#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1snx s ILE 358 N 0.00 2.89 0.05 1.55 -1.09 -1.26 -3.68 121.20 119.66 1snx s ILE 358 Ca 0.00 0.69 0.07 0.00 -2.23 0.00 0.00 60.65 59.18 1snx s ILE 358 Cb 0.00 -3.36 -0.03 0.00 -1.58 0.00 0.00 42.46 37.48 1snx s ILE 358 CO 0.00 0.02 -0.16 -1.81 -1.23 0.00 0.00 174.94 171.75 1snx s ASP 359 N -1.19 3.95 0.10 3.58 1.01 0.45 -4.73 116.67 119.83 1snx s ASP 359 Ca 0.63 -0.41 0.00 0.00 0.71 0.00 0.00 52.55 53.48 1snx s ASP 359 Cb -0.32 -0.67 0.00 0.00 1.01 0.00 0.00 42.92 42.94 1snx s ASP 359 CO 0.39 0.24 0.00 -0.81 0.21 0.00 0.00 175.17 175.20 1snx n PRO 360 N 1.39 1.32 -1.85 8.23 -0.04 -1.26 -4.09 135.00 138.69 1snx n PRO 360 Ca -0.16 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.88 1snx n PRO 360 Cb 0.52 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.98 1snx n PRO 360 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1snx n SER 361 N -2.29 4.78 -0.83 3.54 2.88 -1.26 -4.28 113.62 116.15 1snx n SER 361 Ca 0.00 -2.90 0.08 0.00 -1.33 0.00 0.00 58.87 54.72 1snx n SER 361 Cb 0.00 -1.59 0.18 0.00 -0.75 0.00 0.00 64.21 62.05 1snx n SER 361 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1snx n GLU 362 N 5.14 2.52 -3.88 -1.46 1.02 -1.26 -4.98 120.64 117.73 1snx n GLU 362 Ca 0.52 -2.11 -0.37 0.00 -0.02 0.00 0.00 57.16 55.18 1snx n GLU 362 Cb 0.36 -1.36 -0.06 0.00 -0.02 0.00 0.00 31.44 30.36 1snx n GLU 362 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1snx s LEU 363 N -1.05 4.36 -0.71 -4.62 1.43 -1.25 -2.12 118.68 114.71 1snx s LEU 363 Ca 0.29 0.45 -0.08 0.00 -1.03 0.00 0.00 54.13 53.76 1snx s LEU 363 Cb 0.16 -2.07 0.19 0.00 0.03 0.00 0.00 46.19 44.50 1snx s LEU 363 CO 0.21 0.39 0.59 -0.89 0.23 0.00 0.00 176.35 176.89 1snx s THR 364 N -0.94 4.62 -0.38 5.49 2.01 0.41 -4.86 115.64 122.00 1snx s THR 364 Ca 0.15 -2.68 -0.28 0.00 0.31 0.00 0.00 61.69 59.19 1snx s THR 364 Cb -0.12 -3.93 -0.07 0.00 0.01 0.00 0.00 72.50 68.40 1snx s THR 364 CO 0.04 -0.94 2.34 0.49 -0.69 0.00 0.00 174.62 175.85 1snx n PHE 365 N 3.78 1.64 0.00 4.92 3.01 -1.26 -2.18 117.46 127.36 1snx n PHE 365 Ca 0.10 0.03 0.00 0.00 1.01 0.00 0.00 57.45 58.59 1snx n PHE 365 Cb 0.42 -2.66 0.00 0.00 -0.01 0.00 0.00 39.48 37.23 1snx n PHE 365 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1snx n VAL 366 N 7.85 0.00 -4.68 -4.37 0.31 0.20 -4.97 118.33 112.67 1snx n VAL 366 Ca 0.35 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.37 1snx n VAL 366 Cb 0.47 -0.50 -0.07 0.00 -0.91 0.00 0.00 33.84 32.83 1snx n VAL 366 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1snx