#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1snu s ILE 358 N 0.00 2.91 -0.15 1.55 -1.09 -1.26 -3.36 121.20 119.80 1snu s ILE 358 Ca 0.00 0.65 0.00 0.00 -2.23 0.00 0.00 60.65 59.07 1snu s ILE 358 Cb 0.00 -3.31 -0.00 0.00 -1.58 0.00 0.00 42.46 37.56 1snu s ILE 358 CO 0.00 -0.04 -0.15 -0.62 -1.23 0.00 0.00 174.94 172.90 1snu s ASP 359 N -1.39 3.73 0.68 3.58 -1.08 0.44 -4.84 116.67 117.80 1snu s ASP 359 Ca 0.68 -0.44 -0.05 0.00 -0.52 0.00 0.00 52.55 52.21 1snu s ASP 359 Cb -0.30 -1.58 0.06 0.00 -1.46 0.00 0.00 42.92 39.65 1snu s ASP 359 CO 0.35 0.09 0.98 -2.16 0.52 0.00 0.00 175.17 174.95 1snu s PRO 360 N 0.76 2.17 -1.00 4.34 0.04 -1.26 -4.18 135.00 135.87 1snu s PRO 360 Ca -0.06 -0.42 -0.25 0.00 0.04 0.00 0.00 61.00 60.31 1snu s PRO 360 Cb -0.15 -2.23 -0.22 0.00 0.04 0.00 0.00 34.50 31.93 1snu s PRO 360 CO 0.01 -1.19 2.04 0.45 0.04 0.00 0.00 177.00 178.35 1snu n SER 361 N -2.83 1.07 -0.56 6.66 2.88 -1.26 -4.26 113.62 115.31 1snu n SER 361 Ca 0.09 -2.38 0.06 0.00 -1.33 0.00 0.00 58.87 55.31 1snu n SER 361 Cb 0.60 -1.65 0.17 0.00 -0.75 0.00 0.00 64.21 62.58 1snu n SER 361 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1snu n GLU 362 N 7.87 2.70 -3.92 -1.46 1.02 -1.26 -5.00 120.64 120.59 1snu n GLU 362 Ca 0.38 -2.32 -0.32 0.00 -0.02 0.00 0.00 57.16 54.87 1snu n GLU 362 Cb 0.47 -1.47 -0.05 0.00 -0.02 0.00 0.00 31.44 30.38 1snu n GLU 362 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1snu s LEU 363 N -1.91 4.35 -0.19 -4.62 1.43 -1.26 -2.27 118.68 114.21 1snu s LEU 363 Ca 0.28 0.31 -0.01 0.00 -1.03 0.00 0.00 54.13 53.67 1snu s LEU 363 Cb 0.20 -2.76 0.00 0.00 0.03 0.00 0.00 46.19 43.67 1snu s LEU 363 CO 0.09 0.22 -0.11 -0.89 0.23 0.00 0.00 176.35 175.89 1snu s THR 364 N -1.40 2.86 -0.38 5.49 2.01 0.19 -4.95 115.64 119.46 1snu s THR 364 Ca 0.31 -0.68 -0.21 0.00 0.31 0.00 0.00 61.69 61.42 1snu s THR 364 Cb -0.13 -2.26 0.01 0.00 0.01 0.00 0.00 72.50 70.14 1snu s THR 364 CO 0.23 0.48 0.67 -0.36 -0.69 0.00 0.00 174.62 174.94 1snu s PHE 365 N 1.21 3.11 -0.01 4.92 0.40 -1.26 -2.21 117.98 124.15 1snu s PHE 365 Ca 0.02 0.27 -0.00 0.00 -0.60 0.00 0.00 56.93 56.62 1snu s PHE 365 Cb -0.14 -3.26 -0.00 0.00 0.51 0.00 0.00 43.02 40.13 1snu s PHE 365 CO -0.05 -0.72 -0.01 0.28 0.70 0.00 0.00 175.22 175.42 1snu h VAL 366 N 5.76 0.00 -4.13 -0.44 2.07 -1.38 -3.49 116.25 114.64 1snu h VAL 366 Ca -0.26 -0.04 -0.29 0.00 0.82 0.00 0.00 66.70 66.93 1snu h VAL 366 Cb 1.10 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.73 1snu h VAL 366 CO 0.87 0.00 -0.62 -1.10 0.02 0.00 0.00 177.57 176.74 1snu s GLN 367 N -1.05 1.28 -0.21 1.57 -1.52 -1.15 -4.94 119.66 113.63 1snu s GLN 367 Ca -0.01 -1.68 -0.11 0.00 -1.95 0.00 0.00 55.36 51.62 1snu s GLN 367 Cb 0.00 -0.03 -0.05 0.00 -0.22 0.00 0.00 33.01 32.71 1snu s GLN 367 CO 0.01 -0.32 0.16 -2.00 -0.25 0.00 0.00 175.29 172.89 1snu s GLU 368 N -4.07 4.14 -0.11 2.91 2.12 -1.26 0.43 118.70 122.85 1snu s GLU 368 Ca 0.36 -0.21 0.14 0.00 0.36 0.00 0.00 54.97 55.63 1snu s GLU 368 Cb 0.07 -3.48 0.29 0.00 0.26 0.00 0.00 34.13 31.28 1snu s GLU 368 CO 0.12 0.18 1.15 0.44 -0.54 0.00 0.00 175.26 176.60 1snu n ILE 369 N 3.89 1.39 0.00 -3.70 -5.35 0.17 -4.90 119.36 110.85 1snu n ILE 369 Ca -0.15 -1.97 0.00 0.00 -0.27 0.00 0.00 62.75 60.36 1snu n ILE 369 Cb 0.52 0.06 0.00 0.00 -1.74 0.00 0.00 39.64 38.48 1snu n ILE 369 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1snu n GLY 370 N -0.83 3.42 0.00 3.28 0.00 -1.24 -4.89 105.19 104.94 1snu n GLY 370 Ca 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1snu n GLY 370 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1snu n SER 371 N 0.00 1.86 0.00 1.61 7.64 -1.26 -0.33 113.62 123.14 1snu n SER 371 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1snu n SER 371 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1snu n SER 371 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1snu n GLY 372 N 5.00 3.81 3.63 0.23 0.00 -1.25 -4.97 105.19 111.65 1snu n GLY 372 Ca 0.00 -1.67 -0.43 0.00 0.00 0.00 0.00 46.02 43.92 1snu n GLY 372 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1snu s GLN 373 N -3.46 3.98 0.00 1.61 0.74 -1.26 -3.12 119.66 118.15 1snu s GLN 373 Ca 0.00 1.01 0.00 0.00 0.05 0.00 0.00 55.36 56.42 1snu s GLN 373 Cb 0.00 -3.79 0.00 0.00 1.10 0.00 0.00 33.01 30.32 1snu s GLN 373 CO 0.00 -1.02 0.00 0.34 -0.55 0.00 0.00 175.29 174.06 1snu n PHE 374 N 7.15 0.00 0.00 1.67 7.35 -1.24 -5.07 117.46 127.33 1snu n PHE 374 Ca 0.12 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.81 1snu n PHE 374 Cb 0.47 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.30 1snu n PHE 374 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1snu n GLY 375 N 0.00 2.09 3.86 7.13 0.00 0.75 -4.40 105.19 114.61 1snu n GLY 375 Ca 0.00 -2.01 -0.21 0.00 0.00 0.00 0.00 46.02 43.80 1snu n GLY 375 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1snu s LEU 376 N 0.00 3.77 -0.10 0.99 1.43 -1.22 -3.77 118.68 119.79 1snu s LEU 376 Ca 0.00 -0.32 0.04 0.00 -1.03 0.00 0.00 54.13 52.81 1snu s LEU 376 Cb 0.00 -2.35 0.00 0.00 0.03 0.00 0.00 46.19 43.87 1snu s LEU 376 CO 0.00 -0.19 -0.23 -0.69 0.23 0.00 0.00 176.35 175.46 1snu s VAL 377 N -2.20 1.99 0.15 -1.59 1.01 0.55 -0.96 120.40 119.36 1snu s VAL 377 Ca 0.37 -0.98 0.09 0.00 0.00 0.00 0.00 61.98 61.46 1snu s VAL 377 Cb -0.07 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1snu s VAL 377 CO 0.26 0.54 -0.12 -1.00 0.00 0.00 0.00 175.10 174.79 1snu s HIS 378 N 0.37 2.61 0.06 5.22 3.76 0.24 0.44 115.29 127.99 1snu s HIS 378 Ca -0.19 -0.23 -0.21 0.00 -0.15 0.00 0.00 55.06 54.29 1snu s HIS 378 Cb -0.18 -1.32 -0.06 0.00 1.11 0.00 0.00 32.58 32.13 1snu s HIS 378 CO 0.09 0.47 0.61 -1.17 -0.85 0.00 0.00 174.74 173.89 1snu s LEU 379 N -2.57 4.50 0.00 0.89 2.96 0.17 -0.82 118.68 123.80 1snu s LEU 379 Ca 0.23 1.29 -0.03 0.00 -0.22 0.00 0.00 54.13 55.40 1snu s LEU 379 Cb -0.09 -2.97 0.01 0.00 0.50 0.00 0.00 46.19 43.64 1snu s LEU 379 CO 0.14 0.20 0.15 0.61 -1.32 0.00 0.00 176.35 176.13 1snu n GLY 380 N 1.97 2.00 2.94 7.98 0.00 -0.54 -0.88 105.19 118.65 1snu n GLY 380 Ca -0.08 -1.13 -0.12 0.00 0.00 0.00 0.00 46.02 44.68 1snu n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1snu s TYR 381 N -7.00 -0.07 -0.28 1.61 1.51 -0.94 -1.01 117.35 111.18 1snu s TYR 381 Ca 0.04 0.16 -0.04 0.00 -1.01 0.00 0.00 57.07 56.22 1snu s TYR 381 Cb -0.01 0.02 0.03 0.00 -0.11 0.00 0.00 41.96 41.89 1snu s TYR 381 CO 0.03 -0.04 0.01 -0.46 -1.11 0.00 0.00 175.55 173.98 1snu s TRP 382 N 0.01 3.15 -0.54 2.71 -0.00 -0.03 -0.64 118.94 123.60 1snu s TRP 382 Ca -0.00 -1.45 0.00 0.00 -0.00 0.00 0.00 56.10 54.65 1snu s TRP 382 Cb -0.01 -2.15 0.00 0.00 -0.00 0.00 0.00 33.47 31.32 1snu s TRP 382 CO 0.00 -0.70 0.00 1.28 -0.00 0.00 0.00 176.95 177.53 1snu n LEU 383 N 4.73 0.21 0.00 5.86 4.77 -0.96 -2.57 117.00 129.04 1snu n LEU 383 Ca -0.15 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1snu n LEU 383 Cb 0.46 -2.25 0.00 0.00 -2.33 0.00 0.00 43.42 39.30 1snu n LEU 383 CO 0.28 -0.85 0.00 -3.20 -1.33 0.00 0.00 177.39 172.29 1snu n ASN 384 N -0.82 0.00 0.05 -1.43 2.85 -1.26 -4.64 115.26 110.01 1snu n ASN 384 Ca -0.05 0.00 0.01 0.00 -0.11 0.00 0.00 54.58 54.43 1snu n ASN 384 Cb 0.46 0.00 0.05 0.00 1.24 0.00 0.00 39.78 41.54 1snu n ASN 384 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 1snu n LYS 385 N 0.00 0.02 -3.57 1.20 0.00 -1.23 -4.29 118.16 110.29 1snu n LYS 385 Ca 0.00 0.26 -0.20 0.00 0.00 0.00 0.00 58.31 58.37 1snu n LYS 385 Cb 0.00 -1.97 -0.15 0.00 0.00 0.00 0.00 35.03 32.92 1snu n LYS 385 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1snu s ASP 386 N -2.49 1.52 -0.66 3.14 1.01 -1.06 -5.00 116.67 113.13 1snu s ASP 386 Ca -0.00 -0.21 -0.27 0.00 0.71 0.00 0.00 52.55 52.78 1snu s ASP 386 Cb 0.01 0.16 0.02 0.00 1.01 0.00 0.00 42.92 44.12 1snu s ASP 386 CO 0.02 -0.31 1.39 -0.75 0.21 0.00 0.00 175.17 175.73 1snu s LYS 387 N 2.26 3.17 0.47 8.23 2.20 -1.26 -0.85 119.74 133.96 1snu s LYS 387 Ca 0.05 0.12 0.07 0.00 -0.36 0.00 0.00 55.97 55.85 1snu s LYS 387 Cb -0.15 -4.18 0.01 0.00 -1.51 0.00 0.00 37.83 32.00 1snu s LYS 387 CO -0.10 -2.13 0.44 0.14 -0.36 0.00 0.00 175.35 173.35 1snu s VAL 388 N 6.24 2.31 -0.17 4.02 -7.23 -0.18 -1.88 120.40 