#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 4.53 0.21 -0.61 1.10 -1.26 -5.01 121.20 120.16 2kui s ILE 356 Ca 0.00 1.61 -0.30 0.00 -0.51 0.00 0.00 60.65 61.45 2kui s ILE 356 Cb 0.00 -4.39 -0.08 0.00 0.15 0.00 0.00 42.46 38.14 2kui s ILE 356 CO 0.00 -0.48 1.07 -0.89 -2.11 0.00 0.00 174.94 172.53 2kui s THR 357 N 3.60 3.84 0.00 4.00 2.01 -1.26 -5.02 115.64 122.80 2kui s THR 357 Ca 0.43 1.67 0.00 0.00 0.31 0.00 0.00 61.69 64.11 2kui s THR 357 Cb -0.12 -4.07 0.00 0.00 0.01 0.00 0.00 72.50 68.32 2kui s THR 357 CO 0.16 0.33 0.00 0.54 -0.69 0.00 0.00 174.62 174.96 2kui n ARG 358 N 1.99 3.54 -4.73 4.92 5.12 -1.26 -4.93 116.66 121.31 2kui n ARG 358 Ca 0.01 0.00 -0.25 0.00 -1.93 0.00 0.00 57.85 55.69 2kui n ARG 358 Cb 0.46 0.00 -0.15 0.00 -1.16 0.00 0.00 32.46 31.61 2kui n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2kui s ASP 359 N -1.00 2.16 0.12 0.55 1.01 -1.26 -3.69 116.67 114.56 2kui s ASP 359 Ca 0.00 -0.40 -0.03 0.00 0.71 0.00 0.00 52.55 52.83 2kui s ASP 359 Cb 0.00 -0.21 -0.03 0.00 1.01 0.00 0.00 42.92 43.69 2kui s ASP 359 CO 0.00 0.18 0.09 0.68 0.21 0.00 0.00 175.17 176.33 2kui s VAL 360 N -0.59 0.11 -0.01 -1.27 -7.23 0.29 -4.82 120.40 106.87 2kui s VAL 360 Ca 0.06 -1.79 -0.16 0.00 -1.81 0.00 0.00 61.98 58.29 2kui s VAL 360 Cb -0.08 -1.92 -0.06 0.00 0.56 0.00 0.00 36.38 34.89 2kui s VAL 360 CO 0.00 -0.51 0.44 -1.10 -0.31 0.00 0.00 175.10 173.62 2kui s GLN 361 N -4.01 4.04 -0.21 4.82 -0.21 -1.26 -0.48 119.66 122.34 2kui s GLN 361 Ca 0.20 0.45 -0.15 0.00 0.02 0.00 0.00 55.36 55.88 2kui s GLN 361 Cb 0.07 -3.26 -0.04 0.00 1.00 0.00 0.00 33.01 30.77 2kui s GLN 361 CO -0.00 0.58 0.38 0.08 -2.12 0.00 0.00 175.29 174.21 2kui s VAL 362 N -0.76 5.21 0.30 1.09 1.01 0.30 -5.00 120.40 122.56 2kui s VAL 362 Ca 0.25 0.65 -0.30 0.00 0.00 0.00 0.00 61.98 62.58 2kui s VAL 362 Cb -0.17 -3.71 -0.12 0.00 0.00 0.00 0.00 36.38 32.38 2kui s VAL 362 CO 0.13 0.26 1.46 -2.65 0.00 0.00 0.00 175.10 174.30 2kui n PRO 363 N 4.49 2.38 -2.33 2.72 -0.02 -1.26 -4.26 135.00 136.71 2kui n PRO 363 Ca -0.09 0.84 -0.40 0.00 -2.02 0.00 0.00 63.50 61.83 2kui n PRO 363 Cb 0.51 -2.53 -0.03 0.00 -0.02 0.00 0.00 33.50 31.43 2kui n PRO 363 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 2kui s ASP 364 N 0.16 5.86 0.00 2.55 -4.77 -1.26 -4.80 116.67 114.40 2kui s ASP 364 Ca 0.62 0.03 0.11 0.00 -3.30 0.00 0.00 52.55 50.01 2kui s ASP 364 Cb -0.55 -2.55 0.55 0.00 -1.09 0.00 0.00 42.92 39.29 2kui s ASP 364 CO 0.54 -1.98 1.37 1.33 0.70 0.00 0.00 175.17 177.13 2kui n VAL 365 N 6.80 0.07 -1.72 2.11 0.24 -1.26 -4.89 118.33 119.67 2kui n VAL 365 Ca 0.11 -0.08 -0.39 0.00 -2.04 0.00 0.00 64.34 61.95 2kui n VAL 365 Cb 0.50 -0.06 0.04 0.00 -1.47 0.00 0.00 33.84 32.85 2kui n VAL 365 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2kui n ARG 366 N -0.44 1.64 0.00 7.34 1.85 -1.26 -3.32 116.66 122.46 2kui n ARG 366 Ca 0.08 0.60 0.00 0.00 -1.00 0.00 0.00 57.85 57.53 2kui n ARG 366 Cb 0.09 -2.49 0.00 0.00 -1.05 0.00 0.00 32.46 29.00 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 0.83 0.43 0.00 2.89 0.00 0.22 -4.99 105.19 104.57 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 -1.60 3.20 -3.38 1.61 6.02 -1.21 -4.90 117.38 117.11 2kui n GLN 368 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 57.00 56.74 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 -0.12 6.32 0.35 1.08 1.04 -1.26 -0.98 113.70 120.13 2kui s SER 369 Ca 0.00 0.50 0.03 0.00 0.48 0.00 0.00 55.95 56.95 2kui s SER 369 Cb 0.00 -2.05 0.64 0.00 0.10 0.00 0.00 66.02 64.71 2kui s SER 369 CO 0.00 -0.26 2.00 -1.28 0.98 0.00 0.00 173.24 174.68 2kui h SER 370 N 0.99 0.70 -0.13 7.02 0.87 -1.09 -0.17 113.55 121.74 2kui h SER 370 Ca -0.49 -0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.02 2kui h SER 370 Cb 1.21 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.99 2kui h SER 370 CO 0.63 0.52 -0.01 0.00 -0.53 0.00 0.00 176.83 177.44 2kui h ALA 371 N 1.60 0.18 -0.35 6.23 0.00 -1.94 0.10 119.26 125.09 2kui h ALA 371 Ca 0.22 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.77 2kui h ALA 371 Cb -0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2kui h ALA 371 CO -0.04 -0.11 -0.39 0.22 0.00 0.00 0.00 179.25 178.92 2kui h ASP 372 N -0.04 0.95 -0.24 0.00 3.58 -1.91 0.17 116.42 118.93 2kui h ASP 372 Ca 0.04 -0.48 -0.00 0.00 0.42 0.00 0.00 57.03 57.00 2kui h ASP 372 Cb 0.39 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.16 2kui h ASP 372 CO 0.01 1.24 0.14 0.00 -2.88 0.00 0.00 179.24 177.74 2kui h ALA 373 N 0.74 0.31 -0.36 -0.78 0.00 -1.01 -0.14 119.26 118.03 2kui h ALA 373 Ca 0.05 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 2kui h ALA 373 Cb 0.99 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2kui h ALA 373 CO 0.10 -0.16 -0.33 0.82 0.00 0.00 0.00 179.25 179.67 2kui h ILE 374 N 0.29 1.28 -0.84 0.00 5.03 -0.73 -2.53 117.51 120.01 2kui h ILE 374 Ca 0.09 -1.49 0.01 0.00 -0.12 0.00 0.00 64.86 63.34 2kui h ILE 374 Cb 0.06 1.36 -0.04 0.00 -3.03 0.00 0.00 36.82 35.17 2kui h ILE 374 CO -0.01 0.49 0.55 0.00 -0.68 0.00 0.00 178.15 178.50 2kui h ALA 375 N 0.94 1.39 -0.35 1.87 0.00 -0.30 0.24 119.26 123.05 2kui h ALA 375 Ca 0.07 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2kui h ALA 375 Cb 0.88 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2kui h ALA 375 CO 0.08 0.56 0.12 1.15 0.00 0.00 0.00 179.25 181.16 2kui h THR 376 N 1.14 1.20 -0.65 0.00 2.02 -0.86 -0.52 112.91 115.24 2kui h THR 376 Ca 0.31 -0.64 -0.06 0.00 0.77 0.00 0.00 66.41 66.78 2kui h THR 376 Cb -0.12 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 2kui h THR 376 CO -0.06 0.22 0.16 -0.07 0.37 0.00 0.00 175.52 176.14 2kui h LEU 377 N 0.41 0.97 -0.84 2.58 3.38 -0.88 -1.85 115.31 119.08 2kui h LEU 377 Ca 0.11 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 2kui h LEU 377 Cb 0.23 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 2kui h LEU 377 CO -0.01 0.93 0.43 -0.61 0.09 0.00 0.00 178.44 179.27 2kui h GLN 378 N 0.98 1.20 -0.00 1.13 5.75 -0.31 -0.04 115.11 123.81 2kui h GLN 378 Ca 0.21 -0.16 -0.03 0.00 -0.15 0.00 0.00 58.65 58.51 2kui h GLN 378 Cb 0.34 -0.22 -0.00 0.00 1.07 0.00 0.00 27.48 28.66 2kui h GLN 378 CO -0.00 0.91 -0.15 -0.91 -2.65 0.00 0.00 178.83 176.02 2kui h ASN 379 N 1.19 0.01 1.09 -0.69 2.35 -0.50 -1.44 115.58 117.58 2kui h ASN 379 Ca 0.29 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.04 2kui h ASN 379 Cb 0.09 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 2kui h ASN 379 CO -0.04 0.16 -0.31 0.54 -1.65 0.00 0.00 177.43 176.12 2kui n ARG 380 N -4.35 0.23 -0.25 0.81 5.12 -0.65 -4.92 116.66 112.65 2kui n ARG 380 Ca -0.02 0.12 0.00 0.00 -1.93 0.00 0.00 57.85 56.02 2kui n ARG 380 Cb 0.22 -1.70 0.00 0.00 -1.16 0.00 0.00 32.46 29.82 2kui n ARG 380 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2kui n GLY 381 N 1.35 0.86 3.86 -0.13 0.00 -0.54 -4.82 105.19 105.77 2kui n GLY 381 Ca 0.05 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 2kui n GLY 381 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kui s PHE 382 N -2.00 3.56 -0.16 1.61 0.40 -0.14 -4.71 117.98 116.54 2kui s PHE 382 Ca 0.00 1.32 -0.10 0.00 -0.60 0.00 0.00 56.93 57.55 2kui s PHE 382 Cb 0.00 -2.72 -0.05 0.00 0.51 0.00 0.00 43.02 40.77 2kui s PHE 382 CO 0.00 -0.53 0.18 0.15 0.70 0.00 0.00 175.22 175.72 2kui s LYS 383 N -4.70 4.02 0.18 0.44 -0.14 0.39 -4.36 119.74 115.56 2kui s LYS 383 Ca 0.56 -0.10 0.10 0.00 -1.36 0.00 0.00 55.97 55.16 2kui s LYS 383 Cb -0.11 -3.36 -0.04 0.00 -1.68 0.00 0.00 37.83 32.64 2kui s LYS 383 CO 0.44 0.41 -0.20 0.96 -0.76 0.00 0.00 175.35 176.21 2kui s ILE 384 N -0.00 2.03 -0.02 2.17 -0.00 -1.26 0.04 121.20 124.15 2kui s ILE 384 Ca 0.12 -1.97 0.01 0.00 -0.00 0.00 0.00 60.65 58.82 2kui s ILE 384 Cb -0.12 -1.95 0.01 0.00 -0.00 0.00 0.00 42.46 40.40 2kui s ILE 384 CO 0.01 -0.24 -0.04 -0.60 -0.00 0.00 0.00 174.94 174.07 2kui s ARG 385 N -2.76 0.57 -0.13 0.37 3.52 0.37 -4.89 118.95 116.00 2kui s ARG 385 Ca 0.18 -0.11 0.01 0.00 -0.13 0.00 0.00 55.73 55.68 2kui s ARG 385 Cb -0.07 -0.60 0.02 0.00 -1.56 0.00 0.00 34.95 32.74 2kui s ARG 385 CO 0.08 -0.01 -0.14 0.99 -0.81 0.00 0.00 175.30 175.41 2kui s THR 386 N 0.49 1.52 -0.23 4.11 2.01 -1.26 -0.06 115.64 122.22 2kui s THR 386 Ca -0.06 -0.62 -0.04 0.00 0.31 0.00 0.00 61.69 61.28 2kui s THR 386 Cb -0.09 -1.42 -0.01 0.00 0.01 0.00 0.00 72.50 70.99 2kui s THR 386 CO -0.00 0.45 -0.02 -0.22 -0.69 0.00 0.00 174.62 174.13 2kui s LEU 387 N 1.32 3.05 -0.09 4.42 1.98 0.62 -4.96 118.68 125.01 2kui s LEU 387 Ca 0.01 -0.43 0.03 0.00 -2.89 0.00 0.00 54.13 50.85 2kui s LEU 387 Cb -0.14 -1.77 0.01 0.00 0.66 0.00 0.00 46.19 44.96 2kui s LEU 387 CO -0.07 -0.04 -0.20 0.00 -1.89 0.00 0.00 176.35 174.15 2kui s GLN 388 N 1.49 2.58 0.04 1.98 0.00 -1.25 -0.27 119.66 124.23 2kui s GLN 388 Ca 0.05 -0.71 0.03 0.00 -0.00 0.00 0.00 55.36 54.73 2kui s GLN 388 Cb -0.15 -2.02 -0.02 0.00 0.00 0.00 0.00 33.01 30.82 2kui s GLN 388 CO -0.02 0.10 -0.09 0.15 0.00 0.00 0.00 175.29 175.42 2kui s LYS 389 N 0.54 0.59 0.06 9.60 1.02 -0.70 -4.84 119.74 126.01 2kui s LYS 389 Ca -0.15 -0.73 -0.31 0.00 0.02 0.00 0.00 