s GLN 367 N 0.00 2.13 0.09 5.55 -1.52 -0.63 -4.96 119.66 120.32 1snx s GLN 367 Ca 0.00 -2.35 0.08 0.00 -1.95 0.00 0.00 55.36 51.14 1snx s GLN 367 Cb 0.00 -1.16 -0.04 0.00 -0.22 0.00 0.00 33.01 31.60 1snx s GLN 367 CO 0.00 -0.44 -0.16 -2.00 -0.25 0.00 0.00 175.29 172.43 1snx s GLU 368 N -3.81 1.95 -0.42 2.91 2.12 -1.26 0.88 118.70 121.07 1snx s GLU 368 Ca 0.10 -1.08 0.09 0.00 0.36 0.00 0.00 54.97 54.44 1snx s GLU 368 Cb 0.01 -2.18 0.34 0.00 0.26 0.00 0.00 34.13 32.56 1snx s GLU 368 CO 0.07 0.51 1.01 0.44 -0.54 0.00 0.00 175.26 176.74 1snx n ILE 369 N 1.04 -0.01 0.00 -3.70 -5.35 0.02 -4.88 119.36 106.48 1snx n ILE 369 Ca -0.15 -2.54 0.00 0.00 -0.27 0.00 0.00 62.75 59.79 1snx n ILE 369 Cb 0.52 0.87 0.00 0.00 -1.74 0.00 0.00 39.64 39.30 1snx n ILE 369 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1snx n GLY 370 N 0.24 3.67 0.00 3.28 0.00 -1.26 -4.77 105.19 106.35 1snx n GLY 370 Ca 0.11 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1snx n GLY 370 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1snx n SER 371 N 0.00 1.34 0.00 1.61 3.41 -1.26 -1.40 113.62 117.31 1snx n SER 371 Ca 0.00 -0.55 0.00 0.00 -0.26 0.00 0.00 58.87 58.06 1snx n SER 371 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1snx n SER 371 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1snx n GLY 372 N 5.00 3.31 3.40 5.00 0.00 -1.26 -4.93 105.19 115.72 1snx n GLY 372 Ca 0.00 -1.95 -0.45 0.00 0.00 0.00 0.00 46.02 43.62 1snx n GLY 372 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1snx s GLN 373 N -3.02 3.91 0.00 1.61 0.74 -1.26 -3.91 119.66 117.73 1snx s GLN 373 Ca 0.00 -2.52 0.00 0.00 0.05 0.00 0.00 55.36 52.89 1snx s GLN 373 Cb 0.00 -4.78 0.00 0.00 1.10 0.00 0.00 33.01 29.33 1snx s GLN 373 CO 0.00 -1.54 0.00 0.34 -0.55 0.00 0.00 175.29 173.54 1snx n PHE 374 N 4.80 0.00 0.00 1.67 7.35 -1.26 -4.98 117.46 125.04 1snx n PHE 374 Ca 0.26 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.95 1snx n PHE 374 Cb 0.44 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.27 1snx n PHE 374 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1snx n GLY 375 N 0.00 3.17 3.64 7.13 0.00 -1.22 -4.63 105.19 113.28 1snx n GLY 375 Ca 0.00 -0.13 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 1snx n GLY 375 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1snx s LEU 376 N 0.00 4.10 -0.02 0.99 1.43 -1.19 -4.52 118.68 119.47 1snx s LEU 376 Ca 0.00 0.38 -0.30 0.00 -1.03 0.00 0.00 54.13 53.18 1snx s LEU 376 Cb 0.00 -2.44 -0.04 0.00 0.03 0.00 0.00 46.19 43.74 1snx s LEU 376 CO 0.00 -0.11 1.26 -0.69 