123.50 1snu s VAL 388 Ca 0.45 -1.33 0.01 0.00 -1.81 0.00 0.00 61.98 59.30 1snu s VAL 388 Cb -0.09 -2.64 0.03 0.00 0.56 0.00 0.00 36.38 34.23 1snu s VAL 388 CO 0.20 0.00 -0.16 0.00 -0.31 0.00 0.00 175.10 174.83 1snu s ALA 389 N -2.58 2.09 -0.24 1.32 0.00 0.08 -1.47 121.76 120.96 1snu s ALA 389 Ca 0.46 -1.11 -0.07 0.00 0.00 0.00 0.00 51.96 51.24 1snu s ALA 389 Cb -0.03 -1.16 -0.02 0.00 0.00 0.00 0.00 23.12 21.90 1snu s ALA 389 CO 0.28 -0.48 0.05 0.42 0.00 0.00 0.00 175.76 176.02 1snu s ILE 390 N 1.38 4.11 -0.35 0.00 1.01 -0.00 0.58 121.20 127.93 1snu s ILE 390 Ca 0.03 -0.24 -0.11 0.00 0.00 0.00 0.00 60.65 60.34 1snu s ILE 390 Cb -0.14 -2.91 0.01 0.00 0.01 0.00 0.00 42.46 39.43 1snu s ILE 390 CO -0.11 0.36 0.19 -0.75 0.00 0.00 0.00 174.94 174.63 1snu s LYS 391 N 1.57 3.06 0.68 2.79 2.20 -0.31 0.79 119.74 130.53 1snu s LYS 391 Ca 0.06 -0.92 -0.03 0.00 -0.36 0.00 0.00 55.97 54.72 1snu s LYS 391 Cb -0.15 -3.69 0.08 0.00 -1.51 0.00 0.00 37.83 32.56 1snu s LYS 391 CO 0.02 -0.58 0.96 0.95 -0.36 0.00 0.00 175.35 176.34 1snu s THR 392 N 1.59 2.33 0.00 3.43 -4.23 -0.13 -1.22 115.64 117.40 1snu s THR 392 Ca 0.03 -0.46 0.00 0.00 -1.18 0.00 0.00 61.69 60.08 1snu s THR 392 Cb -0.18 -2.86 0.00 0.00 1.34 0.00 0.00 72.50 70.79 1snu s THR 392 CO 0.07 0.00 0.00 -0.38 -0.54 0.00 0.00 174.62 173.77 1snu n ILE 393 N -2.79 0.00 0.00 2.99 2.08 -1.03 -3.32 119.36 117.29 1snu n ILE 393 Ca 0.11 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.42 1snu n ILE 393 Cb 0.60 -0.74 0.00 0.00 -0.75 0.00 0.00 39.64 38.75 1snu n ILE 393 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 1snu n ARG 394 N -1.19 0.00 0.06 0.38 5.12 -1.26 0.26 116.66 120.03 1snu n ARG 394 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1snu n ARG 394 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1snu n ARG 394 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1snu n GLU 395 N 0.00 0.00 -0.38 5.56 1.02 -1.26 -4.87 120.64 120.71 1snu n GLU 395 Ca 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.21 1snu n GLU 395 Cb 0.00 0.00 0.14 0.00 -0.02 0.00 0.00 31.44 31.56 1snu n GLU 395 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1snu n GLY 396 N -0.18 4.16 0.19 0.62 0.00 -1.26 -4.73 105.19 103.99 1snu n GLY 396 Ca 0.00 -1.03 0.08 0.00 0.00 0.00 0.00 46.02 45.07 1snu n GLY 396 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1snu h ALA 397 N 0.36 0.88 -2.24 4.61 0.00 -1.90 -3.46 119.26 117.51 1snu h ALA 397 Ca -0.02 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 1snu h ALA 397 Cb 1.11 -0.03 -0.22 0.00 0.00 0.00 0.00 17.79 18.64 1snu h ALA 397 CO 0.01 0.27 -0.03 -1.64 0.00 0.00 0.00 179.25 177.86 1snu s MET 398 N -3.18 0.68 0.60 0.00 -1.94 -1.26 -4.89 119.30 109.31 1snu s MET 398 Ca 0.05 0.94 -0.19 0.00 -1.71 0.00 0.00 55.69 54.77 1snu s MET 398 Cb 0.07 0.26 -0.03 0.00 2.01 0.00 0.00 34.83 37.13 1snu s MET 398 CO 0.69 -0.11 1.26 0.43 -0.01 0.00 0.00 175.02 177.28 1snu n SER 399 N 3.29 2.07 0.04 3.03 7.64 -1.26 -4.81 113.62 123.62 1snu n SER 399 Ca -0.16 0.88 0.04 0.00 1.01 0.00 0.00 58.87 60.63 1snu n SER 399 Cb 0.56 -1.53 0.42 0.00 -1.01 0.00 0.00 64.21 62.65 1snu n SER 399 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1snu h GLU 400 N 0.84 0.46 -0.10 1.43 5.08 -2.00 -1.44 114.58 118.85 1snu h GLU 400 Ca -0.50 -0.04 -0.23 0.00 -1.00 0.00 0.00 59.36 57.58 1snu h GLU 400 Cb 1.33 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 30.50 1snu h GLU 400 CO 0.54 0.35 -0.84 1.05 -1.00 0.00 0.00 179.01 179.11 1snu h GLU 401 N 0.46 0.74 -0.64 2.33 4.11 -1.98 -2.07 114.58 117.53 1snu h GLU 401 Ca 0.12 -0.67 0.05 0.00 0.07 0.00 0.00 59.36 58.93 1snu h GLU 401 Cb 0.04 0.16 -0.05 0.00 0.50 0.00 0.00 28.75 29.40 1snu h GLU 401 CO -0.02 1.26 0.37 0.22 0.07 0.00 0.00 179.01 180.91 1snu h ASP 402 N 0.45 0.57 0.16 3.06 1.82 -1.64 0.12 116.42 120.96 1snu h ASP 402 Ca -0.08 0.02 -0.28 0.00 -0.39 0.00 0.00 57.03 56.30 1snu h ASP 402 Cb 1.48 -0.09 0.03 0.00 0.68 0.00 0.00 39.33 41.43 1snu h ASP 402 CO 0.17 0.38 -1.19 0.15 -1.61 0.00 0.00 179.24 177.14 1snu h PHE 403 N 0.70 0.89 -0.22 0.28 3.57 -1.38 -2.87 116.94 117.92 1snu h PHE 403 Ca 0.28 -0.60 0.04 0.00 3.53 0.00 0.00 57.97 61.22 1snu h PHE 403 Cb 0.13 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 1snu h PHE 403 CO -0.07 1.45 -0.06 0.82 -2.23 0.00 0.00 178.31 178.22 1snu h ILE 404 N 0.08 0.76 0.00 1.41 2.04 -1.08 0.50 117.51 121.22 1snu h ILE 404 Ca -0.19 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 1snu h ILE 404 Cb 1.90 0.76 -0.00 0.00 -0.74 0.00 0.00 36.82 38.74 1snu h ILE 404 CO 0.23 0.00 -0.07 -0.08 0.00 0.00 0.00 178.15 178.22 1snu h GLU 405 N -0.01 0.00 0.13 2.37 4.81 -0.86 -2.02 114.58 118.99 1snu h GLU 405 Ca 0.11 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.12 1snu h GLU 405 Cb 0.18 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.57 1snu h GLU 405 CO -0.23 0.07 -1.05 1.49 -0.73 0.00 0.00 179.01 178.56 1snu h GLU 406 N 0.00 0.28 -0.04 1.92 4.81 -0.64 -3.20 114.58 117.71 1snu h GLU 406 Ca -0.00 -0.47 -0.02 0.00 -0.13 0.00 0.00 59.36 58.74 1snu h GLU 406 Cb 0.18 0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.73 1snu h GLU 406 CO 0.01 1.23 -0.08 0.00 -0.73 0.00 0.00 179.01 179.43 1snu h ALA 407 N 0.02 1.80 0.63 2.92 0.00 0.15 -1.97 119.26 122.81 1snu h ALA 407 Ca -0.21 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 1snu h ALA 407 Cb 1.69 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.45 1snu h ALA 407 CO 0.11 0.15 -0.30 0.93 0.00 0.00 0.00 179.25 180.14 1snu h GLU 408 N 0.05 -0.81 -0.98 0.00 5.08 -1.47 -2.13 114.58 114.33 1snu h GLU 408 Ca 0.01 0.06 0.15 0.00 -1.00 0.00 0.00 59.36 58.57 1snu h GLU 408 Cb 0.18 0.18 -0.09 0.00 0.50 0.00 0.00 28.75 29.53 1snu h GLU 408 CO 0.01 -0.52 0.61 -0.24 -1.00 0.00 0.00 179.01 177.87 1snu h VAL 409 N -1.19 0.84 -0.49 3.13 3.04 -1.52 0.20 116.25 120.26 1snu h VAL 409 Ca -0.09 -0.29 -0.02 0.00 -1.01 0.00 0.00 66.70 65.29 1snu h VAL 409 Cb 0.67 -0.09 -0.02 0.00 -2.01 0.00 0.00 31.29 29.83 1snu h VAL 409 CO 0.14 0.16 0.22 -0.03 -1.01 0.00 0.00 177.57 177.05 1snu h MET 410 N 0.85 0.70 -0.00 4.17 4.05 -1.32 -0.14 114.93 123.25 1snu h MET 410 Ca 0.51 -0.09 0.00 0.00 -0.28 0.00 0.00 59.70 59.84 1snu h MET 410 Cb 0.67 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.33 1snu h MET 410 CO -0.28 0.56 -0.03 -1.33 0.23 0.00 0.00 176.91 176.06 1snu n MET 411 N -4.37 0.28 0.04 0.39 2.81 0.58 -2.96 117.12 113.89 1snu n MET 411 Ca 0.04 -0.02 0.01 0.00 -1.81 0.00 0.00 57.70 55.92 1snu n MET 411 Cb 0.14 -1.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.07 1snu n MET 411 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1snu h LYS 412 N 0.04 0.00 -5.40 0.03 1.63 0.19 -3.45 116.57 109.61 1snu h LYS 412 Ca 0.00 0.00 -0.60 0.00 -0.85 0.00 0.00 60.65 59.20 1snu h LYS 412 Cb 0.38 0.00 -0.11 0.00 -0.60 0.00 0.00 32.23 31.89 1snu h LYS 412 CO 0.00 0.27 -0.29 -0.51 -3.45 0.00 0.00 179.45 175.47 1snu s LEU 413 N -5.76 4.18 -0.16 5.20 1.43 -0.80 -5.07 118.68 117.70 1snu s LEU 413 Ca -0.03 0.45 -0.08 0.00 -1.03 0.00 0.00 54.13 53.44 1snu s LEU 413 Cb 0.09 -2.40 0.06 0.00 0.03 0.00 0.00 46.19 43.96 1snu s LEU 413 CO 0.81 0.01 0.37 -0.94 0.23 0.00 0.00 176.35 176.83 1snu s SER 414 N 0.84 -0.43 -0.01 2.29 1.04 -1.26 -4.93 113.70 111.23 1snu s SER 414 Ca 0.16 0.82 -0.23 0.00 0.48 0.00 0.00 55.95 57.18 1snu s SER 414 Cb -0.14 0.72 0.05 0.00 0.10 0.00 0.00 66.02 66.75 1snu s SER 414 CO 0.06 -0.19 0.50 -2.28 0.98 0.00 0.00 173.24 172.31 1snu s HIS 415 N 1.46 -0.41 -0.92 5.02 5.04 -1.26 -5.04 115.29 119.17 1snu s HIS 415 Ca -0.09 0.63 0.04 0.00 -1.54 0.00 0.00 55.06 54.10 1snu s HIS 415 Cb -0.09 0.27 0.19 0.00 0.04 0.00 0.00 32.58 32.99 1snu s HIS 415 CO -0.12 -0.54 1.12 -2.30 -2.34 0.00 0.00 174.74 170.57 1snu n PRO 416 N 0.91 0.01 -0.15 2.88 -0.02 -1.26 -1.31 135.00 136.07 1snu n PRO 416 Ca -0.20 0.48 0.07 0.00 -2.02 0.00 0.00 63.50 61.83 1snu n PRO 416 Cb 0.57 -1.55 0.15 0.00 -0.02 0.00 0.00 33.50 32.66 1snu n PRO 416 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1snu n LYS 417 N -1.58 2.23 -4.67 -0.52 4.01 -1.26 -4.91 118.16 111.46 1snu n LYS 417 Ca 0.00 -1.92 -0.33 0.00 -0.51 0.00 0.00 58.31 55.56 1snu n LYS 417 Cb 