115.64 124.68 2kui s THR 621 Ca -0.08 0.13 0.03 0.00 0.31 0.00 0.00 61.69 62.08 2kui s THR 621 Cb -0.15 -3.42 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 2kui s THR 621 CO -0.00 0.37 -0.09 -1.48 -0.69 0.00 0.00 174.62 172.72 2kui s LEU 622 N 0.94 2.38 0.00 4.42 0.05 -0.88 -0.14 118.68 125.45 2kui s LEU 622 Ca 0.07 -0.78 0.05 0.00 0.05 0.00 0.00 54.13 53.52 2kui s LEU 622 Cb -0.13 -0.26 -0.02 0.00 -2.05 0.00 0.00 46.19 43.74 2kui s LEU 622 CO 0.03 -0.27 -0.16 -0.60 -0.55 0.00 0.00 176.35 174.81 2kui s ARG 623 N -2.64 1.22 0.18 1.48 3.52 -1.18 -0.77 118.95 120.76 2kui s ARG 623 Ca 0.03 -0.64 0.00 0.00 -0.13 0.00 0.00 55.73 54.99 2kui s ARG 623 Cb -0.04 -1.21 -0.04 0.00 -1.56 0.00 0.00 34.95 32.11 2kui s ARG 623 CO -0.00 0.32 0.06 -0.59 -0.81 0.00 0.00 175.30 174.28 2kui s PHE 624 N -0.50 1.15 0.00 5.12 -0.71 -1.26 0.57 117.98 122.35 2kui s PHE 624 Ca 0.05 -1.19 0.00 0.00 -1.04 0.00 0.00 56.93 54.76 2kui s PHE 624 Cb -0.07 -0.64 0.00 0.00 -1.21 0.00 0.00 43.02 41.11 2kui s PHE 624 CO -0.00 -0.42 0.00 0.41 -1.34 0.00 0.00 175.22 173.87 2kui n GLY 625 N -0.24 -1.16 0.00 1.99 0.00 0.97 -3.91 105.19 102.83 2kui n GLY 625 Ca -0.03 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.11 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14