0.23 0.00 0.00 176.35 177.04 1snx s VAL 377 N 1.64 4.06 -0.26 -1.59 1.01 -0.50 -2.58 120.40 122.19 1snx s VAL 377 Ca 0.16 1.41 -0.00 0.00 0.00 0.00 0.00 61.98 63.55 1snx s VAL 377 Cb -0.15 -3.91 0.08 0.00 0.00 0.00 0.00 36.38 32.40 1snx s VAL 377 CO 0.08 0.01 0.02 -1.00 0.00 0.00 0.00 175.10 174.22 1snx s HIS 378 N 2.13 2.08 0.21 5.22 3.76 0.52 -0.80 115.29 128.40 1snx s HIS 378 Ca 0.59 -1.71 -0.31 0.00 -0.15 0.00 0.00 55.06 53.48 1snx s HIS 378 Cb -0.27 -1.66 -0.10 0.00 1.11 0.00 0.00 32.58 31.66 1snx s HIS 378 CO 0.24 -0.79 1.47 -1.17 -0.85 0.00 0.00 174.74 173.64 1snx s LEU 379 N 1.50 4.38 0.00 0.89 2.96 0.25 -1.29 118.68 127.37 1snx s LEU 379 Ca 0.02 2.61 0.00 0.00 -0.22 0.00 0.00 54.13 56.54 1snx s LEU 379 Cb -0.18 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.90 1snx s LEU 379 CO -0.12 -0.73 0.00 0.61 -1.32 0.00 0.00 176.35 174.79 1snx n GLY 380 N 2.80 3.84 3.16 7.98 0.00 -1.20 -0.63 105.19 121.13 1snx n GLY 380 Ca 0.09 -0.78 -0.12 0.00 0.00 0.00 0.00 46.02 45.21 1snx n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1snx s TYR 381 N -1.26 -0.35 -0.14 1.61 1.51 -0.93 -3.45 117.35 114.34 1snx s TYR 381 Ca 0.00 0.84 -0.02 0.00 -1.01 0.00 0.00 57.07 56.88 1snx s TYR 381 Cb 0.00 0.11 -0.02 0.00 -0.11 0.00 0.00 41.96 41.94 1snx s TYR 381 CO 0.00 -0.20 -0.07 -0.46 -1.11 0.00 0.00 175.55 173.71 1snx s TRP 382 N 0.58 2.95 0.00 2.71 -0.00 -1.15 0.16 118.94 124.19 1snx s TRP 382 Ca -0.03 -0.41 0.00 0.00 -0.00 0.00 0.00 56.10 55.66 1snx s TRP 382 Cb -0.05 -1.91 0.00 0.00 -0.00 0.00 0.00 33.47 31.51 1snx s TRP 382 CO -0.03 -0.09 0.00 1.28 -0.00 0.00 0.00 176.95 178.11 1snx n LEU 383 N 3.49 0.89 0.00 5.86 4.77 -0.90 -1.45 117.00 129.67 1snx n LEU 383 Ca -0.18 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1snx n LEU 383 Cb 0.53 -1.88 0.00 0.00 -2.33 0.00 0.00 43.42 39.73 1snx n LEU 383 CO 0.32 -0.70 0.00 -3.20 -1.33 0.00 0.00 177.39 172.48 1snx n ASN 384 N -0.33 0.00 0.11 -1.43 5.15 -1.26 -4.71 115.26 112.78 1snx n ASN 384 Ca 0.00 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.85 1snx n ASN 384 Cb 0.25 -0.39 -0.08 0.00 -0.53 0.00 0.00 39.78 39.03 1snx n ASN 384 CO 0.00 0.00 0.00 0.50 1.40 0.00 0.00 177.26 179.16 1snx h LYS 385 N 0.33 -0.20 -6.41 1.20 3.11 -1.62 -3.45 116.57 109.53 1snx h LYS 385 Ca 0.00 0.01 -0.66 0.00 -2.81 0.00 0.00 60.65 57.19 1snx h LYS 385 Cb 0.00 0.05 -0.15 0.00 -1.00 0.00 0.00 32.23 31.13 1snx h LYS 385 CO 0.00 -0.04 -0.70 -0.51 -2.81 0.00 0.00 179.45 175.38 1snx s ASP 386 N -5.11 4.67 -0.03 4.20 1.01 -1.08 -5.01 116.67 115.31 1snx s ASP 386 Ca -0.14 -0.25 -0.25 0.00 0.71 0.00 0.00 52.55 52.61 1snx s ASP 386 Cb 0.04 -1.02 -0.04 0.00 1.01 0.00 0.00 42.92 42.92 1snx s ASP 386 CO 0.64 0.21 0.78 -0.75 0.21 0.00 0.00 175.17 176.26 1snx s LYS 387 N -2.02 4.48 0.30 8.23 2.20 -1.26 -2.91 119.74 128.75 1snx s LYS 387 Ca 0.22 1.05 0.03 0.00 -0.36 0.00 0.00 55.97 56.91 1snx s LYS 387 Cb -0.11 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.73 1snx s LYS 387 CO 0.14 0.06 0.18 0.14 -0.36 0.00 0.00 175.35 175.51 1snx s VAL 388 N 0.75 0.21 -0.15 4.02 -7.23 -1.22 -3.34 120.40 113.44 1snx s VAL 388 Ca 0.42 -2.00 -0.00 0.00 -1.81 0.00 0.00 61.98 58.58 1snx s VAL 388 Cb -0.19 -2.50 0.03 0.00 0.56 0.00 0.00 36.38 34.28 1snx s VAL 388 CO 0.21 0.00 -0.07 0.00 -0.31 0.00 0.00 175.10 174.93 1snx s ALA 389 N -3.65 1.50 -0.27 1.32 0.00 0.26 -3.28 121.76 117.64 1snx s ALA 389 Ca 0.37 -0.76 -0.08 0.00 0.00 0.00 0.00 51.96 51.49 1snx s ALA 389 Cb 0.05 -1.05 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 1snx s ALA 389 CO 0.19 -0.61 0.10 0.42 0.00 0.00 0.00 175.76 175.85 1snx s ILE 390 N 1.63 4.36 -0.31 0.00 1.01 -0.41 -0.03 121.20 127.45 1snx s ILE 390 Ca 0.03 -0.30 -0.08 0.00 0.00 0.00 0.00 60.65 60.30 1snx s ILE 390 Cb -0.14 -3.12 0.01 0.00 0.01 0.00 0.00 42.46 39.23 1snx s ILE 390 CO -0.08 0.23 0.11 -0.75 0.00 0.00 0.00 174.94 174.44 1snx s LYS 391 N 1.60 3.02 0.74 2.79 2.20 0.29 0.20 119.74 130.57 1snx s LYS 391 Ca 0.05 -0.91 -0.06 0.00 -0.36 0.00 0.00 55.97 54.70 1snx s LYS 391 Cb -0.16 -3.45 0.10 0.00 -1.51 0.00 0.00 37.83 32.81 1snx s LYS 391 CO 0.04 -0.50 1.03 0.95 -0.36 0.00 0.00 175.35 176.52 1snx s THR 392 N 1.51 2.23 0.00 3.43 -4.23 -1.06 0.33 115.64 117.84 1snx s THR 392 Ca 0.02 -0.37 0.00 0.00 -1.18 0.00 0.00 61.69 60.16 1snx s THR 392 Cb -0.18 -2.86 0.00 0.00 1.34 0.00 0.00 72.50 70.81 1snx s THR 392 CO 0.03 0.00 0.00 -0.38 -0.54 0.00 0.00 174.62 173.73 1snx n ILE 393 N -2.98 0.00 0.00 2.99 2.08 -0.86 -3.16 119.36 117.43 1snx n ILE 393 Ca 0.11 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.42 1snx n ILE 393 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.49 1snx n ILE 393 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 1snx n ARG 394 N 0.00 0.00 0.00 0.38 5.12 -1.26 -3.49 116.66 117.41 1snx n ARG 394 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1snx n ARG 394 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1snx n ARG 394 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1snx n GLU 395 N 0.00 0.00 0.00 5.56 1.02 -1.26 -4.92 120.64 121.04 1snx n GLU 395 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1snx