0.03 -1.32 -0.12 0.00 -0.51 0.00 0.00 35.03 33.11 1snu n LYS 417 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1snu s LEU 418 N -1.06 2.94 0.19 -0.35 1.43 -0.43 -1.00 118.68 120.41 1snu s LEU 418 Ca 0.25 -0.17 -0.31 0.00 -1.03 0.00 0.00 54.13 52.87 1snu s LEU 418 Cb 0.14 -1.66 -0.09 0.00 0.03 0.00 0.00 46.19 44.61 1snu s LEU 418 CO 0.19 0.32 1.45 -0.69 0.23 0.00 0.00 176.35 177.85 1snu s VAL 419 N -0.86 2.83 0.28 -1.59 1.01 -1.20 -4.69 120.40 116.19 1snu s VAL 419 Ca 0.14 0.64 -0.19 0.00 0.00 0.00 0.00 61.98 62.58 1snu s VAL 419 Cb -0.11 -3.41 -0.09 0.00 0.00 0.00 0.00 36.38 32.77 1snu s VAL 419 CO 0.04 0.08 0.76 -1.10 0.00 0.00 0.00 175.10 174.88 1snu s GLN 420 N 0.39 4.19 -0.06 2.72 -0.21 -1.26 -4.94 119.66 120.49 1snu s GLN 420 Ca 0.63 0.86 -0.02 0.00 0.02 0.00 0.00 55.36 56.85 1snu s GLN 420 Cb -0.41 -2.66 -0.04 0.00 1.00 0.00 0.00 33.01 30.91 1snu s GLN 420 CO 0.37 0.27 0.06 -1.17 -2.12 0.00 0.00 175.29 172.69 1snu s LEU 421 N -2.43 3.85 -0.02 2.90 2.96 -1.26 0.16 118.68 124.84 1snu s LEU 421 Ca 0.49 0.21 0.18 0.00 -0.22 0.00 0.00 54.13 54.79 1snu s LEU 421 Cb -0.14 -2.03 -0.21 0.00 0.50 0.00 0.00 46.19 44.32 1snu s LEU 421 CO 0.19 0.35 0.56 -1.22 -1.32 0.00 0.00 176.35 174.91 1snu n TYR 422 N 1.76 0.52 -3.02 5.38 4.02 0.42 -4.87 117.16 121.37 1snu n TYR 422 Ca -0.17 0.17 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1snu n TYR 422 Cb 0.54 -0.94 0.00 0.00 -0.02 0.00 0.00 39.34 38.91 1snu n TYR 422 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1snu n GLY 423 N 1.46 -0.54 3.23 2.72 0.00 -1.19 -4.91 105.19 105.96 1snu n GLY 423 Ca -0.14 -1.36 -0.16 0.00 0.00 0.00 0.00 46.02 44.35 1snu n GLY 423 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1snu s VAL 424 N -2.85 1.19 -0.36 1.61 1.01 -1.21 -1.62 120.40 118.17 1snu s VAL 424 Ca 0.00 -1.78 -0.00 0.00 0.00 0.00 0.00 61.98 60.19 1snu s VAL 424 Cb 0.00 -1.56 0.09 0.00 0.00 0.00 0.00 36.38 34.91 1snu s VAL 424 CO 0.00 -0.54 0.11 0.00 0.00 0.00 0.00 175.10 174.67 1snu n LEU 426 N 4.50 1.04 -1.20 0.00 4.77 -1.26 -1.58 117.00 123.26 1snu n LEU 426 Ca -0.03 -0.79 0.00 0.00 -0.03 0.00 0.00 56.01 55.16 1snu n LEU 426 Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1snu n LEU 426 CO 0.28 0.22 0.35 -0.62 -1.33 0.00 0.00 177.39 176.29 1snu n GLU 427 N -0.26 0.55 -0.46 3.23 -0.58 -1.26 -4.85 120.64 116.99 1snu n GLU 427 Ca 0.03 0.00 0.06 0.00 -0.42 0.00 0.00 57.16 56.83 1snu n GLU 427 Cb 0.14 -1.23 -0.02 0.00 -0.57 0.00 0.00 31.44 29.77 1snu n GLU 427 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1snu n GLN 428 N 1.01 -0.95 0.00 3.49 1.13 -1.26 -4.86 117.38 115.93 1snu n GLN 428 Ca 0.00 0.64 0.00 0.00 -1.94 0.00 0.00 57.00 55.70 1snu n GLN 428 Cb 0.27 -1.15 0.00 0.00 0.11 0.00 0.00 30.24 29.47 1snu n GLN 428 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1snu n ALA 429 N -1.66 0.00 -1.42 -1.58 0.00 -1.26 -4.59 120.51 110.00 1snu n ALA 429 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 53.44 52.94 1snu n ALA 429 Cb 0.21 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.58 1snu n ALA 429 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1snu n PRO 430 N -0.89 0.79 -1.59 0.00 -0.04 -1.26 -4.81 135.00 127.20 1snu n PRO 430 Ca 0.00 0.19 -0.41 0.00 -0.04 0.00 0.00 63.50 63.24 1snu n PRO 430 Cb 0.00 -2.28 0.02 0.00 -0.04 0.00 0.00 33.50 31.19 1snu n PRO 430 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1snu n ILE 431 N 7.17 2.49 -4.02 0.52 5.41 -1.26 -4.69 119.36 124.99 1snu n ILE 431 Ca 0.46 -0.50 -0.10 0.00 1.00 0.00 0.00 62.75 63.61 1snu n ILE 431 Cb 0.19 -1.06 -0.06 0.00 -0.71 0.00 0.00 39.64 38.00 1snu n ILE 431 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1snu s LEU 433 N -3.03 2.68 -0.43 0.00 2.96 -0.36 -0.85 118.68 119.65 1snu s LEU 433 Ca 0.24 -0.86 -0.21 0.00 -0.22 0.00 0.00 54.13 53.08 1snu s LEU 433 Cb 0.01 -1.54 0.02 0.00 0.50 0.00 0.00 46.19 45.18 1snu s LEU 433 CO 0.08 -0.07 0.68 -0.69 -1.32 0.00 0.00 176.35 175.03 1snu s VAL 434 N 1.26 4.78 0.41 1.68 1.01 -0.64 -1.16 120.40 127.75 1snu s VAL 434 Ca 0.01 0.26 0.08 0.00 0.00 0.00 0.00 61.98 62.33 1snu s VAL 434 Cb -0.15 -4.22 -0.00 0.00 0.00 0.00 0.00 36.38 32.00 1snu s VAL 434 CO -0.09 -0.60 0.49 -0.36 0.00 0.00 0.00 175.10 174.54 1snu s PHE 435 N 2.94 2.79 0.25 5.22 0.40 0.19 0.16 117.98 129.93 1snu s PHE 435 Ca 0.25 -0.42 -0.30 0.00 -0.60 0.00 0.00 56.93 55.86 1snu s PHE 435 Cb -0.14 -2.28 -0.09 0.00 0.51 0.00 0.00 43.02 41.02 1snu s PHE 435 CO 0.20 -0.29 0.96 -1.83 0.70 0.00 0.00 175.22 174.95 1snu s GLU 436 N -4.26 4.83 0.08 0.44 -1.05 0.12 -0.74 118.70 118.12 1snu s GLU 436 Ca 0.52 1.52 -0.31 0.00 -0.15 0.00 0.00 54.97 56.55 1snu s GLU 436 Cb -0.07 -3.26 -0.06 0.00 -0.44 0.00 0.00 34.13 30.30 1snu s GLU 436 CO 0.31 0.48 1.25 0.12 0.95 0.00 0.00 175.26 178.37 1snu s PHE 437 N -1.19 3.39 -0.46 4.83 5.36 -0.79 -4.40 117.98 124.72 1snu s PHE 437 Ca 0.42 1.21 -0.19 0.00 -0.96 0.00 0.00 56.93 57.41 1snu s PHE 437 Cb -0.26 -3.49 0.04 0.00 -0.34 0.00 0.00 43.02 38.96 1snu s PHE 437 CO 0.33 -1.57 0.56 -1.64 -1.46 0.00 0.00 175.22 171.43 1snu s MET 438 N 1.07 3.15 0.00 10.12 -1.94 -1.26 -4.95 119.30 125.48 1snu s MET 438 Ca 0.60 -0.73 0.00 0.00 -1.71 0.00 0.00 55.69 53.85 1snu s MET 438 Cb -0.31 -4.02 0.00 0.00 2.01 0.00 0.00 34.83 32.51 1snu s MET 438 CO 0.29 -1.04 0.41 0.39 -0.01 0.00 0.00 175.02 175.07 1snu n GLU 439 N 5.97 0.00 -0.95 2.03 -0.58 -1.25 -3.18 120.64 122.68 1snu n GLU 439 Ca -0.06 0.04 0.04 0.00 -0.42 0.00 0.00 57.16 56.76 1snu n GLU 439 Cb 0.47 -1.52 0.07 0.00 -0.57 0.00 0.00 31.44 29.89 1snu n GLU 439 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1snu n HIS 440 N -0.91 0.00 -2.24 -0.32 8.25 -0.27 -4.96 115.22 114.77 1snu n HIS 440 Ca 0.00 -0.67 0.10 0.00 -0.26 0.00 0.00 57.72 56.89 1snu n HIS 440 Cb 0.02 -0.15 -0.03 0.00 1.12 0.00 0.00 29.99 30.95 1snu n HIS 440 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1snu n GLY 441 N -0.16 -1.76 3.79 -1.41 0.00 -1.19 -4.52 105.19 99.95 1snu n GLY 441 Ca 0.09 -1.21 -0.31 0.00 0.00 0.00 0.00 46.02 44.59 1snu n GLY 441 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1snu h LEU 443 N -0.80 -0.86 -0.97 0.00 5.85 0.30 -1.11 115.31 117.71 1snu h LEU 443 Ca -0.44 0.08 0.22 0.00 0.84 0.00 0.00 57.88 58.58 1snu h LEU 443 Cb 1.22 0.30 -0.12 0.00 0.37 0.00 0.00 40.66 42.43 1snu h LEU 443 CO 0.54 -0.44 0.55 -1.28 -0.34 0.00 0.00 178.44 177.47 1snu h SER 444 N -0.65 0.63 0.45 1.25 0.87 -1.69 0.66 113.55 115.08 1snu h SER 444 Ca -0.01 0.13 -0.11 0.00 -1.23 0.00 0.00 61.79 60.56 1snu h SER 444 Cb 0.60 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.58 1snu h SER 444 CO -0.08 0.13 -0.52 -0.78 -0.53 0.00 0.00 176.83 175.06 1snu h ASP 445 N 0.59 0.08 0.13 6.23 3.58 -1.74 -2.82 116.42 122.47 1snu h ASP 445 Ca 0.60 -0.04 -0.30 0.00 0.42 0.00 0.00 57.03 57.71 1snu h ASP 445 Cb 1.08 -0.02 0.03 0.00 1.72 0.00 0.00 39.33 42.14 1snu h ASP 445 CO -0.46 0.58 -1.27 0.22 -2.88 0.00 0.00 179.24 175.44 1snu h TYR 446 N 0.06 1.02 -0.59 0.28 3.20 0.14 -3.29 116.97 117.80 1snu h TYR 446 Ca -0.00 -0.65 -0.10 0.00 3.14 0.00 0.00 58.73 61.12 1snu h TYR 446 Cb 0.94 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.11 1snu h TYR 446 CO 0.01 1.49 -0.01 -0.07 -1.64 0.00 0.00 178.16 177.93 1snu h LEU 447 N 0.27 1.02 0.41 2.82 3.38 -0.41 -3.34 115.31 119.46 1snu h LEU 447 Ca -0.20 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.44 1snu h LEU 447 Cb 1.94 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 42.42 1snu h LEU 447 CO 0.24 1.09 -0.20 0.03 0.09 0.00 0.00 178.44 179.69 1snu h ARG 448 N 0.94 -0.53 -7.18 1.13 3.08 -1.58 -3.20 114.38 107.03 1snu h ARG 448 Ca 0.16 0.04 -0.50 0.00 0.07 0.00 0.00 59.98 59.75 1snu h ARG 448 Cb 0.57 0.12 0.08 0.00 0.08 0.00 0.00 29.97 30.82 1snu h ARG 448 CO 0.03 -0.35 0.38 -0.08 -1.07 0.00 0.00 179.97 178.88 1snu s THR 449 N -3.80 3.47 -0.07 2.04 -1.32 -1.24 -2.21 115.64 112.51 1snu s THR 449 Ca -0.08 0.72 0.00 0.00 -1.21 0.00 0.00 61.69 61.12 1snu s THR 449 Cb 0.01 -3.24 0.00 0.00 -1.51 0.00 0.00 72.50 67.76 1snu s THR 449 CO 0.24 -0.39 0.00 1.67 -2.21 0.00 0.00 174.62 173.93 1snu n GLN 450 N -2.11 -0.12 -2.29 7.08 -0.06 -1.26 -4.68 117.38 113.94 1snu n GLN 450 