55.97 54.80 2kui s LYS 389 Cb -0.17 -0.44 -0.07 0.00 -0.52 0.00 0.00 37.83 36.63 2kui s LYS 389 CO 0.06 0.09 1.42 -2.14 -0.92 0.00 0.00 175.35 173.86 2kui s PRO 390 N -1.43 4.29 -0.25 -1.68 0.02 -1.12 -0.31 135.00 134.53 2kui s PRO 390 Ca -0.07 2.06 -0.35 0.00 0.02 0.00 0.00 61.00 62.66 2kui s PRO 390 Cb -0.09 -3.42 0.16 0.00 0.02 0.00 0.00 34.50 31.17 2kui s PRO 390 CO 0.01 -0.53 1.30 0.34 -0.33 0.00 0.00 177.00 177.79 2kui s ASP 391 N 1.57 -0.08 0.00 2.53 2.15 -0.93 -4.91 116.67 117.01 2kui s ASP 391 Ca 0.65 0.02 0.09 0.00 0.43 0.00 0.00 52.55 53.75 2kui s ASP 391 Cb -0.35 0.08 -0.01 0.00 -0.30 0.00 0.00 42.92 42.34 2kui s ASP 391 CO 0.29 -0.11 0.58 -1.20 -0.17 0.00 0.00 175.17 174.56 2kui n SER 392 N 0.11 1.10 -0.04 -0.34 7.64 -1.26 -4.67 113.62 116.15 2kui n SER 392 Ca 0.02 -1.05 -0.21 0.00 1.01 0.00 0.00 58.87 58.63 2kui n SER 392 Cb 0.58 0.49 -0.13 0.00 -1.01 0.00 0.00 64.21 64.14 2kui n SER 392 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2kui n THR 393 N -0.32 1.68 -3.25 0.44 -1.04 -1.26 -4.90 114.28 105.62 2kui n THR 393 Ca 0.04 -0.52 -0.33 0.00 -2.04 0.00 0.00 64.05 61.19 2kui n THR 393 Cb 0.18 -1.74 -0.06 0.00 -1.82 0.00 0.00 70.33 66.90 2kui n THR 393 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 2kui s ILE 394 N -2.52 4.77 0.48 12.58 -4.36 -1.26 -5.02 121.20 125.87 2kui s ILE 394 Ca -0.27 0.83 -0.21 0.00 -0.26 0.00 0.00 60.65 60.75 2kui s ILE 394 Cb 0.07 -3.67 -0.10 0.00 1.25 0.00 0.00 42.46 40.01 2kui s ILE 394 CO 0.70 -0.02 0.65 -2.65 0.24 0.00 0.00 174.94 173.85 2kui n PRO 395 N 0.05 0.72 -0.63 0.37 -0.02 -1.26 -4.38 135.00 129.85 2kui n PRO 395 Ca 0.00 0.27 -0.31 0.00 -2.02 0.00 0.00 63.50 61.44 2kui n PRO 395 Cb 0.52 -1.72 0.19 0.00 -0.02 0.00 0.00 33.50 32.48 2kui n PRO 395 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2kui n PRO 396 N 0.18 -1.44 0.00 0.52 -0.02 -1.26 -0.17 135.00 132.81 2kui n PRO 396 Ca 0.11 -0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.21 2kui n PRO 396 Cb 0.43 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 2kui n PRO 396 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2kui n ASP 397 N -3.29 0.00 -4.59 2.55 5.75 -1.24 -4.12 116.55 111.60 2kui n ASP 397 Ca 0.05 0.30 -0.41 0.00 -0.01 0.00 0.00 54.79 54.72 2kui n ASP 397 Cb 0.56 -0.30 -0.07 0.00 -1.03 0.00 0.00 41.12 40.28 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 -2.54 3.21 -0.18 2.11 3.76 -1.26 -0.43 115.29 119.96 2kui s HIS 398 Ca 0.00 0.47 -0.29 0.00 -0.15 0.00 0.00 55.06 55.09 2kui s HIS 398 Cb 0.00 -2.90 -0.02 0.00 1.11 0.00 0.00 32.58 30.77 2kui s HIS 398 CO 0.00 -0.45 1.36 0.14 -0.85 0.00 0.00 174.74 174.94 2kui s VAL 399 N 2.47 4.10 -0.06 -0.90 -7.23 -0.15 -4.87 120.40 113.76 2kui s VAL 399 Ca 0.22 1.31 0.14 0.00 -1.81 0.00 0.00 61.98 61.84 2kui s VAL 399 Cb -0.15 -3.92 -0.20 0.00 0.56 0.00 0.00 36.38 32.67 2kui s VAL 399 CO 0.12 -0.20 0.74 -0.29 -0.31 0.00 0.00 175.10 175.15 2kui h ILE 400 N 5.65 0.76 -4.07 -0.62 6.09 -1.86 0.62 117.51 124.08 2kui h ILE 400 Ca -0.29 -2.51 -0.14 0.00 -1.37 0.00 0.00 64.86 60.56 2kui h ILE 400 Cb 1.12 2.31 -0.12 0.00 0.47 0.00 0.00 36.82 40.60 2kui h ILE 400 CO 0.98 0.44 -0.35 -0.83 -3.07 0.00 0.00 178.15 175.32 2kui s GLY 401 N -5.00 0.91 0.48 8.18 0.00 -1.26 -4.47 107.32 106.16 2kui s GLY 401 Ca -0.04 -1.23 0.03 0.00 0.00 0.00 0.00 44.72 43.48 2kui s GLY 401 CO 0.82 -0.97 0.21 -1.30 0.00 0.00 0.00 173.10 171.86 2kui n THR 402 N -0.32 0.00 -3.93 0.90 -2.24 -1.26 -4.79 114.28 102.64 2kui n THR 402 Ca -0.01 -2.04 -0.37 0.00 -2.27 0.00 0.00 64.05 59.37 2kui n THR 402 Cb 0.64 0.14 -0.06 0.00 -2.10 0.00 0.00 70.33 68.94 2kui n THR 402 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2kui s ASP 403 N -3.72 6.26 0.55 3.42 -1.08 -1.26 -4.98 116.67 115.86 2kui s ASP 403 Ca 0.16 0.43 0.45 0.00 -0.52 0.00 0.00 52.55 53.07 2kui s ASP 403 Cb -0.01 -2.01 1.66 0.00 -1.46 0.00 0.00 42.92 41.10 2kui s ASP 403 CO 0.10 0.40 1.66 -0.65 0.52 0.00 0.00 175.17 177.20 2kui h PRO 404 N 5.03 0.01 -0.15 4.34 0.11 -1.96 0.16 132.00 139.54 2kui h PRO 404 Ca -0.54 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 2kui h PRO 404 Cb 1.22 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2kui h PRO 404 CO 0.58 0.00 0.09 0.00 -0.21 0.00 0.00 178.00 178.46 2kui h ALA 405 N 1.18 1.87 0.08 -0.75 0.00 -1.93 0.07 119.26 119.78 2kui h ALA 405 Ca 0.80 -0.02 -0.30 0.00 0.00 0.00 0.00 54.91 55.38 2kui h ALA 405 Cb 3.18 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 20.88 2kui h ALA 405 CO -0.02 0.12 -1.59 0.00 0.00 0.00 0.00 179.25 177.75 2kui h ALA 406 N 1.89 0.43 -0.00 0.00 0.00 -0.99 -3.33 119.26 117.26 2kui h ALA 406 Ca 0.06 -1.22 0.00 0.00 0.00 0.00 0.00 54.91 53.75 2kui h ALA 406 Cb 0.00 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2kui h ALA 406 CO -0.01 1.28 -0.03 0.09 0.00 0.00 0.00 179.25 180.59 2kui n ASN 407 N -3.35 0.36 -4.66 0.00 5.03 -0.75 -0.54 115.26 111.36 2kui n ASN 407 Ca -0.17 -0.86 -0.27 0.00 0.87 0.00 0.00 54.58 54.15 2kui n ASN 407 Cb 1.04 -0.06 -0.08 0.00 -1.02 0.00 0.00 39.78 39.66 2kui n ASN 407 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2kui s THR 408 N -2.20 3.73 -0.33 3.41 2.01 -0.06 -4.92 115.64 117.28 2kui s THR 408 Ca 0.39 -1.35 -0.29 0.00 0.31 0.00 0.00 61.69 60.75 2kui s THR 408 Cb 0.21 -2.85 -0.00 0.00 0.01 0.00 0.00 72.50 69.87 2kui s THR 408 CO 0.40 -0.06 1.43 -0.44 -0.69 0.00 0.00 174.62 175.27 2kui s SER 409 N -2.79 6.44 0.34 3.53 0.01 -1.26 -4.28 113.70 115.69 2kui s SER 409 Ca 0.27 1.14 0.07 0.00 1.31 0.00 0.00 55.95 58.74 2kui s SER 409 Cb -0.10 -2.54 -0.07 0.00 0.21 0.00 0.00 66.02 63.53 2kui s SER 409 CO 0.18 -1.29 -0.04 0.68 0.41 0.00 0.00 173.24 173.18 2kui s VAL 410 N 5.10 1.89 0.24 3.43 -7.23 0.37 -4.69 120.40 119.52 2kui s VAL 410 Ca 0.62 -2.11 -0.30 0.00 -1.81 0.00 0.00 61.98 58.39 2kui s VAL 410 Cb -0.17 -2.69 -0.09 0.00 0.56 0.00 0.00 36.38 33.98 2kui s VAL 410 CO 0.29 -0.16 1.07 -0.44 -0.31 0.00 0.00 175.10 175.55 2kui s SER 411 N -3.57 7.34 -0.25 4.85 0.01 -1.26 -0.55 113.70 120.27 2kui s SER 411 Ca 0.33 2.16 -0.28 0.00 1.31 0.00 0.00 55.95 59.47 2kui s SER 411 Cb 0.05 -2.62 -0.05 0.00 0.21 0.00 0.00 66.02 63.62 2kui s SER 411 CO 0.15 -0.11 2.17 0.00 0.41 0.00 0.00 173.24 175.87 2kui s ALA 412 N -0.89 2.68 0.00 1.44 0.00 -1.24 -3.77 121.76 119.97 2kui s ALA 412 Ca 0.45 0.65 0.00 0.00 0.00 0.00 0.00 51.96 53.07 2kui s ALA 412 Cb -0.30 -4.08 0.00 0.00 0.00 0.00 0.00 23.12 18.74 2kui s ALA 412 CO 0.38 -2.88 0.00 0.41 0.00 0.00 0.00 175.76 173.67 2kui n GLY 413 N 5.73 0.60 0.00 0.00 0.00 -1.26 -5.05 105.19 105.21 2kui n GLY 413 Ca 0.29 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2kui n GLY 413 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kui n ASP 414 N 0.00 0.45 -4.57 1.61 -0.08 -1.25 -4.93 116.55 107.79 2kui n ASP 414 Ca 0.00 -0.86 -0.34 0.00 -1.51 0.00 0.00 54.79 52.08 2kui n ASP 414 Cb 0.00 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.35 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 -1.57 3.70 -0.22 -0.67 2.02 -1.25 -0.46 118.70 120.24 2kui s GLU 415 Ca 0.00 -0.45 0.01 0.00 0.02 0.00 0.00 54.97 54.56 2kui s GLU 415 Cb 0.00 -3.00 0.03 0.00 0.10 0.00 0.00 34.13 31.26 2kui s GLU 415 CO 0.00 0.31 -0.15 0.42 0.02 0.00 0.00 175.26 175.86 2kui s ILE 416 N 0.22 2.21 -0.18 -1.63 -1.09 0.11 -4.90 121.20 115.93 2kui s ILE 416 Ca 0.00 -1.20 -0.11 0.00 -2.23 0.00 0.00 60.65 57.12 2kui s ILE 416 Cb -0.13 -2.09 -0.05 0.00 -1.58 0.00 0.00 42.46 38.61 2kui s ILE 416 CO 0.02 0.30 0.18 0.42 -1.23 0.00 0.00 174.94 174.62 2kui s THR 417 N 1.23 5.38 -0.04 2.92 -4.23 -1.26 -0.48 115.64 119.16 2kui s THR 417 Ca -0.01 0.30 0.04 0.00 -1.18 0.00 0.00 61.69 60.85 2kui s THR 417 Cb -0.16 -3.51 -0.00 0.00 1.34 0.00 0.00 72.50 70.17 2kui s THR 417 CO -0.09 0.44 -0.16 0.54 -0.54 0.00 0.00 174.62 174.81 2kui s VAL 418 N 0.26 1.33 -0.27 2.29 0.11 0.92 -4.56 120.40 120.49 2kui s VAL 418 Ca 0.11 -0.66 -0.10 0.00 -2.93 0.00 0.00 61.98 58.40 2kui s VAL 418 Cb -0.12 -1.15 -0.05 0.00 -1.53 0.00 0.00 36.38 33.54 2kui s VAL 418 CO 0.00 0.39 0.16 0.54 -3.33 0.00 0.00 175.10 172.86 2kui s ASN 419 N 0.09 5.87 0.03 3.54 2.20 -1.26 -0.28 114.94 125.14 2kui s ASN 419 Ca -0.04 -0.03 0.06 0.00 -0.94 0.00 0.00 52.86 51.91 2kui s ASN 419 Cb -0.11 -2.08 -0.02 0.00 -2.00 0.00 0.00 41.25 37.03 2kui s ASN 419 CO 0.02 -0.03 -0.18 -0.69 -2.94 0.00 0.00 177.10 173.28 2kui s VAL 420 N 1.62 1.46 -0.22 3.54 1.01 0.63 -4.35 120.40 124.09 2kui s VAL 420 Ca 0.07 -1.07 -0.09 0.00 0.00 0.00 0.00 61.98 60.88 2kui s VAL 420 Cb -0.15 -1.28 -0.05 0.00 0.00 0.00 0.00 36.38 34.90 2kui s VAL 420 CO 0.09 0.18 0.12 -0.94 0.00 0.00 0.00 175.10 174.55 2kui s SER 421 N -1.05 5.96 -0.31 3.32 1.04 0.76 -1.73 113.70 121.70 2kui s SER 421 Ca 0.06 0.11 0.01 0.00 0.48 0.00 0.00 55.95 56.61 2kui s SER 421 Cb -0.08 -2.06 0.07 0.00 0.10 0.00 0.00 66.02 64.06 2kui s SER 421 CO 0.01 0.11 0.00 0.28 0.98 0.00 0.00 173.24 174.63 2kui s THR 422 N 0.75 2.56 0.00 2.02 -1.32 0.58 -3.69 115.64 116.54 2kui s THR 422 Ca 0.06 -1.81 0.00 0.00 -1.21 0.00 0.00 61.69 58.73 2kui s THR 422 Cb -0.13 -2.63 0.00 0.00 -1.51 0.00 0.00 72.50 68.23 2kui s THR 422 CO 0.02 -0.29 0.00 0.61 -2.21 0.00 0.00 174.62 172.75 2kui n GLY 423 N 4.46 0.51 3.80 6.08 0.00 -1.26 -2.78 105.19 116.00 2kui n GLY 423 Ca -0.08 -1.23 -0.32 0.00 0.00 0.00 0.00 46.02 44.39 2kui n GLY 423 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2kui s PRO 424 N -4.15 2.94 0.67 1.61 0.02 -1.26 -2.18 135.00 132.64 2kui s PRO 424 Ca 0.00 1.12 -0.08 0.00 0.02 0.00 0.00 61.00 62.06 2kui s PRO 424 Cb 0.00 -1.98 0.03 0.00 0.02 0.00 0.00 34.50 32.56 2kui s PRO 424 CO 0.00 -1.11 1.01 -1.21 -0.33 0.00 0.00 177.00 175.36 2kui s GLU 425 N -4.59 2.68 0.45 5.54 2.02 -1.26 -4.81 118.70 118.72 2kui s GLU 425 Ca 0.61 0.10 -0.05 0.00 0.02 0.00 0.00 54.97 55.65 2kui s GLU 425 Cb -0.16 -2.15 -0.04 0.00 0.10 0.00 0.00 34.13 31.89 2kui s GLU 425 CO 0.48 -0.99 0.75 -0.65 0.02 0.00 0.00 175.26 174.87 2kui s GLN 426 N -5.21 3.57 0.17 1.61 -0.21 -1.26 -4.76 119.66 113.57 2kui s GLN 426 Ca 0.57 0.17 0.11 0.00 0.02 0.00 0.00 55.36 56.23 2kui s GLN 426 Cb -0.11 -2.42 -0.04 0.00 1.00 0.00 0.00 33.01 31.44 2kui s GLN 426 CO 0.47 -0.13 -0.24 1.03 -2.12 0.00 0.00 175.29 174.30 2kui s ARG 427 N -4.55 1.43 0.12 2.91 1.81 0.49 -4.90 118.95 116.27 2kui s ARG 427 Ca 0.47 -1.44 -0.22 0.00 -1.72 0.00 0.00 55.73 52.82 2kui s ARG 427 Cb -0.10 -1.76 -0.07 0.00 -0.45 0.00 0.00 34.95 32.57 2kui s ARG 427 CO 0.42 0.39 0.67 -1.83 -0.68 0.00 0.00 175.30 174.27 2kui s GLU 428 N -2.47 4.36 -0.31 3.54 1.03 -1.26 0.32 118.70 123.91 2kui s GLU 428 Ca 0.17 0.93 -0.29 0.00 0.03 0.00 0.00 54.97 55.81 2kui s GLU 428 Cb -0.08 -3.22 0.02 0.00 -0.80 0.00 0.00 34.13 30.04 2kui s GLU 428 CO 0.08 0.59 1.08 0.42 -1.33 0.00 0.00 175.26 176.11 2kui s ILE 429 N -1.16 4.50 0.46 1.83 1.01 -1.09 -4.89 121.20 121.86 2kui s ILE 429 Ca 0.33 1.74 -0.22 0.00 0.00 0.00 0.00 60.65 62.49 2kui s ILE 429 Cb -0.21 -4.40 -0.08 0.00 0.01 0.00 0.00 42.46 37.79 2kui s ILE 429 CO 0.22 -0.46 1.12 -2.16 0.00 0.00 0.00 174.94 173.66 2kui s PRO 430 N 3.65 3.79 -0.10 2.79 0.04 -1.26 -4.39 135.00 139.51 2kui s PRO 430 Ca 0.46 1.65 -0.17 0.00 0.04 0.00 0.00 61.00 62.97 2kui s PRO 430 Cb -0.13 -2.34 -0.05 0.00 0.04 0.00 0.00 34.50 32.03 2kui s PRO 430 CO 0.15 -0.50 0.45 0.34 0.04 0.00 0.00 177.00 177.49 2kui s ASP 431 N -1.54 6.70 0.14 6.66 -1.08 -1.26 -4.92 116.67 121.36 2kui s ASP 431 Ca 0.64 0.83 0.04 0.00 -0.52 0.00 0.00 52.55 53.54 2kui s ASP 431 Cb -0.25 -2.27 -0.04 0.00 -1.46 0.00 0.00 42.92 38.89 2kui s ASP 431 CO 0.30 0.07 -0.10 0.54 0.52 0.00 0.00 175.17 176.50 2kui s VAL 432 N 0.29 1.08 0.62 1.11 0.11 -1.26 -5.11 120.40 117.24 2kui s VAL 432 Ca 0.25 -2.01 -0.17 0.00 -2.93 0.00 0.00 61.98 57.12 2kui s VAL 432 Cb -0.15 -1.79 -0.02 0.00 -1.53 0.00 0.00 36.38 32.89 2kui s VAL 432 CO 0.11 -0.75 1.13 -0.44 -3.33 0.00 0.00 175.10 171.82 2kui s SER 433 N -3.10 5.21 0.27 3.54 0.01 -1.26 -4.95 113.70 113.42 2kui s SER 433 Ca 0.15 2.13 0.04 0.00 1.31 0.00 0.00 55.95 59.58 2kui s SER 433 Cb 0.03 -2.57 0.38 0.00 0.21 0.00 0.00 66.02 64.07 2kui s SER 433 CO -0.00 -1.57 1.67 0.71 0.41 0.00 0.00 173.24 174.46 2kui h THR 434 N 0.43 1.31 0.00 1.44 1.35 -1.99 -2.37 112.91 113.09 2kui h THR 434 Ca -0.48 -1.54 0.00 0.00 -0.55 0.00 0.00 66.41 63.84 2kui h THR 434 Cb 1.26 1.64 0.00 0.00 -1.73 0.00 0.00 68.15 69.32 2kui h THR 434 CO 0.55 0.47 -0.62 0.00 -0.25 0.00 0.00 175.52 175.66 2kui n LEU 435 N -4.03 0.58 -1.89 3.87 -0.00 -1.26 -0.12 117.00 114.15 2kui n LEU 435 Ca -0.01 0.02 -0.14 0.00 -0.00 0.00 0.00 56.01 55.88 2kui n LEU 435 Cb 0.49 -0.20 0.00 0.00 -0.00 0.00 0.00 43.42 43.71 2kui n LEU 435 CO 0.43 0.08 1.25 0.41 -0.00 0.00 0.00 177.39 179.56 2kui n THR 436 N -1.69 2.69 -0.23 1.47 -1.04 -0.89 -4.47 114.28 110.11 2kui n THR 436 Ca 0.04 -1.56 0.07 0.00 -2.04 0.00 0.00 64.05 60.57 2kui n THR 436 Cb 0.37 -1.46 0.33 0.00 -1.82 0.00 0.00 70.33 67.76 2kui n THR 436 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 2kui h TYR 437 N 1.68 0.84 -0.90 -1.42 3.20 -1.75 -0.22 116.97 118.40 2kui h TYR 437 Ca 0.23 0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.23 2kui h TYR 437 Cb 0.95 -0.27 -0.08 0.00 1.54 0.00 0.00 36.73 38.87 2kui h TYR 437 CO 0.84 0.41 0.54 0.00 -1.64 0.00 0.00 178.16 178.30 2kui h ALA 438 N 1.58 1.31 -0.20 1.82 0.00 -1.96 -0.34 119.26 121.48 2kui h ALA 438 Ca 0.37 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.16 2kui h ALA 438 Cb 0.37 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2kui h ALA 438 CO -0.14 0.16 -0.48 1.49 0.00 0.00 0.00 179.25 180.27 2kui h GLU 439 N 0.88 0.52 0.14 0.00 4.81 -1.42 -2.39 114.58 117.11 2kui h GLU 439 Ca 0.44 -0.30 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2kui h GLU 439 Cb 0.41 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.81 2kui h GLU 439 CO -0.25 0.89 -0.07 0.00 -0.73 0.00 0.00 179.01 178.85 2kui h ALA 440 N 1.06 -0.18 -0.64 2.92 0.00 -0.66 -0.54 119.26 121.22 2kui h ALA 440 Ca 0.02 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 2kui h ALA 440 Cb 1.00 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2kui h ALA 440 CO 0.09 -0.58 0.06 -0.39 0.00 0.00 0.00 179.25 178.43 2kui h VAL 441 N -0.23 1.26 -0.25 0.00 -1.51 -1.06 -0.53 116.25 113.93 2kui h VAL 441 Ca -0.02 -1.08 -0.11 0.00 -1.23 0.00 0.00 66.70 64.26 2kui h VAL 441 Cb 0.18 0.70 -0.01 0.00 -2.13 0.00 0.00 31.29 30.03 2kui h VAL 441 CO 0.03 0.40 -0.29 0.07 -1.23 0.00 0.00 177.57 176.55 2kui h LYS 442 N 1.00 0.50 -0.58 5.19 5.09 -1.32 -0.26 116.57 126.20 2kui h LYS 442 Ca 0.19 -0.21 -0.09 0.00 0.09 0.00 0.00 60.65 60.63 2kui h LYS 442 Cb 0.49 -0.02 -0.02 0.00 0.10 0.00 0.00 32.23 32.78 2kui h LYS 442 CO 0.02 0.74 0.01 -0.22 -2.09 0.00 0.00 179.45 177.91 2kui h LYS 443 N 0.44 1.02 -0.15 0.07 3.11 -0.63 0.41 116.57 120.84 2kui h LYS 443 Ca 0.06 -0.32 -0.09 0.00 -2.81 0.00 0.00 60.65 57.49 2kui h LYS 443 Cb 0.73 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.85 2kui h LYS 443 CO 0.06 1.01 -0.30 -0.07 -2.81 0.00 0.00 179.45 177.33 2kui h LEU 444 N 0.91 0.30 -0.28 5.20 3.38 -0.84 -0.87 115.31 123.11 2kui h LEU 444 Ca 0.17 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2kui h LEU 444 Cb 0.54 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2kui h LEU 444 CO 0.03 0.60 -0.30 0.74 0.09 0.00 0.00 178.44 179.60 2kui h THR 445 N 0.26 1.30 0.00 0.22 2.02 -0.53 0.49 112.91 116.67 2kui h THR 445 Ca 0.04 -1.47 0.00 0.00 0.77 0.00 0.00 66.41 65.75 2kui h THR 445 Cb 0.67 1.59 0.00 0.00 -1.74 0.00 0.00 68.15 68.68 2kui h THR 445 CO 0.05 0.47 0.00 0.00 0.37 0.00 0.00 175.52 176.41 2kui h ALA 446 N 0.70 1.00 -0.11 6.16 0.00 -0.63 -2.04 119.26 124.33 2kui h ALA 446 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2kui h ALA 446 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2kui h ALA 446 CO 0.07 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.32 2kui n ALA 447 N -1.84 2.54 0.00 0.00 0.00 -0.36 -4.96 120.51 115.90 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 0.25 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2kui n ALA 447 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 448 N 0.95 2.01 0.46 0.00 0.00 -0.77 -4.64 105.19 103.21 2kui n GLY 448 Ca 0.14 -0.65 -0.15 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 -1.55 -2.78 1.61 -0.00 -1.74 -3.46 116.94 109.01 2kui h PHE 449 Ca 0.00 0.06 -0.41 0.00 -0.00 0.00 0.00 57.97 57.62 2kui h PHE 449 Cb 0.00 0.69 -0.03 0.00 -0.00 0.00 0.00 35.95 36.61 2kui h PHE 449 CO 0.00 -0.55 -0.51 0.41 -0.00 0.00 0.00 178.31 177.66 2kui n GLY 450 N -1.44 -0.31 3.41 6.09 0.00 0.13 -4.90 105.19 108.17 2kui n GLY 450 Ca -0.06 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 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 -4.93 2.97 0.02 1.61 1.81 -1.26 -4.77 118.95 114.39 2kui s ARG 451 Ca 0.00 -0.98 -0.02 0.00 -1.72 0.00 0.00 55.73 53.00 2kui s ARG 451 Cb 0.00 -3.74 -0.01 0.00 -0.45 0.00 0.00 34.95 30.75 2kui s ARG 451 CO 0.00 -0.64 0.02 -0.59 -0.68 0.00 0.00 175.30 173.41 2kui s PHE 452 N 1.59 0.19 0.02 -0.53 -0.12 -1.26 -1.68 117.98 116.20 2kui s PHE 452 Ca 0.03 -0.41 0.02 0.00 -0.05 0.00 0.00 56.93 56.52 2kui s PHE 452 Cb -0.19 -0.15 -0.02 0.00 -0.63 0.00 0.00 43.02 42.04 2kui s PHE 452 CO 0.07 -0.22 -0.06 0.15 -0.05 0.00 0.00 175.22 175.11 2kui s LYS 453 N -1.47 0.44 -0.13 1.99 1.02 -0.18 -4.92 119.74 116.50 2kui s LYS 453 Ca -0.15 -0.55 0.02 0.00 0.02 0.00 0.00 55.97 55.31 2kui s LYS 453 Cb -0.09 -0.25 -0.00 0.00 -0.52 0.00 0.00 37.83 36.97 2kui s LYS 453 CO -0.00 0.05 -0.18 -1.14 -0.92 0.00 0.00 175.35 173.15 2kui s GLN 454 N -1.09 3.19 0.19 1.68 0.74 -1.26 0.21 119.66 123.33 2kui s GLN 454 Ca -0.07 -0.79 0.10 0.00 0.05 0.00 0.00 55.36 54.65 2kui s GLN 454 Cb -0.07 -2.49 -0.04 0.00 1.10 0.00 0.00 33.01 31.50 2kui s GLN 454 CO 0.00 0.14 -0.16 0.00 -0.55 0.00 0.00 175.29 174.72 2kui s ALA 455 N 0.49 2.78 -0.03 1.58 0.00 0.10 -4.94 121.76 121.74 2kui s ALA 455 Ca -0.12 -1.57 0.05 0.00 0.00 0.00 0.00 51.96 50.32 2kui s ALA 455 Cb -0.17 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.40 2kui s ALA 455 CO 0.05 0.44 -0.19 0.54 0.00 0.00 0.00 175.76 176.60 2kui s ASN 456 N -2.83 2.28 0.00 0.00 