n GLU 395 Cb 0.00 -0.07 0.00 0.00 -0.02 0.00 0.00 31.44 31.35 1snx n GLU 395 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1snx n GLY 396 N -0.74 0.50 0.24 0.62 0.00 -1.26 -4.82 105.19 99.73 1snx n GLY 396 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1snx n GLY 396 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1snx h ALA 397 N 0.00 0.69 -2.01 4.61 0.00 -1.93 -3.44 119.26 117.18 1snx h ALA 397 Ca 0.00 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1snx h ALA 397 Cb 0.00 0.26 -0.21 0.00 0.00 0.00 0.00 17.79 17.84 1snx h ALA 397 CO 0.00 -0.36 0.14 1.41 0.00 0.00 0.00 179.25 180.44 1snx s MET 398 N -6.12 0.87 1.01 0.00 -2.45 -1.26 -5.06 119.30 106.29 1snx s MET 398 Ca -0.13 0.89 -0.16 0.00 -1.25 0.00 0.00 55.69 55.03 1snx s MET 398 Cb 0.19 0.42 -0.01 0.00 1.25 0.00 0.00 34.83 36.68 1snx s MET 398 CO 0.74 -0.13 -0.12 0.43 1.05 0.00 0.00 175.02 176.98 1snx n SER 399 N 2.43 -3.04 0.05 1.11 7.64 -1.26 -4.72 113.62 115.82 1snx n SER 399 Ca -0.15 0.16 -0.12 0.00 1.01 0.00 0.00 58.87 59.77 1snx n SER 399 Cb 0.55 -0.99 -0.09 0.00 -1.01 0.00 0.00 64.21 62.68 1snx n SER 399 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1snx h GLU 400 N -1.52 -0.17 0.68 1.43 5.08 -2.00 -2.52 114.58 115.55 1snx h GLU 400 Ca -0.46 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 57.88 1snx h GLU 400 Cb 1.32 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1snx h GLU 400 CO 0.32 0.26 -0.34 1.05 -1.00 0.00 0.00 179.01 179.30 1snx h GLU 401 N -0.69 -0.90 -0.62 2.33 4.11 -1.98 0.15 114.58 116.99 1snx h GLU 401 Ca -0.02 0.06 0.06 0.00 0.07 0.00 0.00 59.36 59.53 1snx h GLU 401 Cb 0.51 0.20 -0.07 0.00 0.50 0.00 0.00 28.75 29.89 1snx h GLU 401 CO 0.03 -0.60 -0.37 -3.47 0.07 0.00 0.00 179.01 174.68 1snx n ASP 402 N -5.50 -0.66 0.23 3.06 -0.08 -1.24 0.96 116.55 113.33 1snx n ASP 402 Ca -0.14 1.30 0.09 0.00 -1.51 0.00 0.00 54.79 54.54 1snx n ASP 402 Cb 0.38 -0.24 0.52 0.00 2.34 0.00 0.00 41.12 44.12 1snx n ASP 402 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 1snx h PHE 403 N 0.00 0.00 -0.23 -0.67 3.57 -1.39 -2.60 116.94 115.62 1snx h PHE 403 Ca 0.10 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 1snx h PHE 403 Cb 0.25 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 1snx h PHE 403 CO -0.83 0.23 0.14 0.82 -2.23 0.00 0.00 178.31 176.45 1snx h ILE 404 N 0.00 1.09 0.00 1.41 2.04 0.36 -2.87 117.51 119.53 1snx h ILE 404 Ca -0.00 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1snx h ILE 404 Cb 0.61 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 1snx h ILE 