Ca 0.10 0.28 -0.37 0.00 -2.00 0.00 0.00 57.00 55.01 1snu n GLN 450 Cb 0.52 -3.61 -0.01 0.00 -4.06 0.00 0.00 30.24 23.08 1snu n GLN 450 CO 0.00 0.00 0.00 0.50 -0.20 0.00 0.00 177.06 177.36 1snu s ARG 451 N -1.10 3.78 0.00 3.69 3.52 -0.94 -3.01 118.95 124.89 1snu s ARG 451 Ca 0.00 1.74 0.00 0.00 -0.13 0.00 0.00 55.73 57.34 1snu s ARG 451 Cb 0.00 -2.40 0.00 0.00 -1.56 0.00 0.00 34.95 30.99 1snu s ARG 451 CO 0.00 -0.53 0.00 0.41 -0.81 0.00 0.00 175.30 174.37 1snu n GLY 452 N 0.42 2.23 0.00 8.12 0.00 -1.26 -4.79 105.19 109.90 1snu n GLY 452 Ca 0.07 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.12 1snu n GLY 452 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1snu n LEU 453 N 0.00 0.00 -4.88 0.99 4.77 -1.16 -4.82 117.00 111.90 1snu n LEU 453 Ca 0.00 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.65 1snu n LEU 453 Cb 0.00 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 1snu n LEU 453 CO 0.00 0.00 0.08 -0.36 -1.33 0.00 0.00 177.39 175.78 1snu s PHE 454 N -2.00 3.53 -0.01 -1.77 0.40 -1.26 -5.08 117.98 111.79 1snu s PHE 454 Ca 0.23 0.72 -0.05 0.00 -0.60 0.00 0.00 56.93 57.23 1snu s PHE 454 Cb 0.11 -2.12 -0.04 0.00 0.51 0.00 0.00 43.02 41.47 1snu s PHE 454 CO 0.18 0.46 0.22 0.00 0.70 0.00 0.00 175.22 176.78 1snu s ALA 455 N -1.53 3.90 0.28 5.36 0.00 -1.26 -4.96 121.76 123.55 1snu s ALA 455 Ca 0.37 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.67 1snu s ALA 455 Cb -0.13 -1.97 0.57 0.00 0.00 0.00 0.00 23.12 21.58 1snu s ALA 455 CO 0.20 0.69 1.81 0.00 0.00 0.00 0.00 175.76 178.47 1snu h ALA 456 N 3.97 1.47 -0.53 0.00 0.00 -1.98 0.80 119.26 122.98 1snu h ALA 456 Ca -0.50 0.04 0.08 0.00 0.00 0.00 0.00 54.91 54.54 1snu h ALA 456 Cb 1.19 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1snu h ALA 456 CO 0.67 0.11 0.36 0.93 0.00 0.00 0.00 179.25 181.32 1snu h GLU 457 N 0.87 0.36 -0.02 0.00 5.08 -1.94 0.59 114.58 119.52 1snu h GLU 457 Ca 0.50 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 58.66 1snu h GLU 457 Cb 0.58 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.76 1snu h GLU 457 CO -0.30 0.24 -0.69 1.15 -1.00 0.00 0.00 179.01 178.41 1snu h THR 458 N 0.37 1.38 -0.15 1.13 2.02 0.15 -2.42 112.91 115.39 1snu h THR 458 Ca 0.24 -2.08 0.00 0.00 0.77 0.00 0.00 66.41 65.34 1snu h THR 458 Cb 0.47 2.49 -0.01 0.00 -1.74 0.00 0.00 68.15 69.36 1snu h THR 458 CO -0.06 0.62 0.10 -0.07 0.37 0.00 0.00 175.52 176.47 1snu h LEU 459 N 0.05 0.17 -0.67 2.58 3.38 0.20 -1.78 115.31 119.24 1snu h LEU 459 Ca -0.08 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 57.93 1snu h LEU 459 Cb 1.38 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 42.03 1snu h LEU 459 CO 0.14 0.14 0.36 0.25 0.09 0.00 0.00 178.44 179.42 1snu h LEU 460 N 0.19 0.53 -0.82 1.67 5.85 -1.02 -0.53 115.31 121.18 1snu h LEU 460 Ca 0.05 0.03 0.19 0.00 0.84 0.00 0.00 57.88 59.00 1snu h LEU 460 Cb -0.01 -0.07 -0.12 0.00 0.37 0.00 0.00 40.66 40.84 1snu h LEU 460 CO -0.01 0.34 0.28 1.23 -0.34 0.00 0.00 178.44 179.94 1snu h GLY 461 N 0.66 1.28 1.22 3.75 0.00 -0.88 0.24 103.07 109.34 1snu h GLY 461 Ca 0.30 -0.10 -0.07 0.00 0.00 0.00 0.00 47.33 47.46 1snu h GLY 461 CO -0.19 -0.23 0.10 -0.33 0.00 0.00 0.00 176.54 175.89 1snu h MET 462 N 0.34 0.96 -0.69 4.80 2.86 -0.28 -2.50 114.93 120.42 1snu h MET 462 Ca 0.49 -0.24 -0.07 0.00 -2.06 0.00 0.00 59.70 57.82 1snu h MET 462 Cb 0.87 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.38 1snu h MET 462 CO -0.52 0.89 0.15 0.00 1.06 0.00 0.00 176.91 178.49 1snu h LEU 464 N 1.05 0.61 0.32 0.00 3.38 -1.09 0.43 115.31 120.01 1snu h LEU 464 Ca 0.21 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1snu h LEU 464 Cb 0.40 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1snu h LEU 464 CO 0.01 0.69 -0.15 0.44 0.09 0.00 0.00 178.44 179.51 1snu h ASP 465 N 0.61 -0.37 -0.17 -0.43 3.32 -1.16 0.29 116.42 118.51 1snu h ASP 465 Ca 0.12 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 1snu h ASP 465 Cb 0.40 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 1snu h ASP 465 CO 0.02 -0.23 -0.03 0.58 -1.72 0.00 0.00 179.24 177.86 1snu h VAL 466 N -0.46 1.19 -0.42 -1.35 2.07 -1.17 -2.11 116.25 114.00 1snu h VAL 466 Ca -0.04 -0.76 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 1snu h VAL 466 Cb 0.35 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1snu h VAL 466 CO 0.07 0.26 0.09 0.00 0.02 0.00 0.00 177.57 178.01 1snu h GLU 468 N 0.54 -0.15 -0.46 0.00 5.08 -0.16 0.28 114.58 119.71 1snu h GLU 468 Ca 0.13 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.55 1snu h GLU 468 Cb 0.33 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 1snu h GLU 468 CO 0.00 -0.10 0.20 0.78 -1.00 0.00 0.00 179.01 178.89 1snu h GLY 469 N -0.15 0.62 1.10 -3.84 0.00 -1.26 -1.85 103.07 97.68 1snu h GLY 469 Ca 0.02 -0.13 -0.08 0.00 0.00 0.00 0.00 47.33 47.15 1snu h GLY 469 CO -0.06 0.07 0.12 -0.33 0.00 0.00 0.00 176.54 176.34 1snu h MET 470 N 0.40 1.11 -0.42 4.80 2.86 -0.52 -1.94 114.93 121.21 1snu h MET 470 Ca 0.21 -0.29 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1snu h MET 470 Cb 0.15 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 1snu h MET 470 CO -0.17 1.00 0.25 0.00 1.06 0.00 0.00 176.91 179.05 1snu h ALA 471 N 1.08 1.66 -0.29 6.32 0.00 -0.08 0.36 119.26 128.31 1snu h ALA 471 Ca 0.21 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 1snu h ALA 471 Cb 0.42 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1snu h ALA 471 CO 0.01 0.30 -0.19 -0.92 0.00 0.00 0.00 179.25 178.46 1snu h TYR 472 N 0.58 0.75 -0.46 0.00 3.20 -0.97 -2.17 116.97 117.90 1snu h TYR 472 Ca 0.15 -0.20 -0.11 0.00 3.14 0.00 0.00 58.73 61.71 1snu h TYR 472 Cb -0.02 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.06 1snu h TYR 472 CO 0.00 0.90 -0.15 -0.07 -1.64 0.00 0.00 178.16 177.21 1snu h LEU 473 N 0.39 0.87 0.22 2.82 3.38 -0.56 -1.77 115.31 120.65 1snu h LEU 473 Ca 0.06 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.75 1snu h LEU 473 Cb 0.73 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1snu h LEU 473 CO 0.05 1.02 -0.24 -0.08 0.09 0.00 0.00 178.44 179.28 1snu h GLU 474 N 0.77 -0.49 0.00 1.13 4.81 -0.25 -0.15 114.58 120.41 1snu h GLU 474 Ca 0.12 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1snu h GLU 474 Cb 0.67 0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.16 1snu h GLU 474 CO 0.05 -0.32 -0.04 1.49 -0.73 0.00 0.00 179.01 179.46 1snu h GLU 475 N -0.51 0.00 -0.26 1.92 4.81 -1.27 0.56 114.58 119.84 1snu h GLU 475 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1snu h GLU 475 Cb 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1snu h GLU 475 CO -0.07 0.04 0.00 0.00 -0.73 0.00 0.00 179.01 178.25 1snu n ALA 476 N -2.29 2.47 -1.47 2.92 0.00 -0.20 -4.88 120.51 117.06 1snu n ALA 476 Ca -0.03 -0.48 -0.16 0.00 0.00 0.00 0.00 53.44 52.78 1snu n ALA 476 Cb 0.13 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.52 1snu n ALA 476 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1snu s VAL 478 N -2.40 5.01 -0.10 0.00 1.01 -0.43 -5.02 120.40 118.48 1snu s VAL 478 Ca 0.00 0.82 0.01 0.00 0.00 0.00 0.00 61.98 62.81 1snu s VAL 478 Cb 0.00 -3.72 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 1snu s VAL 478 CO 0.00 0.53 -0.12 -0.63 0.00 0.00 0.00 175.10 174.88 1snu s ILE 479 N -1.14 3.23 -0.76 2.22 -1.09 -1.26 -4.16 121.20 118.23 1snu s ILE 479 Ca 0.26 -0.63 -0.15 0.00 -2.23 0.00 0.00 60.65 57.91 1snu s ILE 479 Cb -0.16 -2.33 0.20 0.00 -1.58 0.00 0.00 42.46 38.58 1snu s ILE 479 CO 0.14 0.55 0.72 -2.28 -1.23 0.00 0.00 174.94 172.84 1snu s HIS 480 N -0.14 3.64 0.00 3.97 2.46 -1.26 -4.80 115.29 119.16 1snu s HIS 480 Ca -0.00 -1.82 0.00 0.00 0.47 0.00 0.00 55.06 53.70 1snu s HIS 480 Cb -0.13 -3.82 0.00 0.00 -0.13 0.00 0.00 32.58 28.49 1snu s HIS 480 CO 0.03 -1.01 1.08 0.54 -2.47 0.00 0.00 174.74 172.92 1snu n ARG 481 N 4.31 0.64 0.00 2.88 1.74 -1.26 -3.53 116.66 121.43 1snu n ARG 481 Ca 0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 1snu n ARG 481 Cb 0.45 -1.18 0.00 0.00 -1.02 0.00 0.00 32.46 30.71 1snu n ARG 481 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1snu n ASP 482 N 1.39 0.00 -4.50 0.55 2.03 -1.26 -5.07 116.55 109.69 1snu n ASP 482 Ca 0.00 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.88 1snu n ASP 482 Cb 0.32 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.68 1snu n ASP 482 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1snu s LEU 483 N 0.00 4.20 0.13 -2.67 2.96 -1.23 -4.85 118.68 117.23 1snu s LEU 483 Ca 0.00 -0.55 -0.09 0.00 -0.22 0.00 0.00 54.13 53.27 1snu s LEU 483 Cb 0.00 -2.69 -0.01 0.00 0.50 0.00 0.00 46.19 43.99 1snu s LEU 483 CO 0.00 -1.28 0.24 0.00 -1.32 0.00 0.00 176.35 173.99 1snu s ALA 484 N 3.94 -0.07 0.37 5.97 0.00 -1.26 -4.45 121.76 126.26 1snu s ALA 484 Ca 0.27 -0.79 0.12 0.00 0.00 0.00 0.00 51.96 51.56 1snu s ALA 484 Cb -0.14 0.70 0.92 0.00 0.00 0.00 0.00 23.12 24.60 1snu s ALA 484 CO 0.16 -0.58 1.83 0.00 0.00 0.00 0.00 175.76 177.17 1snu h ALA 485 N 2.64 1.96 0.00 0.00 0.00 -1.94 0.28 119.26 122.21 1snu h ALA 485 Ca -0.33 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1snu h ALA 485 Cb 1.22 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1snu h ALA 485 CO 0.52 -0.27 -0.01 0.07 0.00 0.00 0.00 179.25 179.56 1snu h ARG 486 N 0.58 0.00 -0.49 0.00 0.11 -1.95 -1.11 114.38 111.53 1snu h ARG 486 Ca 0.50 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.58 1snu h ARG 486 Cb 1.