2.20 -1.26 0.10 114.94 115.44 2kui s ASN 456 Ca 0.24 -0.36 0.01 0.00 -0.94 0.00 0.00 52.86 51.80 2kui s ASN 456 Cb -0.08 -0.44 -0.01 0.00 -2.00 0.00 0.00 41.25 38.73 2kui s ASN 456 CO 0.13 0.20 -0.03 -0.55 -2.94 0.00 0.00 177.10 173.91 2kui s SER 457 N -0.23 0.35 -0.01 3.54 0.15 -0.15 -4.93 113.70 112.42 2kui s SER 457 Ca 0.02 -0.13 -0.30 0.00 0.70 0.00 0.00 55.95 56.24 2kui s SER 457 Cb -0.10 -0.02 -0.05 0.00 -1.71 0.00 0.00 66.02 64.14 2kui s SER 457 CO 0.01 -0.02 1.43 -2.16 1.20 0.00 0.00 173.24 173.70 2kui s PRO 458 N -0.32 4.26 0.37 5.44 0.04 -1.24 -0.22 135.00 143.34 2kui s PRO 458 Ca -0.01 1.99 -0.06 0.00 0.04 0.00 0.00 61.00 62.95 2kui s PRO 458 Cb -0.03 -3.63 0.02 0.00 0.04 0.00 0.00 34.50 30.91 2kui s PRO 458 CO -0.00 -0.62 0.60 -1.12 0.04 0.00 0.00 177.00 175.89 2kui s SER 459 N 2.06 0.73 0.27 6.66 0.01 -0.78 -4.89 113.70 117.77 2kui s SER 459 Ca 0.65 -1.44 -0.28 0.00 1.31 0.00 0.00 55.95 56.18 2kui s SER 459 Cb -0.31 0.75 -0.14 0.00 0.21 0.00 0.00 66.02 66.52 2kui s SER 459 CO 0.26 -1.47 0.99 1.07 0.41 0.00 0.00 173.24 174.50 2kui n THR 460 N -0.58 1.89 -0.08 1.44 5.66 -1.26 -4.61 114.28 116.74 2kui n THR 460 Ca -0.02 -0.47 0.25 0.00 -3.05 0.00 0.00 64.05 60.76 2kui n THR 460 Cb 0.61 -0.92 0.72 0.00 -1.55 0.00 0.00 70.33 69.19 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 2.06 0.00 0.00 1.09 0.13 -1.94 -0.11 132.00 133.23 2kui h PRO 461 Ca -0.39 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.73 2kui h PRO 461 Cb 1.35 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.48 2kui h PRO 461 CO 0.61 0.00 -0.05 1.05 -0.23 0.00 0.00 178.00 179.38 2kui h GLU 462 N 0.00 0.00 0.00 0.86 4.11 -1.99 -2.59 114.58 114.97 2kui h GLU 462 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.77 2kui h GLU 462 Cb 1.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.75 2kui h GLU 462 CO -0.00 0.05 -1.14 1.28 0.07 0.00 0.00 179.01 179.27 2kui n LEU 463 N -3.20 0.56 -4.71 3.06 4.77 -0.07 -4.91 117.00 112.49 2kui n LEU 463 Ca -0.00 -0.34 -0.42 0.00 -0.03 0.00 0.00 56.01 55.22 2kui n LEU 463 Cb 0.29 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 2kui n LEU 463 CO 0.28 0.14 1.40 -0.69 -1.33 0.00 0.00 177.39 177.19 2kui s VAL 464 N -2.83 2.36 0.00 4.08 1.01 -0.98 -1.67 120.40 122.37 2kui s VAL 464 Ca 0.02 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.10 2kui s VAL 464 Cb 0.13 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.44 2kui s VAL 464 CO 0.72 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.44 2kui n GLY 465 N 4.07 2.25 3.60 4.51 0.00 0.57 -4.94 105.19 115.25 2kui n GLY 465 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 2kui n GLY 465 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kui s LYS 466 N -0.78 1.95 0.37 1.61 3.01 -0.67 -4.91 119.74 120.31 2kui s LYS 466 Ca 0.00 -1.94 -0.26 0.00 -1.01 0.00 0.00 55.97 52.76 2kui s LYS 466 Cb 0.00 -1.76 -0.09 0.00 -1.01 0.00 0.00 37.83 34.97 2kui s LYS 466 CO 0.00 0.06 1.13 0.08 0.51 0.00 0.00 175.35 177.14 2kui s VAL 467 N -2.62 3.33 -0.16 3.17 1.01 0.82 -0.79 120.40 125.16 2kui s VAL 467 Ca 0.34 1.15 0.15 0.00 0.00 0.00 0.00 61.98 63.62 2kui s VAL 467 Cb 0.04 -3.66 -0.24 0.00 0.00 0.00 0.00 36.38 32.52 2kui s VAL 467 CO 0.18 0.14 0.20 -0.38 0.00 0.00 0.00 175.10 175.23 2kui n ILE 468 N 0.32 1.46 -3.64 2.22 5.41 0.91 -4.67 119.36 121.38 2kui n ILE 468 Ca 0.03 -0.82 0.00 0.00 1.00 0.00 0.00 62.75 62.96 2kui n ILE 468 Cb 0.47 -0.71 0.00 0.00 -0.71 0.00 0.00 39.64 38.69 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 1.75 -0.47 3.51 7.39 0.00 -1.15 -5.05 105.19 111.16 2kui n GLY 469 Ca -0.30 -1.10 -0.31 0.00 0.00 0.00 0.00 46.02 44.31 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 -3.08 3.05 -0.05 2.61 -4.23 -1.26 -1.87 115.64 110.81 2kui s THR 470 Ca 0.00 -1.18 -0.22 0.00 -1.18 0.00 0.00 61.69 59.11 2kui s THR 470 Cb 0.00 -2.34 -0.16 0.00 1.34 0.00 0.00 72.50 71.34 2kui s THR 470 CO 0.00 0.27 0.90 -1.13 -0.54 0.00 0.00 174.62 174.12 2kui h ASN 471 N 4.23 -0.16 -3.37 3.99 -0.73 -1.61 -3.42 115.58 114.51 2kui h ASN 471 Ca -0.48 -0.39 -0.52 0.00 1.87 0.00 0.00 56.30 56.77 2kui h ASN 471 Cb 1.16 0.04 0.04 0.00 0.27 0.00 0.00 38.32 39.84 2kui h ASN 471 CO 0.49 0.40 0.70 -2.16 -0.37 0.00 0.00 177.43 176.50 2kui s PRO 472 N -3.45 4.33 0.35 6.67 0.04 -1.26 -4.96 135.00 136.73 2kui s PRO 472 Ca -0.13 2.16 -0.28 0.00 0.04 0.00 0.00 61.00 62.79 2kui s PRO 472 Cb 0.00 -3.16 -0.11 0.00 0.04 0.00 0.00 34.50 31.28 2kui s PRO 472 CO 0.50 -0.33 1.46 -2.14 0.04 0.00 0.00 177.00 176.53 2kui s PRO 473 N -0.19 4.17 0.00 0.56 0.02 -1.26 -4.86 135.00 133.44 2kui s PRO 473 Ca 0.58 2.48 0.00 0.00 0.02 0.00 0.00 61.00 64.08 2kui s PRO 473 Cb -0.39 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.13 2kui s PRO 473 CO 0.40 -0.46 0.40 0.00 -0.33 0.00 0.00 177.00 177.01 2kui n ALA 474 N 0.81 2.19 0.12 -1.55 0.00 -1.26 -1.61 120.51 119.21 2kui n ALA 474 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.52 2kui n ALA 474 Cb 0.40 -1.00 -0.09 0.00 0.00 0.00 0.00 19.45 18.76 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 0.10 1.89 -4.91 0.00 5.03 -1.26 -4.52 115.26 111.58 2kui n ASN 475 Ca 0.00 -0.18 -0.25 0.00 0.87 0.00 0.00 54.58 55.02 2kui n ASN 475 Cb 0.20 1.41 0.06 0.00 -1.02 0.00 0.00 39.78 40.43 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 -2.65 2.22 -0.19 3.52 -1.52 -0.64 -4.90 119.66 115.51 2kui s GLN 476 Ca -0.02 -0.41 -0.06 0.00 -1.95 0.00 0.00 55.36 52.92 2kui s GLN 476 Cb 0.08 -2.24 -0.03 0.00 -0.22 0.00 0.00 33.01 30.59 2kui s GLN 476 CO 0.49 -1.15 0.03 0.99 -0.25 0.00 0.00 175.29 175.39 2kui s THR 477 N -3.15 4.33 0.01 -0.19 2.01 -1.26 -2.68 115.64 114.72 2kui s THR 477 Ca 0.60 -0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.42 2kui s THR 477 Cb -0.10 -2.96 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 2kui s THR 477 CO 0.43 0.44 0.05 -0.94 -0.69 0.00 0.00 174.62 173.91 2kui s SER 478 N 0.73 5.43 0.48 3.53 1.04 0.15 -4.90 113.70 120.15 2kui s SER 478 Ca 0.02 0.05 -0.02 0.00 0.48 0.00 0.00 55.95 56.48 2kui s SER 478 Cb -0.14 -1.49 -0.01 0.00 0.10 0.00 0.00 66.02 64.48 2kui s SER 478 CO 0.02 0.26 0.74 0.00 0.98 0.00 0.00 173.24 175.23 2kui s ALA 479 N -1.19 3.55 0.08 5.32 0.00 -1.26 -0.38 121.76 127.88 2kui s ALA 479 Ca 0.23 -0.81 0.32 0.00 0.00 0.00 0.00 51.96 51.69 2kui s ALA 479 Cb -0.12 -2.36 1.25 0.00 0.00 0.00 0.00 23.12 21.89 2kui s ALA 479 CO 0.14 -0.42 1.94 0.82 0.00 0.00 0.00 175.76 178.24 2kui h ILE 480 N 0.27 0.08 -0.08 0.00 5.03 -1.88 -1.70 117.51 119.23 2kui h ILE 480 Ca -0.47 -0.62 0.00 0.00 -0.12 0.00 0.00 64.86 63.65 2kui h ILE 480 Cb 1.24 1.57 0.00 0.00 -3.03 0.00 0.00 36.82 36.60 2kui h ILE 480 CO 0.60 0.03 0.00 0.35 -0.68 0.00 0.00 178.15 178.45 2kui n THR 481 N -3.14 0.08 -4.21 -0.27 -2.24 -1.26 -4.25 114.28 98.99 2kui n THR 481 Ca 0.01 -0.37 -0.35 0.00 -2.27 0.00 0.00 64.05 61.06 2kui n THR 481 Cb 0.33 0.78 -0.09 0.00 -2.10 0.00 0.00 70.33 69.26 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 -1.88 5.54 -0.18 3.42 2.47 -0.64 -5.10 114.94 118.57 2kui s ASN 482 Ca 0.34 0.20 -0.05 0.00 0.42 0.00 0.00 52.86 53.78 2kui s ASN 482 Cb 0.20 -1.69 -0.03 0.00 -1.45 0.00 0.00 41.25 38.28 2kui s ASN 482 CO 0.31 0.35 -0.00 0.54 -3.72 0.00 0.00 177.10 174.58 2kui s VAL 483 N -0.69 4.04 -0.01 -5.21 0.11 -1.26 -4.60 120.40 112.78 2kui s VAL 483 Ca 0.11 -0.29 -0.11 0.00 -2.93 0.00 0.00 61.98 58.76 2kui s VAL 483 Cb -0.12 -2.81 -0.05 0.00 -1.53 0.00 0.00 36.38 31.87 2kui s VAL 483 CO 0.02 0.45 0.33 0.68 -3.33 0.00 0.00 175.10 173.26 2kui s VAL 484 N 0.71 5.18 -0.19 2.04 -7.23 -0.67 -4.96 120.40 115.29 2kui s VAL 484 Ca -0.00 0.54 -0.04 0.00 -1.81 0.00 0.00 61.98 60.67 2kui s VAL 484 Cb -0.14 -3.61 -0.02 0.00 0.56 0.00 0.00 36.38 33.16 2kui s VAL 484 CO 0.02 0.51 -0.02 -0.51 -0.31 0.00 0.00 175.10 174.78 2kui s ILE 485 N -1.16 3.81 -0.15 -0.62 -1.16 -1.26 -1.01 121.20 119.65 2kui s ILE 485 Ca 0.24 -0.37 -0.01 0.00 -0.51 0.00 0.00 60.65 60.00 2kui s ILE 485 Cb -0.15 -2.70 -0.02 0.00 0.61 0.00 0.00 42.46 40.20 2kui s ILE 485 CO 0.13 0.45 -0.10 -0.63 -2.81 0.00 0.00 174.94 171.98 2kui s ILE 486 N 0.84 3.29 -0.20 2.00 1.01 0.13 -1.41 121.20 126.86 2kui s ILE 486 Ca -0.00 -0.57 -0.07 0.00 0.00 0.00 0.00 60.65 60.01 2kui s ILE 486 Cb -0.14 -2.41 -0.04 0.00 0.01 0.00 0.00 42.46 39.88 2kui s ILE 486 CO 0.02 0.50 0.05 -0.51 0.00 0.00 0.00 174.94 175.00 2kui s ILE 487 N 0.50 4.52 0.13 2.92 2.07 -0.78 0.03 121.20 130.60 2kui s ILE 487 Ca -0.07 -0.12 0.07 0.00 -1.41 0.00 0.00 60.65 59.12 2kui s ILE 487 Cb -0.15 -3.05 -0.04 0.00 0.13 0.00 0.00 42.46 39.35 2kui s ILE 487 CO 0.04 0.43 -0.05 0.68 -1.91 0.00 0.00 174.94 174.13 2kui s VAL 488 N 0.71 3.59 0.22 4.00 -7.23 0.12 -0.06 120.40 121.74 2kui s VAL 488 Ca 0.03 -1.32 -0.27 0.00 -1.81 0.00 0.00 61.98 58.61 2kui s VAL 488 Cb -0.13 -2.74 -0.09 0.00 0.56 0.00 0.00 36.38 33.98 2kui s VAL 488 CO 0.02 0.01 0.87 -0.83 -0.31 0.00 0.00 175.10 174.86 2kui s GLY 489 N -2.55 2.98 0.07 2.32 0.00 0.03 -0.98 107.32 109.19 2kui s GLY 489 Ca 0.25 0.48 -0.04 0.00 0.00 0.00 0.00 44.72 45.41 2kui s GLY 489 CO 0.16 1.00 0.05 -0.45 