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.08 1snu h ARG 486 CO -0.25 0.01 0.00 0.09 0.10 0.00 0.00 179.97 179.93 1snu n ASN 487 N -3.59 4.54 -4.57 0.08 3.02 0.08 -4.75 115.26 110.06 1snu n ASN 487 Ca -0.03 -2.67 -0.32 0.00 -0.03 0.00 0.00 54.58 51.54 1snu n ASN 487 Cb 0.10 -0.55 -0.11 0.00 -0.61 0.00 0.00 39.78 38.61 1snu n ASN 487 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1snu s LEU 489 N -1.41 2.18 -0.13 0.00 1.43 -0.07 0.23 118.68 120.91 1snu s LEU 489 Ca 0.17 -0.43 -0.10 0.00 -1.03 0.00 0.00 54.13 52.74 1snu s LEU 489 Cb -0.11 -1.38 -0.05 0.00 0.03 0.00 0.00 46.19 44.69 1snu s LEU 489 CO 0.07 0.32 0.20 -0.69 0.23 0.00 0.00 176.35 176.48 1snu s VAL 490 N -0.64 5.39 0.00 -1.59 1.01 -0.63 -1.72 120.40 122.21 1snu s VAL 490 Ca 0.10 0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.43 1snu s VAL 490 Cb -0.10 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.78 1snu s VAL 490 CO -0.01 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1snu n GLY 491 N 2.62 5.21 2.16 4.51 0.00 0.30 -1.11 105.19 118.87 1snu n GLY 491 Ca -0.17 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.11 1snu n GLY 491 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1snu n GLU 492 N 0.00 0.00 -2.82 1.61 4.71 -1.26 -3.02 120.64 119.86 1snu n GLU 492 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 57.16 57.09 1snu n GLU 492 Cb 0.00 -0.72 0.01 0.00 -1.01 0.00 0.00 31.44 29.72 1snu n GLU 492 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1snu n ASN 493 N 2.92 -7.94 0.00 1.62 6.94 -1.26 -3.60 115.26 113.94 1snu n ASN 493 Ca 0.00 0.86 0.00 0.00 -0.02 0.00 0.00 54.58 55.42 1snu n ASN 493 Cb 0.28 -5.27 0.00 0.00 -2.36 0.00 0.00 39.78 32.43 1snu n ASN 493 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1snu n GLN 494 N 0.10 0.00 -1.69 -3.83 1.13 -1.17 -4.89 117.38 107.03 1snu n GLN 494 Ca 0.07 0.00 -0.61 0.00 -1.94 0.00 0.00 57.00 54.52 1snu n GLN 494 Cb 0.29 -1.83 -0.08 0.00 0.11 0.00 0.00 30.24 28.73 1snu n GLN 494 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1snu n VAL 495 N -0.37 0.13 -4.47 5.09 0.31 -1.24 -4.63 118.33 113.15 1snu n VAL 495 Ca 0.00 -0.02 -0.34 0.00 -0.01 0.00 0.00 64.34 63.97 1snu n VAL 495 Cb 0.00 -0.79 -0.12 0.00 -0.91 0.00 0.00 33.84 32.02 1snu n VAL 495 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1snu s ILE 496 N 2.64 3.84 0.09 2.52 -1.09 -1.26 -0.54 121.20 127.39 1snu s ILE 496 Ca 0.98 -0.39 0.07 0.00 -2.23 0.00 0.00 60.65 59.08 1snu s ILE 496 Cb -1.23 -2.65 -0.03 0.00 -1.58 0.00 0.00 42.46 36.97 1snu s ILE 496 CO 0.68 0.53 -0.17 -0.54 -1.23 0.00 0.00 174.94 174.21 1snu s LYS 497 N -0.00 0.97 -0.18 2.79 1.02 -0.70 -4.43 119.74 119.21 1snu s LYS 497 Ca 0.00 -1.08 -0.09 0.00 0.02 0.00 0.00 55.97 54.82 1snu s LYS 497 Cb -0.13 -1.07 -0.05 0.00 -0.52 0.00 0.00 37.83 36.06 1snu s LYS 497 CO 0.03 0.24 0.13 0.08 -0.92 0.00 0.00 175.35 174.91 1snu s VAL 498 N -1.34 5.42 0.00 3.17 1.01 -0.17 -0.89 120.40 127.60 1snu s VAL 498 Ca 0.03 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.20 1snu s VAL 498 Cb -0.09 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.84 1snu s VAL 498 CO 0.03 0.48 0.00 -1.54 0.00 0.00 0.00 175.10 174.07 1snu n SER 499 N 3.20 0.00 -0.98 3.32 3.41 -0.97 -3.25 113.62 118.35 1snu n SER 499 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.44 1snu n SER 499 Cb 0.53 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 1snu n SER 499 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1snu n ASP 500 N 0.00 0.00 -4.95 4.04 8.00 -1.26 -4.86 116.55 117.52 1snu n ASP 500 Ca 0.00 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.27 1snu n ASP 500 Cb 0.00 -0.50 -0.01 0.00 -0.02 0.00 0.00 41.12 40.59 1snu n ASP 500 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1snu s PHE 501 N -0.98 3.42 0.00 1.24 -0.12 -1.26 -5.01 117.98 115.28 1snu s PHE 501 Ca 0.00 0.22 0.00 0.00 -0.05 0.00 0.00 56.93 57.10 1snu s PHE 501 Cb 0.00 -1.91 0.00 0.00 -0.63 0.00 0.00 43.02 40.48 1snu s PHE 501 CO 0.00 0.10 0.00 0.41 -0.05 0.00 0.00 175.22 175.68 1snu n GLY 502 N -1.75 0.45 0.00 1.99 0.00 -1.26 -4.98 105.19 99.64 1snu n GLY 502 Ca -0.04 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1snu n GLY 502 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1snu n PRO 521 N -1.53 0.00 0.18 1.61 -0.02 -1.26 -4.94 135.00 129.04 1snu n PRO 521 Ca 0.00 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.60 1snu n PRO 521 Cb 0.34 0.00 0.62 0.00 -0.02 0.00 0.00 33.50 34.44 1snu n PRO 521 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1snu h VAL 522 N 0.00 0.00 0.00 -1.45 2.07 -1.98 -1.47 116.25 113.43 1snu h VAL 522 Ca 0.00 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 1snu h VAL 522 Cb 0.00 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1snu h VAL 522 CO 0.00 0.00 -0.35 0.11 0.02 0.00 0.00 177.57 177.35 1snu h LYS 523 N 0.00 0.00 -0.24 1.57 1.57 -1.97 -2.98 116.57 114.52 1snu h LYS 523 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1snu h LYS 523 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1snu h LYS 523 CO 0.00 0.35 0.00 0.91 -0.57 0.00 0.00 179.45 180.14 1snu n TRP 524 N -3.58 0.30 -3.29 -1.35 8.01 -0.56 -5.01 117.44 111.96 1snu n TRP 524 Ca -0.00 -0.22 -0.34 0.00 -1.31 0.00 0.00 57.50 55.63 1snu n TRP 524 Cb 0.48 -0.01 -0.06 0.00 -2.01 0.00 0.00 31.31 29.72 1snu n TRP 524 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1snu s ALA 525 N -1.21 3.49 0.69 6.99 0.00 -1.13 -3.95 121.76 126.65 1snu s ALA 525 Ca 0.26 -0.09 -0.07 0.00 0.00 0.00 0.00 51.96 52.06 1snu s ALA 525 Cb 0.16 -2.60 0.05 0.00 0.00 0.00 0.00 23.12 20.73 1snu s ALA 525 CO 0.22 0.43 1.00 -1.54 0.00 0.00 0.00 175.76 175.87 1snu s SER 526 N -2.02 4.97 0.13 0.00 1.04 -1.26 -4.86 113.70 111.69 1snu s SER 526 Ca 0.45 0.54 -0.19 0.00 0.48 0.00 0.00 55.95 57.24 1snu s SER 526 Cb -0.13 -1.25 -0.05 0.00 0.10 0.00 0.00 66.02 64.69 1snu s SER 526 CO 0.20 -1.50 1.78 -0.65 0.98 0.00 0.00 173.24 174.04 1snu h PRO 527 N -0.54 0.34 0.00 4.02 0.11 -1.94 -1.38 132.00 132.61 1snu h PRO 527 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1snu h PRO 527 Cb 1.30 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1snu h PRO 527 CO 0.61 0.23 0.00 -0.85 -0.21 0.00 0.00 178.00 177.78 1snu n GLU 528 N -4.90 0.04 -0.07 1.05 -0.00 -1.26 -1.10 120.64 114.41 1snu n GLU 528 Ca -0.02 0.50 -0.22 0.00 -0.00 0.00 0.00 57.16 57.42 1snu n GLU 528 Cb 0.03 -1.63 -0.12 0.00 -0.00 0.00 0.00 31.44 29.72 1snu n GLU 528 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1snu n VAL 529 N -1.71 1.63 -0.00 3.84 0.31 -0.62 0.33 118.33 122.11 1snu n VAL 529 Ca 0.00 -0.39 -0.01 0.00 -0.01 0.00 0.00 64.34 63.93 1snu n VAL 529 Cb 0.04 -1.83 -0.01 0.00 -0.91 0.00 0.00 33.84 31.13 1snu n VAL 529 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1snu h PHE 530 N -0.45 -0.14 0.38 3.52 0.05 -0.10 -1.54 116.94 118.66 1snu h PHE 530 Ca -0.45 0.01 -0.02 0.00 3.82 0.00 0.00 57.97 61.33 1snu h PHE 530 Cb 1.71 0.07 0.00 0.00 2.00 0.00 0.00 35.95 39.73 1snu h PHE 530 CO 0.06 -0.05 -0.18 0.77 -0.18 0.00 0.00 178.31 178.73 1snu h SER 531 N -0.05 -0.43 -0.19 2.17 0.02 -1.53 -3.39 113.55 110.15 1snu h SER 531 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1snu h SER 531 Cb 0.06 0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.71 1snu h SER 531 CO -0.04 -0.13 0.00 0.49 -1.14 0.00 0.00 176.83 176.01 1snu n PHE 532 N -4.39 0.23 -3.92 3.45 3.01 -1.14 -4.96 117.46 109.75 1snu n PHE 532 Ca -0.06 -0.12 -0.26 0.00 1.01 0.00 0.00 57.45 58.02 1snu n PHE 532 Cb 0.20 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.66 1snu n PHE 532 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1snu n SER 533 N 0.98 -0.73 -3.98 4.37 2.88 -0.58 -4.89 113.62 111.67 1snu n SER 533 Ca 0.17 -1.00 -0.34 0.00 -1.33 0.00 0.00 58.87 56.37 1snu n SER 533 Cb 0.50 -3.10 -0.07 0.00 -0.75 0.00 0.00 64.21 60.79 1snu n SER 533 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1snu n ARG 534 N -4.39 2.55 -0.69 -1.46 0.63 0.15 -4.94 116.66 108.51 1snu n ARG 534 Ca -0.29 -4.51 -0.29 0.00 -0.92 0.00 0.00 57.85 51.83 1snu n ARG 534 Cb 0.68 -2.37 0.25 0.00 0.45 0.00 0.00 32.46 31.47 1snu n ARG 534 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1snu s TYR 535 N -1.61 0.72 0.00 -0.14 1.51 -1.26 -4.48 117.35 112.09 1snu s TYR 535 Ca 0.29 0.82 0.00 0.00 -1.01 0.00 0.00 57.07 57.17 1snu s TYR 535 Cb -0.03 -3.13 0.00 0.00 -0.11 0.00 0.00 41.96 38.69 1snu s TYR 535 CO -0.11 -4.08 0.00 -1.13 -1.11 0.00 0.00 175.55 169.11 1snu n SER 536 N -5.01 0.00 0.00 2.29 3.41 -1.26 -4.92 113.62 108.13 1snu n SER 536 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 1snu n SER 536 Cb 0.58 0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.69 1snu n SER 536 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1snu n SER 537 N -1.87 0.00 -0.01 4.04 2.88 -1.26 -4.85 113.62 112.55 1snu n SER 537 Ca 0.00 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.53 1snu n SER 537 Cb 0.00 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.35 1snu n SER 537 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1snu n LYS 538 N 0.00 0.64 -0.24 -1.46 4.76 -1.26 -2.82 118.16 117.79 1snu n LYS 538 Ca 0.00 0.12 -0.08 0.00 -2.87 0.00 0.00 58.31 55.48 1snu n LYS 538 Cb 0.00 -1.70 0.04 0.00 -1.84 0.00 0.00 35.03 31.52 1snu n LYS 538 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 1snu h SER 539 N 0.00 1.06 0.44 4.39 0.02 -1.90 -1.67 113.55 115.89 1snu h SER 539 Ca -0.23 -0.26 -0.02 0.00 -0.84 0.00 0.00 61.79 60.44 1snu h SER 539 Cb 1.66 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 63.92 1snu h SER 539 CO 0.04 1.05 -0.27 0.44 -1.14 0.00 0.00 176.83 176.95 1snu h ASP 540 N 1.03 -0.66 -0.67 3.07 3.32 -1.85 -0.52 116.42 120.14 1snu h ASP 540 Ca 0.20 0.04 0.14 0.00 0.02 0.00 0.00 57.03 57.44 1snu h ASP 540 Cb 0.44 0.20 -0.11 0.00 0.22 0.00 0.00 39.33 40.08 1snu h ASP 540 CO 0.01 -0.42 0.04 0.58 -1.72 0.00 0.00 179.24 177.73 1snu h VAL 541 N -0.67 0.47 -0.28 -1.35 2.07 -1.34 0.96 116.25 116.11 1snu h VAL 541 Ca -0.05 -0.05 0.05 0.00 0.82 0.00 0.00 66.70 67.47 1snu h VAL 541 Cb 0.55 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.57 1snu h VAL 541 CO 0.05 0.03 -0.04 -0.25 0.02 0.00 0.00 177.57 177.38 1snu h TRP 542 N 0.15 -0.09 -0.38 1.57 2.91 -0.71 0.24 115.95 119.64 1snu h TRP 542 Ca 0.36 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.41 1snu h TRP 542 Cb 0.60 0.08 -0.02 0.00 -0.51 0.00 0.00 29.16 29.31 1snu h TRP 542 CO -0.35 -0.09 0.25 1.03 -1.03 0.00 0.00 178.44 178.25 1snu h SER 543 N 0.04 0.42 -0.82 2.65 0.87 0.81 -1.49 113.55 116.04 1snu h SER 543 Ca 0.13 -0.01 0.14 0.00 -1.23 0.00 0.00 61.79 60.82 1snu h SER 543 Cb 0.19 -0.10 -0.09 0.00 -0.44 0.00 0.00 62.40 61.96 1snu h SER 543 CO -0.26 0.31 0.41 0.15 -0.53 0.00 0.00 176.83 176.91 1snu h PHE 544 N 0.50 0.71 -0.76 2.24 3.57 0.22 0.42 116.94 123.86 1snu h PHE 544 Ca 0.14 0.03 0.13 0.00 3.53 0.00 0.00 57.97 61.80 1snu h PHE 544 Cb -0.05 -0.19 -0.09 0.00 2.79 0.00 0.00 35.95 38.41 1snu h PHE 544 CO -0.05 0.18 0.34 0.78 -2.23 0.00 0.00 178.31 177.32 1snu h GLY 545 N 0.60 1.17 1.27 2.40 0.00 0.47 0.53 103.07 109.51 1snu h GLY 545 Ca 0.44 -0.18 -0.20 0.00 0.00 0.00 0.00 47.33 47.38 1snu h GLY 545 CO -0.35 -0.05 -0.67 -2.08 0.00 0.00 0.00 176.54 173.39 1snu h VAL 546 N 0.52 1.29 -0.08 4.60 2.07 -0.09 -1.87 116.25 122.69 1snu h VAL 546 Ca 0.41 -1.90 0.03 0.00 0.82 0.00 0.00 66.70 66.06 1snu h VAL 546 Cb 0.57 1.86 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 1snu h VAL 546 CO -0.36 0.60 -0.12 0.25 0.02 0.00 0.00 177.57 177.96 1snu h LEU 547 N 0.53 -0.36 -0.89 2.57 6.46 0.12 0.48 115.31 124.22 1snu h LEU 547 Ca -0.02 0.07 0.21 0.00 -0.12 0.00 0.00 57.88 58.02 1snu h LEU 547 Cb 1.28 0.17 -0.12 0.00 -0.73 0.00 0.00 40.66 41.26 1snu h LEU 547 CO 0.14 -0.16 0.39 0.24 -0.62 0.00 0.00 178.44 178.42 1snu h MET 548 N -0.16 0.40 -0.60 1.25 2.86 0.12 0.28 114.93 119.08 1snu h MET 548 Ca 0.07 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1snu h MET 548 Cb 0.26 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 1snu h MET 548 CO -0.18 0.26 0.35 2.35 1.06 0.00 0.00 176.91 180.75 1snu h TRP 549 N 0.41 0.80 -0.39 -0.22 7.01 -0.20 -0.94 115.95 122.42 1snu h TRP 549 Ca 0.55 -0.01 -0.05 0.00 2.11 0.00 0.00 58.89 61.49 1snu h TRP 549 Cb 1.02 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 27.80 1snu h TRP 549 CO -0.14 0.56 0.04 0.93 -2.79 0.00 0.00 178.44 177.05 1snu h GLU 550 N 0.81 0.59 0.62 2.65 5.08 0.15 0.28 114.58 124.77 1snu h GLU 550 Ca 0.21 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 1snu h GLU 550 Cb 0.01 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.18 1snu h GLU 550 CO -0.04 0.59 -0.30 0.28 -1.00 0.00 0.00 179.01 178.54 1snu h VAL 551 N 0.57 0.19 0.00 3.13 2.07 -0.47 0.69 116.25 122.44 1snu h VAL 551 Ca 0.13 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 1snu h VAL 551 Cb 0.30 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1snu h VAL 551 CO 0.01 0.03 -0.14 -0.26 0.02 0.00 0.00 177.57 177.22 1snu h PHE 552 N -1.11 0.00 0.00 1.57 -1.00 -1.09 0.33 116.94 115.64 1snu h PHE 552 Ca -0.09 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.69 1snu h PHE 552 Cb 0.69 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.25 1snu h PHE 552 CO 0.00 0.14 -0.05 -1.13 -1.61 0.00 0.00 178.31 175.67 1snu n SER 553 N -3.87 0.08 -2.64 2.17 3.41 0.08 -4.28 113.62 108.57 1snu n SER 553 Ca -0.02 0.44 -0.11 0.00 -0.26 0.00 0.00 58.87 58.92 1snu n SER 553 Cb 0.24 -0.45 0.06 0.00 -0.26 0.00 0.00 64.21 63.80 1snu n SER 553 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1snu n GLU 554 N -1.54 -3.71 -1.76 4.33 1.02 0.12 -4.09 120.64 115.00 1snu n GLU 554 Ca 0.07 0.57 0.00 0.00 -0.02 0.00 0.00 57.16 57.78 1snu n GLU 554 Cb 0.34 -4.68 0.00 0.00 -0.02 0.00 0.00 31.44 27.09 1snu n GLU 554 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1snu n GLY 555 N -1.15 0.82 3.90 0.62 0.00 0.23 -3.72 105.19 105.89 1snu n GLY 555 Ca -0.16 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 44.93 1snu n GLY 555 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1snu s LYS 556 N -3.64 3.64 -0.46 1.61 1.02 -1.26 -4.75 119.74 115.90 1snu s LYS 556 Ca 0.00 -0.04 -0.28 0.00 0.02 0.00 0.00 55.97 55.67 1snu s LYS 556 Cb 0.00 -2.75 0.03 0.00 -0.52 0.00 0.00 37.83 34.59 1snu s LYS 556 CO 0.00 0.35 1.05 0.42 -0.92 0.00 0.00 175.35 176.24 1snu s ILE 557 N -1.86 4.34 0.17 2.17 1.01 -1.26 -4.72 121.20 121.05 1snu s ILE 557 Ca 0.43 1.09 -0.32 0.00 0.00 0.00 0.00 60.65 61.85 1snu s ILE 557 Cb -0.11 -4.52 -0.11 0.00 0.01 0.00 0.00 42.46 37.73 1snu s ILE 557 CO 0.26 -0.89 1.65 -2.16 0.00 0.00 0.00 174.94 173.80 1snu s PRO 558 N 4.10 4.18 -1.47 2.79 0.04 -1.26 -2.36 135.00 141.01 1snu s PRO 558 Ca 0.43 2.46 -0.11 0.00 0.04 0.00 0.00 61.00 63.82 1snu s PRO 558 Cb -0.09 -3.20 0.06 0.00 0.04 0.00 0.00 34.50 31.32 1snu s PRO 558 CO 0.28 -0.68 0.99 0.66 0.04 0.00 0.00 177.00 178.29 1snu n TYR 559 N 4.23 -2.37 -0.05 0.56 4.02 -1.26 -4.91 117.16 117.38 1snu n TYR 559 Ca 0.15 0.92 -0.10 0.00 -0.01 0.00 0.00 57.90 58.86 1snu n TYR 559 Cb 0.37 -4.25 -0.07 0.00 -0.02 0.00 0.00 39.34 35.37 1snu n TYR 559 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 