0.00 0.00 0.00 173.10 173.87 2kui s SER 490 N -1.25 0.35 0.00 1.64 0.15 0.70 -0.32 113.70 114.98 2kui s SER 490 Ca 0.40 -0.90 0.00 0.00 0.70 0.00 0.00 55.95 56.15 2kui s SER 490 Cb -0.24 0.26 0.00 0.00 -1.71 0.00 0.00 66.02 64.33 2kui s SER 490 CO 0.28 -0.66 0.00 0.61 1.20 0.00 0.00 173.24 174.68 2kui n GLY 491 N 0.04 -0.50 3.72 9.45 0.00 -1.26 -1.87 105.19 114.77 2kui n GLY 491 Ca -0.14 -0.17 -0.39 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.38 4.38 -1.41 1.61 0.04 -1.26 -4.37 135.00 132.60 2kui s PRO 492 Ca 0.00 0.64 -0.10 0.00 0.04 0.00 0.00 61.00 61.58 2kui s PRO 492 Cb 0.00 -3.45 0.07 0.00 0.04 0.00 0.00 34.50 31.16 2kui s PRO 492 CO 0.00 0.10 2.32 0.00 0.04 0.00 0.00 177.00 179.46 2kui n ALA 493 N 3.77 6.21 -2.39 8.56 0.00 -1.26 -4.89 120.51 130.51 2kui n ALA 493 Ca -0.04 -3.98 -0.31 0.00 0.00 0.00 0.00 53.44 49.11 2kui n ALA 493 Cb 0.51 -3.17 -0.14 0.00 0.00 0.00 0.00 19.45 16.65 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 1.20 2.45 -0.01 0.00 -4.23 -1.26 -1.81 115.64 111.98 2kui s THR 494 Ca 0.51 -1.20 -0.10 0.00 -1.18 0.00 0.00 61.69 59.73 2kui s THR 494 Cb 0.15 -1.97 0.01 0.00 1.34 0.00 0.00 72.50 72.03 2kui s THR 494 CO -0.06 0.42 0.20 -0.75 -0.54 0.00 0.00 174.62 173.89 2kui s LYS 495 N -1.15 0.51 -0.07 3.99 2.20 0.56 -4.92 119.74 120.87 2kui s LYS 495 Ca 0.12 -0.26 -0.22 0.00 -0.36 0.00 0.00 55.97 55.25 2kui s LYS 495 Cb -0.10 0.22 -0.04 0.00 -1.51 0.00 0.00 37.83 36.40 2kui s LYS 495 CO 0.02 -0.13 0.66 0.16 -0.36 0.00 0.00 175.35 175.71 2kui s ASP 496 N -1.20 6.93 0.22 1.43 -4.77 -1.26 -0.28 116.67 117.75 2kui s ASP 496 Ca -0.13 1.12 -0.30 0.00 -3.30 0.00 0.00 52.55 49.95 2kui s ASP 496 Cb -0.06 -2.39 -0.08 0.00 -1.09 0.00 0.00 42.92 39.29 2kui s ASP 496 CO 0.02 -0.09 1.07 0.27 0.70 0.00 0.00 175.17 177.14 2kui s ILE 497 N 0.75 3.79 0.05 2.11 -4.36 -0.00 -4.88 121.20 118.66 2kui s ILE 497 Ca 0.35 1.66 0.00 0.00 -0.26 0.00 0.00 60.65 62.40 2kui s ILE 497 Cb -0.17 -4.06 0.01 0.00 1.25 0.00 0.00 42.46 39.49 2kui s ILE 497 CO 0.17 0.34 0.07 -0.81 0.24 0.00 0.00 174.94 174.95 2kui n PRO 498 N 1.85 0.64 -3.01 0.37 -0.04 -1.26 0.13 135.00 133.69 2kui n PRO 498 Ca 0.01 -0.21 -0.35 0.00 -0.04 0.00 0.00 63.50 62.91 2kui n PRO 498 Cb 0.46 -0.04 -0.06 0.00 -0.04 0.00 0.00 33.50 33.81 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 -1.29 7.06 0.00 3.54 -4.77 -1.26 -4.67 116.67 115.28 2kui s ASP 499 Ca 0.05 1.51 0.00 0.00 -3.30 0.00 0.00 52.55 50.81 2kui s ASP 499 Cb -0.00 -2.46 0.00 0.00 -1.09 0.00 0.00 42.92 39.37 2kui s ASP 499 CO 0.03 -0.07 0.52 0.55 0.70 0.00 0.00 175.17 176.91 2kui n VAL 500 N 0.38 0.16 -2.23 2.11 3.14 -1.26 -5.05 118.33 115.58 2kui n VAL 500 Ca 0.00 -0.18 -0.42 0.00 -2.96 0.00 0.00 64.34 60.78 2kui n VAL 500 Cb 0.51 1.03 -0.03 0.00 -1.06 0.00 0.00 33.84 34.30 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 -0.16 3.62 0.00 1.55 0.00 -1.26 -3.19 121.76 122.32 2kui s ALA 501 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 51.96 52.70 2kui s ALA 501 Cb 0.00 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.46 2kui s ALA 501 CO 0.00 -1.18 0.00 0.41 0.00 0.00 0.00 175.76 174.99 2kui n GLY 502 N 3.80 1.94 3.31 0.00 0.00 -0.47 -4.99 105.19 108.79 2kui n GLY 502 Ca 0.15 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.53 1.62 0.40 1.61 -0.21 -1.19 -4.99 119.66 116.36 2kui s GLN 503 Ca 0.00 -1.83 -0.02 0.00 0.02 0.00 0.00 55.36 53.54 2kui s GLN 503 Cb 0.00 0.34 -0.03 0.00 1.00 0.00 0.00 33.01 34.31 2kui s GLN 503 CO 0.00 -0.60 0.64 0.95 -2.12 0.00 0.00 175.29 174.16 2kui s THR 504 N -3.60 5.03 0.28 -0.19 -4.23 -1.26 -0.74 115.64 110.92 2kui s THR 504 Ca 0.38 -0.21 0.02 0.00 -1.18 0.00 0.00 61.69 60.69 2kui s THR 504 Cb 0.03 -3.86 0.28 0.00 1.34 0.00 0.00 72.50 70.29 2kui s THR 504 CO 0.21 -0.67 1.82 -0.37 -0.54 0.00 0.00 174.62 175.07 2kui h VAL 505 N 0.55 0.86 -0.44 2.29 -1.51 -1.88 0.13 116.25 116.25 2kui h VAL 505 Ca -0.49 -0.31 -0.08 0.00 -1.23 0.00 0.00 66.70 64.59 2kui h VAL 505 Cb 1.21 -0.14 -0.01 0.00 -2.13 0.00 0.00 31.29 30.22 2kui h VAL 505 CO 0.61 0.17 -0.04 0.44 -1.23 0.00 0.00 177.57 177.52 2kui h ASP 506 N 0.92 0.80 0.33 4.19 3.32 -1.94 -2.25 116.42 121.79 2kui h ASP 506 Ca 0.51 -0.33 -0.20 0.00 0.02 0.00 0.00 57.03 57.03 2kui h ASP 506 Cb 0.59 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.92 2kui h ASP 506 CO -0.30 0.94 -0.83 0.58 -1.72 0.00 0.00 179.24 177.91 2kui h VAL 507 N 0.64 1.40 -0.05 -1.35 2.07 -1.78 -2.66 116.25 114.53 2kui h VAL 507 Ca 0.12 -2.32 0.00 0.00 0.82 0.00 0.00 66.70 65.32 2kui h VAL 507 Cb 0.55 2.28 -0.01 0.00 -1.52 0.00 0.00 31.29 32.60 2kui h VAL 507 CO 0.03 0.69 0.01 0.00 0.02 0.00 0.00 177.57 178.33 2kui h ALA 508 N 0.86 0.05 -0.39 1.67 0.00 -0.63 0.84 119.26 121.67 2kui h ALA 508 Ca -0.05 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2kui h ALA 508 Cb 1.44 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.21 2kui h ALA 508 CO 0.14 -0.47 -0.08 -0.56 0.00 0.00 0.00 179.25 178.29 2kui h GLN 509 N 0.04 0.65 -0.24 0.00 3.07 -1.45 -1.80 115.11 115.38 2kui h GLN 509 Ca 0.02 -0.19 -0.00 0.00 0.09 0.00 0.00 58.65 58.57 2kui h GLN 509 Cb 0.01 -0.07 -0.01 0.00 0.08 0.00 0.00 27.48 27.49 2kui h GLN 509 CO -0.02 0.73 0.14 -0.22 0.09 0.00 0.00 178.83 179.54 2kui h LYS 510 N 0.61 0.34 -0.45 0.06 1.63 -1.04 -0.10 116.57 117.61 2kui h LYS 510 Ca 0.11 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.86 2kui h LYS 510 Cb 0.49 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.04 2kui h LYS 510 CO 0.03 0.30 0.23 -0.91 -3.45 0.00 0.00 179.45 175.65 2kui h ASN 511 N 0.28 0.58 -0.26 4.20 2.35 -0.55 0.49 115.58 122.68 2kui h ASN 511 Ca 0.09 -0.11 0.01 0.00 -0.55 0.00 0.00 56.30 55.73 2kui h ASN 511 Cb 0.06 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 2kui h ASN 511 CO -0.01 0.53 0.16 -0.07 -1.65 0.00 0.00 177.43 176.39 2kui h LEU 512 N 0.59 0.28 -1.06 1.61 3.38 -1.12 -1.00 115.31 118.00 2kui h LEU 512 Ca 0.16 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 2kui h LEU 512 Cb 0.09 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 2kui h LEU 512 CO -0.02 0.20 0.36 -1.13 0.09 0.00 0.00 178.44 177.94 2kui h ASN 513 N 0.33 0.92 -0.34 -0.43 -0.00 -0.58 0.58 115.58 116.07 2kui h ASN 513 Ca 0.10 -0.09 -0.05 0.00 -0.00 0.00 0.00 56.30 56.25 2kui h ASN 513 Cb -0.02 -0.24 -0.02 0.00 -0.00 0.00 0.00 38.32 38.04 2kui h ASN 513 CO -0.03 0.77 0.04 0.58 -0.00 0.00 0.00 177.43 178.79 2kui h VAL 514 N 1.02 1.21 0.00 2.57 2.07 -0.34 -2.21 116.25 120.57 2kui h VAL 514 Ca 0.25 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.96 2kui h VAL 514 Cb 0.08 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 2kui h VAL 514 CO -0.03 0.29 0.00 -1.22 0.02 0.00 0.00 177.57 176.62 2kui n TYR 515 N -4.27 0.54 0.00 1.57 4.01 -0.43 -4.87 117.16 113.70 2kui n TYR 515 Ca 0.02 0.16 0.00 0.00 -0.16 0.00 0.00 57.90 57.92 2kui n TYR 515 Cb 0.24 -0.76 0.00 0.00 -0.31 0.00 0.00 39.34 38.51 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 1.29 0.83 3.62 2.72 0.00 -0.74 -5.05 105.19 107.86 2kui n GLY 516 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 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 3.13 -0.12 1.61 0.08 0.09 -4.55 117.98 116.22 2kui s PHE 517 Ca 0.00 0.96 0.16 0.00 0.12 0.00 0.00 56.93 58.17 2kui s PHE 517 Cb 0.00 -3.59 -0.12 0.00 -0.57 0.00 0.00 43.02 38.74 2kui s PHE 517 CO 0.00 -0.75 0.90 1.79 -0.10 0.00 0.00 175.22 177.06 2kui h THR 518 N 5.74 0.59 -3.46 0.64 1.35 -1.53 -3.15 112.91 113.08 2kui h THR 518 Ca -0.22 -2.09 -0.65 0.00 -0.55 0.00 0.00 66.41 62.89 2kui h THR 518 Cb 1.07 2.12 -0.26 0.00 -1.73 0.00 0.00 68.15 69.35 2kui h THR 518 CO 0.98 0.33 -0.69 -0.54 -0.25 0.00 0.00 175.52 175.36 2kui s LYS 519 N -2.90 3.47 -0.01 4.72 -0.14 -1.20 -5.02 119.74 118.66 2kui s LYS 519 Ca -0.02 -0.58 0.03 0.00 -1.36 0.00 0.00 55.97 54.05 2kui s LYS 519 Cb 0.09 -3.09 -0.01 0.00 -1.68 0.00 0.00 37.83 33.14 2kui s LYS 519 CO 0.80 -0.17 -0.11 -0.59 -0.76 0.00 0.00 175.35 174.53 2kui s PHE 520 N 1.44 0.96 0.02 3.18 -0.12 -1.26 -0.22 117.98 121.98 2kui s PHE 520 Ca 0.05 -0.19 0.03 0.00 -0.05 0.00 0.00 56.93 56.77 2kui s PHE 520 Cb -0.14 -0.61 -0.01 0.00 -0.63 0.00 0.00 43.02 41.62 2kui s PHE 520 CO -0.01 -0.02 -0.08 -1.12 -0.05 0.00 0.00 175.22 173.94 2kui s SER 521 N -0.28 0.95 -0.17 1.98 0.01 -0.26 -4.92 113.70 111.01 2kui s SER 521 Ca 0.04 -0.32 0.00 0.00 1.31 0.00 0.00 55.95 56.98 2kui s SER 521 Cb -0.04 -0.05 0.01 0.00 0.21 0.00 0.00 66.02 66.15 2kui s SER 521 CO -0.00 -0.02 -0.16 0.00 0.41 0.00 0.00 173.24 173.46 2kui s GLN 522 N -0.81 3.14 -0.11 12.44 -2.07 -1.26 0.09 119.66 131.08 2kui s GLN 522 Ca -0.02 -0.77 -0.06 0.00 -1.82 0.00 0.00 55.36 52.69 2kui s GLN 522 Cb -0.06 -2.65 -0.04 0.00 -1.09 0.00 0.00 33.01 29.18 2kui s GLN 522 CO 0.00 -0.10 0.12 0.00 -1.32 0.00 0.00 175.29 173.99 2kui s ALA 523 N 1.09 3.81 -0.33 2.60 0.00 0.11 -4.94 121.76 124.10 2kui s ALA 523 Ca -0.00 -0.67 -0.22 0.00 0.00 0.00 0.00 51.96 51.07 2kui s ALA 523 Cb -0.14 -1.90 0.00 0.00 0.00 0.00 0.00 23.12 21.07 2kui s ALA 523 CO -0.05 0.62 0.71 -1.12 0.00 0.00 0.00 175.76 175.92 2kui s SER 524 N -1.05 6.54 0.24 0.00 0.01 -1.26 -0.25 113.70 117.92 2kui s SER 524 Ca 0.15 0.41 0.11 0.00 1.31 0.00 0.00 55.95 57.93 2kui s SER 524 Cb -0.12 -2.36 -0.05 0.00 0.21 0.00 0.00 66.02 63.70 2kui s SER 524 CO 0.04 -0.60 -0.19 0.68 0.41 0.00 0.00 173.24 173.58 2kui s VAL 525 N 2.84 2.23 -0.06 3.43 -7.23 0.28 -4.94 120.40 116.94 2kui s VAL 525 Ca 0.28 -2.25 -0.14 0.00 -1.81 0.00 0.00 61.98 58.06 2kui s VAL 525 Cb -0.14 -2.17 -0.05 0.00 0.56 0.00 0.00 36.38 34.58 2kui s VAL 525 CO 0.14 -0.39 0.35 1.51 -0.31 0.00 0.00 175.10 176.40 2kui s ASP 526 N -3.24 6.66 0.30 4.85 -4.77 -1.26 -0.25 116.67 118.95 2kui s ASP 526 Ca 0.25 0.78 -0.12 0.00 -3.30 0.00 0.00 52.55 50.16 2kui s ASP 526 Cb -0.05 -2.21 0.01 0.00 -1.09 0.00 0.00 42.92 39.58 2kui s ASP 526 CO 0.11 0.26 0.57 -0.44 0.70 0.00 0.00 175.17 176.37 2kui s SER 527 N -0.56 0.12 0.00 2.11 0.01 -1.00 -4.84 113.70 109.54 2kui s SER 527 Ca 0.21 -1.05 0.29 0.00 1.31 0.00 0.00 55.95 56.71 2kui s SER 527 Cb -0.15 0.68 1.21 0.00 0.21 0.00 0.00 66.02 67.97 2kui s SER 527 CO 0.10 -1.31 1.88 -2.65 0.41 0.00 0.00 173.24 171.67 2kui n PRO 528 N -0.46 0.19 -2.55 12.44 -0.02 -1.26 -3.91 135.00 139.43 2kui n PRO 528 Ca -0.03 -0.03 -0.41 0.00 -2.02 0.00 0.00 63.50 61.01 2kui n PRO 528 Cb 0.61 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.55 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 -2.83 4.59 0.78 -0.52 3.00 -1.26 -4.80 118.95 117.91 2kui s ARG 529 Ca 0.19 1.66 -0.15 0.00 0.00 0.00 0.00 55.73 57.44 2kui s ARG 529 Cb 0.19 -3.31 0.04 0.00 0.00 0.00 0.00 34.95 31.87 2kui s ARG 529 CO 0.53 0.05 0.98 -0.35 0.00 0.00 0.00 175.30 176.51 2kui n PRO 530 N 2.71 0.29 -1.67 3.54 -0.04 -1.26 -2.87 135.00 135.69 2kui n PRO 530 Ca 0.04 0.16 -0.42 0.00 -0.04 0.00 0.00 63.50 63.23 2kui n PRO 530 Cb 0.47 -2.25 -0.03 0.00 -0.04 0.00 0.00 33.50 31.65 2kui n PRO 530 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kui s ALA 531 N -2.00 3.33 0.00 0.55 0.00 -1.25 -2.41 121.76 119.97 2kui s ALA 531 Ca 0.71 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.82 2kui s ALA 531 Cb -0.31 -3.91 0.00 0.00 0.00 0.00 0.00 23.12 18.90 2kui s ALA 531 CO 0.53 -1.94 0.00 0.41 0.00 0.00 0.00 175.76 174.76 2kui n GLY 532 N 4.89 1.47 3.69 0.00 0.00 -1.23 -5.00 105.19 109.02 2kui n GLY 532 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 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 4.33 -0.53 1.61 2.56 -1.01 -2.82 118.70 122.85 2kui s GLU 533 Ca 0.00 1.74 -0.26 0.00 0.00 0.00 0.00 54.97 56.46 2kui s GLU 533 Cb 0.00 -3.56 0.03 0.00 2.00 0.00 0.00 34.13 32.60 2kui s GLU 533 CO 0.00 -0.48 1.00 0.08 -0.56 0.00 0.00 175.26 175.30 2kui s VAL 534 N 2.25 4.33 0.07 3.70 1.01 0.08 -1.74 120.40 130.09 2kui s VAL 534 Ca 0.58 0.60 0.17 0.00 0.00 0.00 0.00 61.98 63.33 2kui s VAL 534 Cb -0.26 -4.55 0.09 0.00 0.00 0.00 0.00 36.38 31.66 2kui s VAL 534 CO 0.23 -1.07 1.62 0.74 0.00 0.00 0.00 175.10 176.62 2kui h THR 535 N 6.08 0.92 0.00 3.92 2.02 -0.99 -1.24 112.91 123.61 2kui h THR 535 Ca -0.25 -1.84 0.00 0.00 0.77 0.00 0.00 66.41 65.09 2kui h THR 535 Cb 1.07 2.13 0.00 0.00 -1.74 0.00 0.00 68.15 69.61 2kui h THR 535 CO 1.09 0.44 0.00 0.61 0.37 0.00 0.00 175.52 178.03 2kui n GLY 536 N 0.60 -0.83 3.49 2.16 0.00 -1.13 -4.70 105.19 104.78 2kui n GLY 536 Ca 0.00 -1.11 -0.26 0.00 0.00 0.00 0.00 46.02 44.65 2kui n GLY 536 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 537 N -3.00 2.71 -0.08 2.61 -4.23 -1.26 -0.03 115.64 112.36 2kui s THR 537 Ca 0.00 -1.95 -0.22 0.00 -1.18 0.00 0.00 61.69 58.34 2kui s THR 537 Cb 0.00 -2.34 -0.18 0.00 1.34 0.00 0.00 72.50 71.32 2kui s THR 537 CO 0.00 -0.16 0.80 -1.13 -0.54 0.00 0.00 174.62 173.59 2kui h ASN 538 N 2.92 -0.08 -2.86 3.99 -1.24 -1.21 -3.42 115.58 113.68 2kui h ASN 538 Ca -0.46 -0.54 -0.52 0.00 0.71 0.00 0.00 56.30 55.49 2kui h ASN 538 Cb 1.22 0.02 0.04 0.00 0.73 0.00 0.00 38.32 40.33 2kui h ASN 538 CO 0.52 0.61 0.87 -2.16 -1.29 0.00 0.00 177.43 175.98 2kui s PRO 539 N -2.94 4.22 0.45 6.67 0.04 -1.26 -4.96 135.00 137.22 2kui s PRO 539 Ca -0.14 2.36 -0.25 0.00 0.04 0.00 0.00 61.00 63.02 2kui s PRO 539 Cb -0.01 -3.15 -0.08 0.00 0.04 0.00 0.00 34.50 31.31 2kui s PRO 539 CO 0.52 -0.60 1.35 -1.25 0.04 0.00 0.00 177.00 177.06 2kui s PRO 540 N 1.04 3.70 0.27 0.56 0.04 -1.26 -4.94 135.00 134.40 2kui s PRO 540 Ca 0.69 2.24 -0.30 0.00 0.04 0.00 0.00 61.00 63.68 2kui s PRO 540 Cb -0.44 -2.60 -0.10 0.00 0.04 0.00 0.00 34.50 31.40 2kui s PRO 540 CO 0.32 -0.75 1.43 0.00 0.04 0.00 0.00 177.00 178.04 2kui s ALA 541 N -1.27 3.61 0.00 8.56 0.00 -1.26 -2.33 121.76 129.06 2kui s ALA 541 Ca 0.62 1.34 0.00 0.00 0.00 0.00 0.00 51.96 53.92 2kui s ALA 541 Cb -0.40 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.17 2kui s ALA 541 CO 0.50 -0.75 0.00 0.41 0.00 0.00 0.00 175.76 175.92 2kui n GLY 542 N 1.88 2.86 3.74 0.00 0.00 0.12 -4.99 105.19 108.80 2kui n GLY 542 Ca 0.05 0.00 -0.41 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 -2.57 3.07 -0.19 2.61 2.01 -0.99 -4.61 115.64 114.97 2kui s THR 543 Ca 0.00 0.88 -0.24 0.00 0.31 0.00 0.00 61.69 62.64 2kui s THR 543 Cb 0.00 -3.56 -0.01 0.00 0.01 0.00 0.00 72.50 68.93 2kui s THR 543 CO 0.00 0.13 0.79 -0.89 -0.69 0.00 0.00 174.62 173.97 2kui s THR 544 N 0.10 4.90 0.11 -0.82 2.01 -1.26 -0.82 115.64 119.86 2kui s THR 544 Ca 0.57 1.53 0.07 0.00 0.31 0.00 0.00 61.69 64.18 2kui s THR 544 Cb -0.38 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.00 2kui s THR 544 CO 0.39 0.02 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.49 2kui s VAL 545 N 2.26 1.47 0.33 3.82 1.01 0.62 -4.88 120.40 125.02 2kui s VAL 545 Ca 0.36 -1.60 -0.29 0.00 0.00 0.00 0.00 61.98 60.45 2kui s VAL 545 Cb -0.16 -1.48 -0.10 0.00 0.00 0.00 0.00 36.38 34.63 2kui s VAL 545 CO 0.11 -0.25 1.33 -2.84 0.00 0.00 0.00 175.10 173.45 2kui s PRO 546 N -2.25 4.33 0.63 2.72 0.02 -1.26 -0.32 135.00 138.87 2kui s PRO 546 Ca 0.07 2.26 0.41 0.00 0.02 0.00 0.00 61.00 63.75 2kui s PRO 546 Cb -0.08 -3.07 2.09 0.00 0.02 0.00 0.00 34.50 33.47 2kui s PRO 546 CO 0.04 -0.24 2.25 -0.39 -0.33 0.00 0.00 177.00 178.33 2kui h VAL 547 N 3.08 0.01 -0.19 3.83 -1.51 -1.65 -0.71 116.25 119.11 2kui h VAL 547 Ca -0.49 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 64.81 2kui h VAL 547 Cb 1.23 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 31.55 2kui h VAL 547 CO 0.66 0.00 0.00 -0.67 -1.23 0.00 0.00 177.57 176.34 2kui n ASP 548 N -3.10 2.25 -4.21 4.19 2.03 -1.26 -1.60 116.55 114.85 2kui n ASP 548 Ca -0.02 -1.79 -0.20 0.00 0.52 0.00 0.00 54.79 53.30 2kui n ASP 548 Cb 0.15 -0.12 0.10 0.00 -0.72 0.00 0.00 41.12 40.53 2kui n ASP 548 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2kui n SER 549 N 0.72 1.17 -4.58 1.67 2.88 -0.27 -4.70 113.62 110.50 2kui n SER 549 Ca 0.17 -1.99 -0.37 0.00 -1.33 0.00 0.00 58.87 55.36 2kui n SER 549 Cb 0.43 -0.56 -0.11 0.00 -0.75 0.00 0.00 64.21 63.22 2kui n SER 549 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2kui s VAL 550 N -2.66 4.99 -0.21 2.46 1.01 -1.26 -3.25 120.40 121.49 2kui s VAL 550 Ca 0.58 0.06 -0.08 0.00 0.00 0.00 0.00 61.98 62.53 2kui s VAL 550 Cb -0.03 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 2kui s VAL 550 CO 0.38 0.33 0.08 -0.63 0.00 0.00 0.00 175.10 175.26 2kui s ILE 551 N 1.34 4.78 -0.26 2.22 1.09 0.69 -4.96 121.20 126.11 2kui s ILE 551 Ca 0.06 -0.03 -0.09 0.00 -1.10 0.00 0.00 60.65 59.50 2kui s ILE 551 Cb -0.15 -3.19 -0.04 0.00 -1.06 0.00 0.00 42.46 38.03 2kui s ILE 551 CO 0.06 0.41 0.12 -0.70 -0.10 0.00 0.00 174.94 174.73 2kui s GLU 552 N 0.78 3.79 -0.10 2.79 2.12 -1.26 -1.10 118.70 125.72 2kui s GLU 552 Ca 0.04 -0.41 -0.14 0.00 0.36 0.00 0.00 54.97 54.82 2kui s GLU 552 Cb -0.13 -3.45 -0.05 0.00 0.26 0.00 0.00 34.13 30.75 2kui s GLU 552 CO 0.02 -0.16 0.35 -0.51 -0.54 0.00 0.00 175.26 174.42 2kui s LEU 553 N 1.61 4.34 -0.28 2.70 1.43 0.11 -0.64 118.68 127.96 2kui s LEU 553 Ca 0.06 0.71 -0.09 0.00 -1.03 0.00 0.00 54.13 53.79 2kui s LEU 553 Cb -0.15 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.56 2kui s LEU 553 CO 0.06 0.18 0.13 -1.10 0.23 0.00 0.00 176.35 175.85 2kui s GLN 554 N -0.16 3.63 -0.16 1.70 -0.21 0.96 0.04 119.66 125.47 2kui s GLN 554 Ca 0.21 -0.51 -0.03 0.00 0.02 0.00 0.00 55.36 55.04 2kui s GLN 554 Cb -0.15 -3.48 -0.03 0.00 1.00 0.00 0.00 33.01 30.36 2kui s GLN 554 CO 0.08 -0.26 -0.05 0.08 -2.12 0.00 0.00 175.29 173.03 2kui s VAL 555 N 1.65 3.77 0.31 1.09 1.01 0.65 -0.33 120.40 128.55 2kui s VAL 555 Ca 0.06 -0.40 -0.27 0.00 0.00 0.00 0.00 61.98 61.37 2kui s VAL 555 Cb -0.16 -2.65 -0.10 0.00 0.00 0.00 0.00 36.38 33.48 2kui s VAL 555 CO 0.06 0.49 0.94 -0.94 0.00 0.00 0.00 175.10 175.66 2kui s SER 556 N 0.41 7.40 0.24 3.32 1.04 -0.71 -0.56 113.70 124.84 2kui s SER 556 Ca -0.05 1.85 -0.06 0.00 0.48 0.00 0.00 55.95 58.17 2kui s SER 556 Cb -0.14 -2.58 -0.06 0.00 0.10 0.00 0.00 66.02 63.33 2kui s SER 556 CO 0.03 -0.02 0.52 -1.59 0.98 0.00 0.00 173.24 173.16 2kui s LYS 557 N -1.88 3.68 0.18 4.02 -2.85 0.65 -3.53 119.74 120.02 2kui s LYS 557 Ca 0.48 0.07 0.04 0.00 -1.00 0.00 0.00 55.97 55.56 2kui s LYS 557 Cb -0.20 -2.68 0.05 0.00 -2.06 0.00 0.00 37.83 32.94 