1snu h GLU 560 N -2.18 -0.34 -4.49 -0.72 4.81 -1.89 -3.12 114.58 106.65 1snu h GLU 560 Ca -0.58 0.02 -0.70 0.00 -0.13 0.00 0.00 59.36 57.97 1snu h GLU 560 Cb 1.37 0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.78 1snu h GLU 560 CO 0.64 -0.23 2.89 0.09 -0.73 0.00 0.00 179.01 181.67 1snu n ASN 561 N -4.60 4.15 -3.56 1.04 3.02 -1.26 -4.85 115.26 109.20 1snu n ASN 561 Ca -0.03 -2.86 -0.10 0.00 -0.03 0.00 0.00 54.58 51.55 1snu n ASN 561 Cb 0.26 -1.68 -0.04 0.00 -0.61 0.00 0.00 39.78 37.70 1snu n ASN 561 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1snu s ARG 562 N 3.46 0.63 0.08 3.52 0.52 -1.18 -5.11 118.95 120.87 1snu s ARG 562 Ca 0.49 0.06 -0.04 0.00 -0.52 0.00 0.00 55.73 55.72 1snu s ARG 562 Cb 0.11 0.30 -0.05 0.00 0.52 0.00 0.00 34.95 35.83 1snu s ARG 562 CO -0.05 -0.22 0.30 0.45 0.02 0.00 0.00 175.30 175.80 1snu s SER 563 N -1.40 6.46 0.39 0.23 0.15 -1.26 -4.88 113.70 113.39 1snu s SER 563 Ca -0.00 0.49 0.09 0.00 0.70 0.00 0.00 55.95 57.23 1snu s SER 563 Cb -0.01 -2.05 0.86 0.00 -1.71 0.00 0.00 66.02 63.11 1snu s SER 563 CO -0.00 0.15 1.96 0.78 1.20 0.00 0.00 173.24 177.33 1snu h ASN 564 N 3.25 0.55 -0.23 5.45 2.35 -1.98 1.97 115.58 126.94 1snu h ASN 564 Ca -0.47 0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.24 1snu h ASN 564 Cb 1.17 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 39.40 1snu h ASN 564 CO 0.72 0.34 0.06 -1.20 -1.65 0.00 0.00 177.43 175.70 1snu n SER 565 N -4.48 2.76 0.00 5.81 7.64 -1.26 -3.15 113.62 120.93 1snu n SER 565 Ca 0.11 -2.37 0.00 0.00 1.01 0.00 0.00 58.87 57.62 1snu n SER 565 Cb 0.29 -0.58 0.00 0.00 -1.01 0.00 0.00 64.21 62.92 1snu n SER 565 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1snu n GLU 566 N 0.13 0.07 -0.14 1.43 2.13 0.38 -4.75 120.64 119.89 1snu n GLU 566 Ca 0.12 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.84 1snu n GLU 566 Cb 0.66 -0.53 -0.01 0.00 0.27 0.00 0.00 31.44 31.83 1snu n GLU 566 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1snu h VAL 567 N 0.00 1.25 -0.36 6.31 2.07 0.25 -1.53 116.25 124.23 1snu h VAL 567 Ca 0.00 -0.92 0.10 0.00 0.82 0.00 0.00 66.70 66.71 1snu h VAL 567 Cb 0.05 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1snu h VAL 567 CO 0.00 0.31 0.38 0.58 0.02 0.00 0.00 177.57 178.86 1snu h VAL 568 N 0.54 0.43 0.35 2.57 2.07 -1.76 -1.29 116.25 119.16 1snu h VAL 568 Ca 0.12 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.63 1snu h VAL 568 Cb 0.40 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1snu h VAL 568 CO 0.01 0.00 -0.17 -0.08 0.02 0.00 0.00 177.57 177.35 1snu h GLU 569 N 0.00 -0.46 -0.84 1.57 4.81 -1.58 -2.81 114.58 115.27 1snu h GLU 569 Ca 0.17 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.53 1snu h GLU 569 Cb 0.92 0.10 -0.08 0.00 0.63 0.00 0.00 28.75 30.33 1snu h GLU 569 CO -0.00 -0.30 0.48 -0.44 -0.73 0.00 0.00 179.01 178.01 1snu h ASP 570 N -1.12 0.68 0.15 1.04 3.32 -0.99 -2.38 116.42 117.12 1snu h ASP 570 Ca -0.05 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1snu h ASP 570 Cb 0.36 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1snu h ASP 570 CO 0.08 0.38 -0.07 0.40 -1.72 0.00 0.00 179.24 178.30 1snu h ILE 571 N 0.79 0.98 -0.97 0.35 2.04 -1.40 0.10 117.51 119.40 1snu h ILE 571 Ca 0.41 -0.63 0.22 0.00 1.00 0.00 0.00 64.86 65.86 1snu h ILE 571 Cb 0.40 1.36 -0.08 0.00 -0.74 0.00 0.00 36.82 37.76 1snu h ILE 571 CO -0.26 0.15 0.63 0.28 0.00 0.00 0.00 178.15 178.95 1snu h SER 572 N -0.51 0.49 1.37 1.72 0.02 -1.22 0.17 113.55 115.60 1snu h SER 572 Ca -0.02 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1snu h SER 572 Cb 0.40 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1snu h SER 572 CO 0.03 0.16 0.00 0.35 -1.14 0.00 0.00 176.83 176.24 1snu n THR 573 N -4.59 0.59 0.00 -2.27 -2.24 -0.92 -4.91 114.28 99.94 1snu n THR 573 Ca 0.22 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1snu n THR 573 Cb 0.74 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 1snu n THR 573 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1snu n GLY 574 N 1.18 1.23 3.80 3.38 0.00 0.61 -5.11 105.19 110.28 1snu n GLY 574 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1snu n GLY 574 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1snu s PHE 575 N -2.00 3.05 0.06 1.61 5.36 0.35 -4.99 117.98 121.42 1snu s PHE 575 Ca 0.00 1.54 -0.05 0.00 -0.96 0.00 0.00 56.93 57.46 1snu s PHE 575 Cb 0.00 -3.01 -0.02 0.00 -0.34 0.00 0.00 43.02 39.65 1snu s PHE 575 CO 0.00 -0.86 0.08 1.03 -1.46 0.00 0.00 175.22 174.01 1snu s ARG 576 N -3.63 0.68 0.22 10.12 3.00 -1.26 -4.28 118.95 123.80 1snu s ARG 576 Ca 0.65 -1.00 -0.32 0.00 0.00 0.00 0.00 55.73 55.06 1snu s ARG 576 Cb -0.15 0.26 -0.13 0.00 0.00 0.00 0.00 34.95 34.93 1snu s ARG 576 CO 0.27 -0.17 1.58 1.28 0.00 0.00 0.00 175.30 178.25 1snu n LEU 577 N 0.24 3.60 -4.68 2.53 4.77 -1.26 -4.92 117.00 117.28 1snu n LEU 577 Ca -0.16 1.11 -0.31 0.00 -0.03 0.00 0.00 56.01 56.62 1snu n LEU 577 Cb 0.61 -1.50 0.16 0.00 -2.33 0.00 0.00 43.42 40.36 1snu n LEU 577 CO 0.25 -0.12 0.67 -0.72 -1.33 0.00 0.00 177.39 176.14 1snu s TYR 578 N 0.54 1.80 -0.35 -1.77 -0.85 -1.26 -4.92 117.35 110.53 1snu s TYR 578 Ca 0.72 1.68 -0.29 0.00 -0.52 0.00 0.00 57.07 58.66 1snu s TYR 578 Cb -0.59 -3.26 0.02 0.00 0.38 0.00 0.00 41.96 38.51 1snu s TYR 578 CO 0.42 -2.70 1.08 0.21 -1.52 0.00 0.00 175.55 173.05 1snu s LYS 579 N -4.69 4.00 0.57 -3.49 2.20 -1.26 -5.00 119.74 112.06 1snu s LYS 579 Ca 0.66 0.98 -0.20 0.00 -0.36 0.00 0.00 55.97 57.04 1snu s LYS 579 Cb -0.22 -3.77 -0.04 0.00 -1.51 0.00 0.00 37.83 32.29 1snu s LYS 579 CO 0.58 -0.99 1.27 -1.25 -0.36 0.00 0.00 175.35 174.60 1snu s PRO 580 N 3.79 3.08 0.25 4.03 0.04 -1.26 -4.91 135.00 140.01 1snu s PRO 580 Ca 0.46 2.00 -0.04 0.00 0.04 0.00 0.00 61.00 63.46 1snu s PRO 580 Cb -0.11 -2.10 0.46 0.00 0.04 0.00 0.00 34.50 32.79 1snu s PRO 580 CO 0.18 -1.17 1.74 0.07 0.04 0.00 0.00 177.00 177.87 1snu h ARG 581 N 1.20 0.49 0.00 4.56 0.11 -1.95 -0.41 114.38 118.39 1snu h ARG 581 Ca -0.51 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 59.55 1snu h ARG 581 Cb 1.30 -0.11 0.00 0.00 1.11 0.00 0.00 29.97 32.27 1snu h ARG 581 CO 0.56 0.33 0.00 1.28 0.10 0.00 0.00 179.97 182.24 1snu n LEU 582 N -4.95 0.69 -4.67 0.08 4.77 -1.26 -4.67 117.00 106.98 1snu n LEU 582 Ca 0.15 0.67 -0.42 0.00 -0.03 0.00 0.00 56.01 56.37 1snu n LEU 582 Cb 0.40 -0.57 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 1snu n LEU 582 CO 0.20 -0.55 0.75 0.00 -1.33 0.00 0.00 177.39 176.46 1snu s ALA 583 N -3.32 3.52 0.93 -1.18 0.00 -0.17 -4.83 121.76 116.71 1snu s ALA 583 Ca 0.04 0.19 -0.12 0.00 0.00 0.00 0.00 51.96 52.08 1snu s ALA 583 Cb 0.09 -3.38 0.15 0.00 0.00 0.00 0.00 23.12 19.98 1snu s ALA 583 CO 0.41 -0.74 1.09 -1.54 0.00 0.00 0.00 175.76 174.98 1snu s SER 584 N 1.15 3.15 0.47 0.00 1.04 -1.26 -4.75 113.70 113.50 1snu s SER 584 Ca 0.43 1.50 0.17 0.00 0.48 0.00 0.00 55.95 58.53 1snu s SER 584 Cb -0.17 -2.17 1.11 0.00 0.10 0.00 0.00 66.02 64.89 1snu s SER 584 CO 0.13 -2.84 2.02 0.00 0.98 0.00 0.00 173.24 173.53 1snu h THR 585 N -1.69 1.03 -0.15 2.02 1.03 -1.96 -0.04 112.91 113.15 1snu h THR 585 Ca -0.51 -0.54 -0.15 0.00 -0.01 0.00 0.00 66.41 65.20 1snu h THR 585 Cb 1.29 1.30 -0.01 0.00 -1.07 0.00 0.00 68.15 69.66 1snu h THR 585 CO 0.54 0.15 -0.55 0.45 -0.01 0.00 0.00 175.52 176.10 1snu h HIS 586 N 0.00 0.56 -0.21 0.00 3.86 -1.90 -0.56 115.15 116.90 1snu h HIS 586 Ca -0.00 -0.20 -0.21 0.00 -1.16 0.00 0.00 60.37 58.81 1snu h HIS 586 Cb 0.29 -0.11 0.01 0.00 1.06 0.00 0.00 27.41 28.65 1snu h HIS 586 CO 0.00 0.89 -0.68 0.28 0.86 0.00 0.00 177.93 179.29 1snu h VAL 587 N 0.34 1.28 -0.84 2.45 2.07 -1.64 -3.09 116.25 116.82 1snu h VAL 587 Ca 0.01 -1.87 -0.02 0.00 0.82 0.00 0.00 66.70 65.64 1snu h VAL 587 Cb 1.07 1.83 -0.04 0.00 -1.52 0.00 0.00 31.29 32.62 1snu h VAL 587 CO 0.10 0.60 0.44 0.22 0.02 0.00 0.00 177.57 178.95 1snu h TYR 588 N 0.59 1.16 -0.92 1.57 3.20 -0.81 -2.24 116.97 119.53 1snu h TYR 588 Ca -0.02 -0.03 0.10 0.00 3.14 0.00 0.00 58.73 61.91 1snu h TYR 588 Cb 1.29 -0.37 -0.08 0.00 1.54 0.00 0.00 36.73 39.12 1snu h TYR 588 CO 0.08 0.81 0.56 1.96 -1.64 0.00 0.00 178.16 179.93 1snu h GLN 589 N 1.18 0.89 -0.05 1.82 4.20 -1.03 -1.14 115.11 120.98 1snu h GLN 589 Ca 0.29 -0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.80 1snu h GLN 589 Cb 0.05 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 1snu h GLN 589 CO -0.04 0.59 -0.62 0.82 -0.67 0.00 0.00 178.83 178.90 1snu h ILE 590 N 0.92 1.41 -0.47 2.54 2.04 -1.38 -2.28 117.51 120.28 1snu h ILE 590 Ca 0.44 -2.05 -0.11 0.00 1.00 0.00 0.00 64.86 64.14 1snu h ILE 590 Cb 0.38 2.