2kui s LYS 557 CO 0.25 0.29 1.42 0.78 0.10 0.00 0.00 175.35 178.19 2kui h GLY 558 N 2.15 0.17 0.00 0.59 0.00 -1.70 -2.66 103.07 101.62 2kui h GLY 558 Ca -0.47 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 46.57 2kui h GLY 558 CO 0.68 0.26 0.00 -2.01 0.00 0.00 0.00 176.54 175.47 2kui n ASN 559 N -3.67 0.00 -4.04 0.19 5.15 -1.25 -4.12 115.26 107.53 2kui n ASN 559 Ca -0.03 0.00 -0.15 0.00 -0.60 0.00 0.00 54.58 53.80 2kui n ASN 559 Cb 0.77 -0.02 -0.13 0.00 -0.53 0.00 0.00 39.78 39.88 2kui n ASN 559 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2kui s GLN 560 N 0.00 0.54 -0.03 1.20 -0.21 -1.26 -3.19 119.66 116.71 2kui s GLN 560 Ca 0.00 -0.55 0.06 0.00 0.02 0.00 0.00 55.36 54.89 2kui s GLN 560 Cb 0.00 -0.42 -0.01 0.00 1.00 0.00 0.00 33.01 33.58 2kui s GLN 560 CO 0.00 0.10 -0.22 -0.59 -2.12 0.00 0.00 175.29 172.46 2kui s PHE 561 N -0.86 2.01 -0.04 0.91 -0.71 -0.41 -4.75 117.98 114.12 2kui s PHE 561 Ca -0.04 -0.47 -0.29 0.00 -1.04 0.00 0.00 56.93 55.09 2kui s PHE 561 Cb -0.07 -1.31 -0.08 0.00 -1.21 0.00 0.00 43.02 40.35 2kui s PHE 561 CO 0.00 -0.10 2.06 0.28 -1.34 0.00 0.00 175.22 176.12 2kui n VAL 562 N 2.75 0.64 -2.83 -2.49 0.31 -1.26 -0.27 118.33 115.18 2kui n VAL 562 Ca -0.16 -0.24 -0.35 0.00 -0.01 0.00 0.00 64.34 63.57 2kui n VAL 562 Cb 0.52 -2.40 -0.07 0.00 -0.91 0.00 0.00 33.84 30.99 2kui n VAL 562 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2kui s MET 563 N 5.07 4.40 0.98 5.55 0.23 0.09 -4.92 119.30 130.70 2kui s MET 563 Ca 0.93 1.19 -0.12 0.00 -1.03 0.00 0.00 55.69 56.66 2kui s MET 563 Cb -0.40 -2.56 0.18 0.00 -1.53 0.00 0.00 34.83 30.52 2kui s MET 563 CO 0.40 0.17 1.11 -2.14 -2.03 0.00 0.00 175.02 172.52 2kui s PRO 564 N -2.51 0.61 -0.03 3.16 0.02 -1.26 -1.96 135.00 133.02 2kui s PRO 564 Ca 0.54 0.44 -0.30 0.00 0.02 0.00 0.00 61.00 61.70 2kui s PRO 564 Cb -0.14 -1.76 -0.04 0.00 0.02 0.00 0.00 34.50 32.57 2kui s PRO 564 CO 0.19 -2.59 1.24 0.34 -0.33 0.00 0.00 177.00 175.85 2kui s ASP 565 N -3.63 7.01 0.00 2.53 2.15 -1.26 -4.58 116.67 118.89 2kui s ASP 565 Ca 0.65 1.90 0.00 0.00 0.43 0.00 0.00 52.55 55.52 2kui s ASP 565 Cb -0.17 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.89 2kui s ASP 565 CO 0.56 -0.60 0.89 0.18 -0.17 0.00 0.00 175.17 176.04 2kui n LEU 566 N 5.12 0.00 -4.75 -1.34 4.77 -1.26 -5.11 117.00 114.43 2kui n LEU 566 Ca 0.11 -0.90 -0.40 0.00 -0.03 0.00 0.00 56.01 54.79 2kui n LEU 566 Cb 0.46 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.49 2kui n LEU 566 CO 0.56 0.30 0.66 -0.94 -1.33 0.00 0.00 177.39 176.63 2kui s SER 567 N -0.80 7.62 0.00 -1.43 1.04 -1.26 -3.80 113.70 115.06 2kui s SER 567 Ca 0.00 1.93 0.00 0.00 0.48 0.00 0.00 55.95 58.36 2kui s SER 567 Cb 0.00 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.51 2kui s SER 567 CO 0.00 0.12 0.00 0.61 0.98 0.00 0.00 173.24 174.95 2kui n GLY 568 N 1.61 0.60 3.89 7.32 0.00 -1.26 -5.05 105.19 112.29 2kui n GLY 568 Ca -0.01 -0.80 -0.24 0.00 0.00 0.00 0.00 46.02 44.97 2kui n GLY 568 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2kui s MET 569 N -2.59 2.35 -0.13 1.61 1.00 -1.25 -4.91 119.30 115.38 2kui s MET 569 Ca 0.00 -1.81 -0.06 0.00 0.00 0.00 0.00 55.69 53.82 2kui s MET 569 Cb 0.00 -2.24 -0.04 0.00 0.00 0.00 0.00 34.83 32.56 2kui s MET 569 CO 0.00 -0.45 0.09 -0.06 0.00 0.00 0.00 175.02 174.59 2kui s PHE 570 N -2.65 3.40 0.54 -0.03 0.40 -1.26 -1.88 117.98 116.49 2kui s PHE 570 Ca 0.42 0.33 0.26 0.00 -0.60 0.00 0.00 56.93 57.34 2kui s PHE 570 Cb -0.02 -1.95 1.41 0.00 0.51 0.00 0.00 43.02 42.97 2kui s PHE 570 CO 0.25 0.51 2.00 2.35 0.70 0.00 0.00 175.22 181.03 2kui h TRP 571 N 5.54 0.00 0.00 0.36 7.01 -0.36 0.32 115.95 128.83 2kui h TRP 571 Ca -0.49 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.51 2kui h TRP 571 Cb 1.20 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.26 2kui h TRP 571 CO 0.67 0.00 0.00 -0.39 -2.79 0.00 0.00 178.44 175.93 2kui h VAL 572 N 0.00 0.00 0.00 2.65 -1.51 -1.94 -0.23 116.25 115.22 2kui h VAL 572 Ca 0.24 -0.67 -0.34 0.00 -1.23 0.00 0.00 66.70 64.71 2kui h VAL 572 Cb 1.00 1.64 -0.06 0.00 -2.13 0.00 0.00 31.29 31.74 2kui h VAL 572 CO -0.00 0.00 -2.28 -0.67 -1.23 0.00 0.00 177.57 173.38 2kui n ASP 573 N -2.96 1.64 -0.12 4.19 2.03 0.07 -4.46 116.55 116.94 2kui n ASP 573 Ca 0.02 -0.08 -0.11 0.00 0.52 0.00 0.00 54.79 55.14 2kui n ASP 573 Cb 0.39 0.09 -0.02 0.00 -0.72 0.00 0.00 41.12 40.86 2kui n ASP 573 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kui h ALA 574 N 0.31 0.50 -0.09 -1.67 0.00 -0.35 -2.62 119.26 115.33 2kui h ALA 574 Ca -0.50 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.12 2kui h ALA 574 Cb 1.90 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.54 2kui h ALA 574 CO -0.04 0.36 -0.06 1.49 0.00 0.00 0.00 179.25 180.99 2kui h GLU 575 N 0.50 -0.06 -0.93 0.00 4.81 -1.27 0.77 114.58 118.39 2kui h GLU 575 Ca 0.09 0.00 0.15 0.00 -0.13 0.00 0.00 59.36 59.48 2kui h GLU 575 Cb 0.60 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.92 2kui h GLU 575 CO 0.04 -0.04 0.59 -1.35 -0.73 0.00 0.00 179.01 177.52 2kui h PRO 576 N -0.07 0.72 -0.64 0.92 0.11 -1.77 -0.22 132.00 131.05 2kui h PRO 576 Ca 0.06 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.05 2kui h PRO 576 Cb 0.15 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.07 2kui h PRO 576 CO -0.14 0.47 0.10 0.00 -0.21 0.00 0.00 178.00 178.23 2kui h ARG 577 N 0.74 1.04 -0.60 1.05 2.47 -0.87 0.05 114.38 118.25 2kui h ARG 577 Ca 0.48 -0.27 -0.02 0.00 -1.26 0.00 0.00 59.98 58.91 2kui h ARG 577 Cb 0.75 -0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 28.91 2kui h ARG 577 CO -0.24 0.95 0.29 -0.07 0.56 0.00 0.00 179.97 181.47 2kui h LEU 578 N 0.98 0.77 -1.00 3.04 3.38 0.34 0.62 115.31 123.44 2kui h LEU 578 Ca 0.20 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2kui h LEU 578 Cb 0.42 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 2kui h LEU 578 CO 0.01 0.68 0.40 0.03 0.09 0.00 0.00 178.44 179.66 2kui h ARG 579 N 0.81 1.11 -0.00 1.13 3.08 -0.70 0.94 114.38 120.74 2kui h ARG 579 Ca 0.21 -0.14 -0.11 0.00 0.07 0.00 0.00 59.98 60.01 2kui h ARG 579 Cb 0.11 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 2kui h ARG 579 CO -0.03 0.83 -0.51 0.00 -1.07 0.00 0.00 179.97 179.19 2kui h ALA 580 N 1.33 1.16 -0.00 0.04 0.00 -0.32 -2.69 119.26 118.78 2kui h ALA 580 Ca 0.27 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2kui h ALA 580 Cb 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2kui h ALA 580 CO -0.04 0.64 -0.07 1.28 0.00 0.00 0.00 179.25 181.06 2kui n LEU 581 N -3.93 0.15 -0.24 0.00 4.77 0.15 -4.91 117.00 112.99 2kui n LEU 581 Ca -0.01 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 2kui n LEU 581 Cb 0.52 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2kui n LEU 581 CO 0.41 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2kui n GLY 582 N 1.37 0.80 3.71 -0.72 0.00 -0.64 -5.02 105.19 104.69 2kui n GLY 582 Ca 0.11 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.49 3.58 -0.37 1.61 -0.00 0.23 -4.99 118.94 116.51 2kui s TRP 583 Ca 0.00 1.54 0.02 0.00 -0.00 0.00 0.00 56.10 57.66 2kui s TRP 583 Cb 0.00 -3.24 0.15 0.00 -0.00 0.00 0.00 33.47 30.38 2kui s TRP 583 CO 0.00 -0.53 0.32 0.99 -0.00 0.00 0.00 176.95 177.74 2kui s THR 584 N 0.93 -0.15 0.00 5.86 2.01 -1.26 -4.69 115.64 118.34 2kui s THR 584 Ca 0.54 -1.33 0.00 0.00 0.31 0.00 0.00 61.69 61.22 2kui s THR 584 Cb -0.25 -0.84 0.00 0.00 0.01 0.00 0.00 72.50 71.43 2kui s THR 584 CO 0.29 -0.75 0.00 0.61 -0.69 0.00 0.00 174.62 174.08 2kui n GLY 585 N 4.07 4.15 3.38 4.40 0.00 -1.24 -4.67 105.19 115.27 2kui n GLY 585 Ca 0.13 -0.59 -0.32 0.00 0.00 0.00 0.00 46.02 45.23 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 2.95 2.80 -0.19 1.61 -2.45 -1.26 -4.95 119.30 117.81 2kui s MET 586 Ca 0.00 -0.76 -0.09 0.00 -1.25 0.00 0.00 55.69 53.59 2kui s MET 586 Cb 0.00 -2.39 -0.05 0.00 1.25 0.00 0.00 34.83 33.64 2kui s MET 586 CO 0.00 0.42 0.12 -1.17 1.05 0.00 0.00 175.02 175.44 2kui s LEU 587 N -0.21 4.17 -0.28 4.11 1.98 -1.26 -3.05 118.68 124.14 2kui s LEU 587 Ca -0.00 0.23 -0.10 0.00 -2.89 0.00 0.00 54.13 51.37 2kui s LEU 587 Cb -0.13 -2.07 -0.03 0.00 0.66 0.00 0.00 46.19 44.61 2kui s LEU 587 CO 0.03 0.20 0.16 -0.62 -1.89 0.00 0.00 176.35 174.23 2kui s ASP 588 N 0.25 5.71 -0.41 3.68 2.15 -1.25 -5.04 116.67 121.76 2kui s ASP 588 Ca 0.08 -0.20 -0.23 0.00 0.43 0.00 0.00 52.55 52.63 2kui s ASP 588 Cb -0.11 -2.05 0.02 0.00 -0.30 0.00 0.00 42.92 40.48 2kui s ASP 588 CO -0.01 -0.09 0.79 -0.54 -0.17 0.00 0.00 175.17 175.15 2kui s LYS 589 N 1.69 3.57 0.33 4.34 -0.14 -1.26 -4.52 119.74 123.75 2kui s LYS 589 Ca 0.06 0.09 -0.05 0.00 -1.36 0.00 0.00 55.97 54.72 2kui s LYS 589 Cb -0.16 -3.88 0.08 0.00 -1.68 0.00 0.00 37.83 32.18 2kui s LYS 589 CO 0.08 -1.01 0.45 0.41 -0.76 0.00 0.00 175.35 174.53 2kui n GLY 590 N 4.79 -1.07 3.77 -3.33 0.00 -1.26 -5.02 105.19 103.07 2kui n GLY 590 Ca 0.03 -1.71 -0.38 0.00 0.00 0.00 0.00 46.02 43.96 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 -3.88 3.09 -0.16 4.61 0.00 -1.26 -4.97 121.76 119.18 2kui s ALA 591 Ca 0.26 0.94 -0.24 0.00 0.00 0.00 0.00 51.96 52.92 2kui s ALA 591 Cb -0.01 -3.37 -0.02 0.00 0.00 0.00 0.00 23.12 19.72 2kui s ALA 591 CO 0.18 -0.55 0.77 -0.51 0.00 0.00 0.00 175.76 175.65 2kui s ASP 592 N -1.24 6.91 -0.11 0.00 1.01 -1.26 -4.86 116.67 117.12 2kui s ASP 592 Ca 0.59 1.12 0.02 0.00 0.71 0.00 0.00 52.55 54.99 2kui s ASP 592 Cb -0.29 -2.43 0.02 0.00 1.01 0.00 0.00 42.92 41.22 2kui s ASP 592 CO 0.36 -0.33 -0.15 -0.69 0.21 0.00 0.00 175.17 174.57 2kui s VAL 593 N 1.88 1.53 -0.38 -1.27 1.01 0.12 -4.92 120.40 118.37 2kui s VAL 593 Ca 0.36 -0.66 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 2kui s VAL 593 Cb -0.17 -1.40 0.01 0.00 0.00 0.00 0.00 36.38 34.82 2kui s VAL 593 CO 0.13 0.45 1.35 -0.62 0.00 0.00 0.00 175.10 176.41 2kui s ASP 594 N 1.03 6.48 -0.01 3.32 -1.08 -1.26 -1.94 116.67 123.21 2kui s ASP 594 Ca -0.05 0.93 0.06 0.00 -0.52 0.00 0.00 52.55 52.97 2kui s ASP 594 Cb -0.15 -2.54 -0.10 0.00 -1.46 0.00 0.00 42.92 38.67 2kui s ASP 594 CO -0.02 -1.30 0.14 0.00 0.52 0.00 0.00 175.17 174.51 2kui n ALA 595 N 8.33 2.25 0.00 3.66 0.00 -1.26 -5.02 120.51 128.46 2kui n ALA 595 Ca 0.16 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2kui n ALA 595 Cb 0.48 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 19.71 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 2.12 3.93 0.37 0.00 0.00 -1.26 -4.81 105.19 105.54 2kui n GLY 596 Ca -0.01 -1.47 0.04 0.00 0.00 0.00 0.00 46.02 44.59 2kui n GLY 596 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2kui h GLY 597 N 0.00 1.57 2.00 -0.02 0.00 -1.97 0.48 103.07 105.13 2kui h GLY 597 Ca 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 46.85 2kui h GLY 597 CO 0.00 0.26 -0.14 1.76 0.00 0.00 0.00 176.54 178.42 2kui h SER 598 N 1.10 0.00 -0.02 0.19 0.02 -2.02 -2.61 113.55 110.21 2kui h SER 598 Ca 0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.41 2kui h SER 598 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2kui h SER 598 CO -0.21 0.14 -0.06 0.00 -1.14 0.00 0.00 176.83 175.55 2kui n GLN 599 N -3.55 1.12 -2.11 3.45 1.13 -0.15 -4.93 117.38 112.35 2kui n GLN 599 Ca -0.01 -1.16 -0.35 0.00 -1.94 0.00 0.00 57.00 53.53 2kui n GLN 599 Cb 0.28 -1.24 0.02 0.00 0.11 0.00 0.00 30.24 29.41 2kui n GLN 599 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 2kui s HIS 600 N -1.24 2.55 0.00 1.08 3.76 -0.02 -2.70 115.29 118.72 2kui s HIS 600 Ca 0.15 1.54 0.00 0.00 -0.15 0.00 0.00 55.06 56.59 2kui s HIS 600 Cb 0.11 -3.35 0.00 0.00 1.11 0.00 0.00 32.58 30.45 2kui s HIS 600 CO 0.21 -1.83 0.00 0.09 -0.85 0.00 0.00 174.74 172.36 2kui n ASN 601 N -1.55 0.00 -4.75 1.40 3.02 -1.26 -4.92 115.26 107.21 2kui n ASN 601 Ca 0.12 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.27 2kui n ASN 601 Cb 0.51 -1.55 -0.05 0.00 -0.61 0.00 0.00 39.78 38.07 2kui n ASN 601 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2kui s ARG 602 N -0.31 4.79 0.41 3.52 3.00 -1.10 0.45 118.95 129.71 2kui s ARG 602 Ca 0.00 1.53 -0.26 0.00 -1.00 0.00 0.00 55.73 56.00 2kui s ARG 602 Cb 0.00 -3.29 -0.09 0.00 0.00 0.00 0.00 34.95 31.57 2kui s ARG 602 CO 0.00 0.40 1.35 0.54 0.00 0.00 0.00 175.30 177.59 2kui s VAL 603 N -0.87 2.43 -0.24 7.11 0.11 -0.79 -3.13 120.40 125.02 2kui s VAL 603 Ca 0.43 0.39 -0.13 0.00 -2.93 0.00 0.00 61.98 59.74 2kui s VAL 603 Cb -0.26 -3.23 -0.16 0.00 -1.53 0.00 0.00 36.38 31.19 2kui s VAL 603 CO 0.33 0.06 -0.11 0.55 -3.33 0.00 0.00 175.10 172.60 2kui n VAL 604 N 0.14 1.55 -3.55 2.04 3.14 0.18 -4.87 118.33 116.96 2kui n VAL 604 Ca 0.03 -0.33 -0.14 0.00 -2.96 0.00 0.00 64.34 60.95 2kui n VAL 604 Cb 0.42 -1.85 -0.05 0.00 -1.06 0.00 0.00 33.84 31.30 2kui n VAL 604 CO 0.00 0.00 0.00 -0.72 -6.46 0.00 0.00 176.83 169.65 2kui s TYR 605 N -2.47 -0.44 -0.13 1.45 1.13 -1.26 -5.03 117.35 110.59 2kui s TYR 605 Ca -0.34 0.44 0.01 0.00 -1.41 0.00 0.00 57.07 55.77 2kui s TYR 605 Cb 0.11 0.38 -0.01 0.00 -1.10 0.00 0.00 41.96 41.34 2kui s TYR 605 CO 0.56 -0.68 -0.16 1.14 -2.51 0.00 0.00 175.55 173.90 2kui s GLN 606 N -2.71 3.28 0.18 -3.49 -2.07 -1.26 -3.37 119.66 110.21 2kui s GLN 606 Ca -0.04 -0.74 -0.20 0.00 -1.82 0.00 0.00 55.36 52.57 2kui s GLN 606 Cb -0.00 -2.57 0.11 0.00 -1.09 0.00 0.00 33.01 29.46 2kui s GLN 606 CO -0.04 0.16 1.62 -0.97 -1.32 0.00 0.00 175.29 174.73 2kui h ASN 607 N 6.86 -0.83 -3.52 12.60 -0.73 -0.57 -3.29 115.58 126.11 2kui h ASN 607 Ca -0.26 0.18 -0.72 0.00 1.87 0.00 0.00 56.30 57.37 2kui h ASN 607 Cb 1.21 0.43 -0.22 0.00 0.27 0.00 0.00 38.32 40.02 2kui h ASN 607 CO 0.54 -0.26 -0.45 -2.16 -0.37 0.00 0.00 177.43 174.73 2kui s PRO 608 N -6.10 2.96 0.89 6.67 0.05 -1.26 -5.05 135.00 133.15 2kui s PRO 608 Ca -0.14 -1.02 -0.10 0.00 0.05 0.00 0.00 61.00 59.78 2kui s PRO 608 Cb 0.15 -3.93 0.13 0.00 0.05 0.00 0.00 34.50 30.90 2kui s PRO 608 CO 0.70 -0.73 1.13 -2.14 0.05 0.00 0.00 177.00 176.01 2kui s PRO 609 N 1.66 1.27 0.12 0.56 0.02 -1.24 -4.81 135.00 132.57 2kui s PRO 609 Ca 0.04 1.42 -0.33 0.00 0.02 0.00 0.00 61.00 62.16 2kui s PRO 609 Cb -0.19 -1.77 -0.12 0.00 0.02 0.00 0.00 34.50 32.44 2kui s PRO 609 CO 0.09 -2.41 1.73 0.00 -0.33 0.00 0.00 177.00 176.08 2kui n ALA 610 N -4.07 1.77 0.00 -1.55 0.00 -1.26 -1.00 120.51 114.40 2kui n ALA 610 Ca 0.11 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2kui n ALA 610 Cb 0.52 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.50 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 3.91 0.33 3.91 0.00 0.00 -0.83 -4.96 105.19 107.55 2kui n GLY 611 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 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 5.03 -0.11 2.61 2.01 -0.17 -4.71 115.64 118.30 2kui s THR 612 Ca 0.00 0.02 -0.27 0.00 0.31 0.00 0.00 61.69 61.75 2kui s THR 612 Cb 0.00 -3.75 -0.02 0.00 0.01 0.00 0.00 72.50 68.74 2kui s THR 612 CO 0.00 -0.36 0.88 -0.83 -0.69 0.00 0.00 174.62 173.61 2kui s GLY 613 N -3.28 2.37 -0.06 4.40 0.00 -1.26 -0.73 107.32 108.76 2kui s GLY 613 Ca 0.44 0.21 -0.03 0.00 0.00 0.00 0.00 44.72 45.34 2kui s GLY 613 CO 0.31 1.66 0.08 -1.34 0.00 0.00 0.00 173.10 173.80 2kui s VAL 614 N 1.73 4.84 0.49 1.40 -7.23 0.63 -4.69 120.40 117.57 2kui s VAL 614 Ca 0.43 -0.17 -0.22 0.00 -1.81 0.00 0.00 61.98 60.20 2kui s VAL 614 Cb -0.18 -3.13 -0.09 0.00 0.56 0.00 0.00 36.38 33.55 2kui s VAL 614 CO 0.17 0.51 0.94 -0.46 -0.31 0.00 0.00 175.10 175.95 2kui n ASN 615 N 1.71 0.87 -0.32 4.85 2.04 -1.26 -1.29 115.26 121.86 2kui n ASN 615 Ca -0.17 0.94 0.23 0.00 -0.44 0.00 0.00 54.58 55.14 2kui n ASN 615 Cb 0.54 -1.34 0.52 0.00 -2.53 0.00 0.00 39.78 36.96 2kui n ASN 615 CO 0.00 0.00 0.00 0.03 -0.44 0.00 0.00 177.26 176.85 2kui h ARG 616 N 1.10 0.36 -0.00 -3.83 -0.00 -1.95 0.72 114.38 110.77 2kui h ARG 616 Ca -0.46 -0.02 -0.15 0.00 -0.50 0.00 0.00 59.98 58.85 2kui h ARG 616 Cb 1.35 -0.08 -0.02 0.00 0.00 0.00 0.00 29.97 31.22 2kui h ARG 616 CO 0.54 0.24 -0.70 0.38 0.00 0.00 0.00 179.97 180.43 2kui h ASP 617 N 0.37 0.03 0.00 7.04 2.03 -1.90 -3.48 116.42 120.51 2kui h ASP 617 Ca 0.59 -0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.87 2kui h ASP 617 Cb 1.54 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 40.03 2kui h ASP 617 CO -0.28 0.72 0.00 0.61 -1.03 0.00 0.00 179.24 179.26 2kui n GLY 618 N 0.48 0.82 3.66 7.15 0.00 0.24 -3.64 105.19 113.91 2kui n GLY 618 Ca -0.01 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 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 3.81 -0.05 -0.61 -1.16 -1.26 -4.38 121.20 115.55 2kui s ILE 619 Ca 0.00 0.97 0.02 0.00 -0.51 0.00 0.00 60.65 61.14 2kui s ILE 619 Cb 0.00 -3.64 0.01 0.00 0.61 0.00 0.00 42.46 39.44 2kui s ILE 619 CO 0.00 -0.10 -0.11 -0.51 -2.81 0.00 0.00 174.94 171.41 2kui s ILE 620 N 3.92 1.02 -0.28 2.00 -1.16 -1.17 -4.76 121.20 120.77 2kui s ILE 620 Ca 0.67 -0.44 -0.08 0.00 -0.51 0.00 0.00 60.65 60.29 2kui s ILE 620 Cb -0.29 -0.93 -0.01 0.00 0.61 0.00 0.00 42.46 41.84 2kui s ILE 620 CO 0.25 0.32 0.10 -0.89 -2.81 0.00 0.00 174.94 171.91 2kui s THR 621 N 0.49 4.30 0.02 4.00 2.01 -1.26 -3.83 115.64 121.36 2kui s THR 621 Ca -0.10 -0.42 0.00 0.00 0.31 0.00 0.00 61.69 61.48 2kui s THR 621 Cb -0.13 -3.14 -0.02 0.00 0.01 0.00 0.00 72.50 69.22 2kui s THR 621 CO 0.02 0.17 -0.03 -1.48 -0.69 0.00 0.00 174.62 172.61 2kui s LEU 622 N 1.58 2.24 0.14 4.42 -0.00 -1.26 0.28 118.68 126.08 2kui s LEU 622 Ca 0.05 -0.50 0.06 0.00 -0.00 0.00 0.00 54.13 53.74 2kui s LEU 622 Cb -0.16 0.09 -0.04 0.00 -0.00 0.00 0.00 46.19 46.08 2kui s LEU 622 CO 0.04 -0.30 -0.14 -0.60 -0.00 0.00 0.00 176.35 175.35 2kui s ARG 623 N -1.46 1.10 0.30 1.48 3.52 -1.22 -4.69 118.95 117.99 2kui s ARG 623 Ca -0.16 -1.33 0.06 0.00 -0.13 0.00 0.00 55.73 54.17 2kui s ARG 623 Cb -0.10 -0.95 -0.06 0.00 -1.56 0.00 0.00 34.95 32.28 2kui s ARG 623 CO -0.01 0.17 -0.04 -0.59 -0.81 0.00 0.00 175.30 174.03 2kui s PHE 624 N -2.40 2.03 0.00 5.12 -0.71 -1.26 0.51 117.98 121.27 2kui s PHE 624 Ca 0.13 -0.72 0.00 0.00 -1.04 0.00 0.00 56.93 55.29 2kui s PHE 624 Cb -0.03 -1.22 0.00 0.00 -1.21 0.00 0.00 43.02 40.56 2kui s PHE 624 CO 0.04 0.27 0.04 0.41 -1.34 0.00 0.00 175.22 174.63 2kui n GLY 625 N -0.65 -2.27 0.00 1.99 0.00 -1.18 -4.59 105.19 98.49 2kui n GLY 625 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14