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.51 1snu h ILE 590 CO -0.24 0.60 -0.14 0.24 0.00 0.00 0.00 178.15 178.61 1snu h MET 591 N 0.13 0.88 0.00 2.37 2.86 -0.85 -2.14 114.93 118.18 1snu h MET 591 Ca -0.01 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.31 1snu h MET 591 Cb 1.13 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.73 1snu h MET 591 CO 0.09 0.96 0.00 0.09 1.06 0.00 0.00 176.91 179.12 1snu n ASN 592 N -4.14 0.51 0.06 1.22 3.02 -0.51 -1.66 115.26 113.76 1snu n ASN 592 Ca 0.01 0.58 -0.01 0.00 -0.03 0.00 0.00 54.58 55.13 1snu n ASN 592 Cb 0.40 -0.70 -0.07 0.00 -0.61 0.00 0.00 39.78 38.80 1snu n ASN 592 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 1snu h HIS 593 N 0.00 0.00 0.00 3.10 3.86 -0.85 -3.12 115.15 118.14 1snu h HIS 593 Ca 0.00 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.06 1snu h HIS 593 Cb 0.51 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.96 1snu h HIS 593 CO 0.00 0.66 -0.74 0.00 0.86 0.00 0.00 177.93 178.72 1snu n TRP 595 N -3.25 1.24 -2.00 0.00 8.01 -0.66 -3.90 117.44 116.89 1snu n TRP 595 Ca 0.00 -0.44 -0.36 0.00 -1.31 0.00 0.00 57.50 55.39 1snu n TRP 595 Cb 0.81 -0.31 0.04 0.00 -2.01 0.00 0.00 31.31 29.84 1snu n TRP 595 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.69 176.83 1snu s LYS 596 N -2.02 2.95 0.15 -0.99 -0.14 -1.18 -4.93 119.74 113.58 1snu s LYS 596 Ca 0.35 1.84 -0.10 0.00 -1.36 0.00 0.00 55.97 56.70 1snu s LYS 596 Cb 0.25 -1.92 -0.02 0.00 -1.68 0.00 0.00 37.83 34.46 1snu s LYS 596 CO 0.12 -1.23 1.50 1.49 -0.76 0.00 0.00 175.35 176.47 1snu h GLU 597 N 0.87 0.94 -5.68 1.68 4.81 -1.93 -3.43 114.58 111.84 1snu h GLU 597 Ca -0.51 -0.47 -0.61 0.00 -0.13 0.00 0.00 59.36 57.64 1snu h GLU 597 Cb 1.30 0.01 -0.11 0.00 0.63 0.00 0.00 28.75 30.58 1snu h GLU 597 CO 0.55 1.13 0.31 1.03 -0.73 0.00 0.00 179.01 181.30 1snu s ARG 598 N -4.45 3.90 0.23 1.92 0.52 -1.26 -4.80 118.95 115.01 1snu s ARG 598 Ca -0.11 0.44 -0.17 0.00 -0.52 0.00 0.00 55.73 55.37 1snu s ARG 598 Cb 0.11 -3.74 0.25 0.00 0.52 0.00 0.00 34.95 32.09 1snu s ARG 598 CO 0.88 -0.67 1.56 -1.35 0.02 0.00 0.00 175.30 175.74 1snu h PRO 599 N 8.20 -0.03 0.00 3.54 0.11 -1.95 1.22 132.00 143.10 1snu h PRO 599 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1snu h PRO 599 Cb 1.10 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1snu h PRO 599 CO 0.86 -0.02 0.00 -0.85 -0.21 0.00 0.00 178.00 177.78 1snu n GLU 600 N -5.49 0.04 0.00 1.05 0.00 -1.26 -0.29 120.64 114.69 1snu n GLU 600 Ca 0.10 0.31 0.12 0.00 0.00 0.00 0.00 57.16 57.69 1snu n GLU 600 Cb 0.40 -1.50 0.10 0.00 0.00 0.00 0.00 31.44 30.45 1snu n GLU 600 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1snu n ASP 601 N -1.36 2.01 -4.86 -1.84 8.00 0.42 -4.91 116.55 114.01 1snu n ASP 601 Ca 0.02 -1.50 -0.35 0.00 0.71 0.00 0.00 54.79 53.67 1snu n ASP 601 Cb 0.04 0.32 -0.06 0.00 -0.02 0.00 0.00 41.12 41.40 1snu n ASP 601 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1snu s ARG 602 N -2.38 3.81 0.32 -1.24 0.52 0.61 -4.89 118.95 115.70 1snu s ARG 602 Ca 0.22 0.25 -0.28 0.00 -0.52 0.00 0.00 55.73 55.40 1snu s ARG 602 Cb 0.19 -2.99 -0.09 0.00 0.52 0.00 0.00 34.95 32.58 1snu s ARG 602 CO 0.51 0.54 1.14 -2.14 0.02 0.00 0.00 175.30 175.37 1snu s PRO 603 N -1.91 4.46 0.54 3.54 0.02 -1.26 -5.01 135.00 135.38 1snu s PRO 603 Ca 0.34 1.86 -0.17 0.00 0.02 0.00 0.00 61.00 63.05 1snu s PRO 603 Cb -0.14 -3.03 -0.06 0.00 0.02 0.00 0.00 34.50 31.29 1snu s PRO 603 CO 0.18 0.03 1.03 0.00 -0.33 0.00 0.00 177.00 177.91 1snu s ALA 604 N -1.24 2.86 0.30 -1.55 0.00 -1.26 -4.74 121.76 116.13 1snu s ALA 604 Ca 0.48 0.39 0.05 0.00 0.00 0.00 0.00 51.96 52.89 1snu s ALA 604 Cb -0.32 -3.21 0.74 0.00 0.00 0.00 0.00 23.12 20.33 1snu s ALA 604 CO 0.42 -0.52 1.76 0.74 0.00 0.00 0.00 175.76 178.16 1snu h PHE 605 N 0.87 0.99 -0.27 0.00 0.05 -1.92 0.46 116.94 117.11 1snu h PHE 605 Ca -0.48 0.04 0.05 0.00 3.82 0.00 0.00 57.97 61.40 1snu h PHE 605 Cb 1.21 -0.29 -0.01 0.00 2.00 0.00 0.00 35.95 38.86 1snu h PHE 605 CO 0.59 0.18 0.19 0.66 -0.18 0.00 0.00 178.31 179.75 1snu h SER 606 N 0.69 0.14 0.13 2.17 4.64 -1.90 0.34 113.55 119.76 1snu h SER 606 Ca 0.57 -0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.67 1snu h SER 606 Cb 0.94 -0.03 0.01 0.00 -0.31 0.00 0.00 62.40 63.00 1snu h SER 606 CO -0.41 0.10 -1.08 -0.09 -0.87 0.00 0.00 176.83 174.48 1snu h ARG 607 N 0.17 0.27 -0.88 4.77 2.43 -0.66 -3.34 114.38 117.14 1snu h ARG 607 Ca 0.12 -0.46 0.13 0.00 -0.81 0.00 0.00 59.98 58.96 1snu h ARG 607 Cb 0.27 0.17 -0.09 0.00 -0.42 0.00 0.00 29.97 29.90 1snu h ARG 607 CO -0.02 1.22 0.49 -0.07 -1.51 0.00 0.00 179.97 180.08 1snu h LEU 608 N -0.36 0.65 -0.75 3.80 3.38 0.63 -2.06 115.31 120.61 1snu h LEU 608 Ca -0.22 0.07 0.03 0.00 0.09 0.00 0.00 57.88 57.85 1snu h LEU 608 Cb 1.69 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 42.35 1snu h LEU 608 CO 0.10 0.32 0.48 0.25 0.09 0.00 0.00 178.44 179.68 1snu h LEU 609 N 0.74 0.79 -0.37 1.67 5.85 -0.48 -1.79 115.31 121.73 1snu h LEU 609 Ca 0.46 -0.01 -0.19 0.00 0.84 0.00 0.00 57.88 58.98 1snu h LEU 609 Cb 0.56 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 1snu h LEU 609 CO -0.31 0.55 -0.80 0.03 -0.34 0.00 0.00 178.44 177.56 1snu h ARG 610 N 0.94 0.26 -0.33 1.25 -0.00 -1.51 -1.61 114.38 113.38 1snu h ARG 610 Ca 0.29 -0.24 -0.13 0.00 -0.50 0.00 0.00 59.98 59.40 1snu h ARG 610 Cb -0.01 0.06 -0.01 0.00 0.00 0.00 0.00 29.97 30.01 1snu h ARG 610 CO -0.10 0.93 -0.33 1.96 0.00 0.00 0.00 179.97 182.43 1snu h GLN 611 N 0.16 0.72 0.00 0.04 4.20 -1.24 -1.74 115.11 117.24 1snu h GLN 611 Ca -0.04 -0.34 -0.13 0.00 0.06 0.00 0.00 58.65 58.21 1snu h GLN 611 Cb 1.40 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 29.15 1snu h GLN 611 CO 0.13 0.95 -0.60 -0.07 -0.67 0.00 0.00 178.83 178.56 1snu h LEU 612 N 0.61 0.00 -0.37 1.46 3.38 -1.31 -2.41 115.31 116.67 1snu h LEU 612 Ca 0.06 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1snu h LEU 612 Cb 0.86 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 1snu h LEU 612 CO 0.07 0.60 -0.18 0.00 0.09 0.00 0.00 178.44 179.02 1snu h ALA 613 N 1.40 0.52 0.01 1.53 0.00 -0.85 -1.65 119.26 120.22 1snu h ALA 613 Ca -0.01 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1snu h ALA 613 Cb 1.12 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1snu h ALA 613 CO 0.08 0.46 -0.01 0.93 0.00 0.00 0.00 179.25 180.72 1snu h GLU 614 N 0.57 -0.02 0.24 0.00 5.08 -1.27 -2.93 114.58 116.25 1snu h GLU 614 Ca 0.08 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1snu h GLU 614 Cb 0.73 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 1snu h GLU 614 CO 0.06 0.17 -0.35 0.82 -1.00 0.00 0.00 179.01 178.71 1snu h ILE 615 N -0.20 0.28 -1.18 3.13 2.04 -1.44 -2.32 117.51 117.82 1snu h ILE 615 Ca -0.00 0.00 0.37 0.00 1.00 0.00 0.00 64.86 66.22 1snu h ILE 615 Cb 0.20 0.28 -0.12 0.00 -0.74 0.00 0.00 36.82 36.43 1snu h ILE 615 CO 0.00 0.00 0.75 0.00 0.00 0.00 0.00 178.15 178.90 1snu h ALA 616 N -0.11 2.47 -1.39 1.87 0.00 -1.27 -2.86 119.26 117.96 1snu h ALA 616 Ca 0.00 0.11 -0.66 0.00 0.00 0.00 0.00 54.91 54.36 1snu h ALA 616 Cb 0.63 0.15 -0.13 0.00 0.00 0.00 0.00 17.79 18.44 1snu h ALA 616 CO -0.13 -1.03 1.39 -1.21 0.00 0.00 0.00 179.25 178.27 1snu s GLU 617 N -5.41 3.72 0.00 0.00 2.02 -0.87 -4.62 118.70 113.54 1snu s GLU 617 Ca -0.08 -1.65 0.00 0.00 0.02 0.00 0.00 54.97 53.26 1snu s GLU 617 Cb 0.28 -5.22 0.00 0.00 0.10 0.00 0.00 34.13 29.30 1snu s GLU 617 CO 0.81 -2.03 0.00 0.45 0.02 0.00 0.00 175.26 174.51 1snu n SER 618 N 7.68 0.00 0.00 -0.19 2.88 -1.20 -4.96 113.62 117.82 1snu n SER 618 Ca 0.33 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.87 1snu n SER 618 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 1snu n SER 618 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42