404 CO 0.03 0.08 0.00 1.21 0.00 0.00 0.00 178.15 179.47 1snx n GLU 405 N -4.90 0.00 -0.33 2.37 2.13 0.58 -1.09 120.64 119.40 1snx n GLU 405 Ca -0.03 0.43 0.23 0.00 0.66 0.00 0.00 57.16 58.45 1snx n GLU 405 Cb 0.05 -1.09 0.44 0.00 0.27 0.00 0.00 31.44 31.10 1snx n GLU 405 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1snx h GLU 406 N 0.00 0.08 -0.61 5.31 4.81 -1.65 1.06 114.58 123.58 1snx h GLU 406 Ca 0.00 -0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1snx h GLU 406 Cb 0.00 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 1snx h GLU 406 CO 0.00 0.05 0.38 0.00 -0.73 0.00 0.00 179.01 178.71 1snx h ALA 407 N 1.94 0.79 -0.77 2.92 0.00 -1.23 -1.90 119.26 121.02 1snx h ALA 407 Ca 0.71 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.66 1snx h ALA 407 Cb 1.68 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 19.23 1snx h ALA 407 CO -0.78 0.13 0.51 0.93 0.00 0.00 0.00 179.25 180.04 1snx h GLU 408 N 0.76 0.81 0.00 0.00 5.08 0.28 -2.44 114.58 119.07 1snx h GLU 408 Ca 0.24 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1snx h GLU 408 Cb 0.01 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.07 1snx h GLU 408 CO -0.09 0.53 -0.67 -0.24 -1.00 0.00 0.00 179.01 177.54 1snx h VAL 409 N 0.83 0.00 0.00 3.13 3.04 -1.17 -3.24 116.25 118.84 1snx h VAL 409 Ca 0.33 -0.96 -0.03 0.00 -1.01 0.00 0.00 66.70 65.02 1snx h VAL 409 Cb 0.24 1.62 -0.00 0.00 -2.01 0.00 0.00 31.29 31.13 1snx h VAL 409 CO -0.11 0.00 -0.16 0.24 -1.01 0.00 0.00 177.57 176.52 1snx h MET 410 N 0.00 0.00 0.00 4.17 2.86 -0.86 -2.10 114.93 119.00 1snx h MET 410 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1snx h MET 410 Cb 0.98 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.64 1snx h MET 410 CO 0.00 0.16 -0.26 -1.33 1.06 0.00 0.00 176.91 176.55 1snx n MET 411 N -3.31 0.25 -0.01 1.72 2.00 -1.13 -3.76 117.12 112.89 1snx n MET 411 Ca 0.00 0.15 -0.17 0.00 0.00 0.00 0.00 57.70 57.68 1snx n MET 411 Cb 0.41 -1.73 -0.12 0.00 0.00 0.00 0.00 33.22 31.78 1snx n MET 411 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 1snx h LYS 412 N 0.00 0.27 -6.22 0.03 1.63 -1.43 -3.45 116.57 107.40 1snx h LYS 412 Ca 0.00 -0.31 -0.56 0.00 -0.85 0.00 0.00 60.65 58.93 1snx h LYS 412 Cb 0.72 0.09 -0.05 0.00 -0.60 0.00 0.00 32.23 32.40 1snx h LYS 412 CO 0.00 1.03 0.01 -0.51 -3.45 0.00 0.00 179.45 176.53 1snx s LEU 413 N -8.36 4.49 -0.22 5.20 1.43 -1.17 -5.08 118.68 114.97 1snx s LEU 413 Ca -0.15 1.28 -0.06 0.00 -1.03 0.00 0.00 54.13 54.18 1snx s LEU 413 Cb 0.02 -2.98 0.11 0.00 0.03 0.00 0.00 46.19 43.37 1snx s LEU 413 CO 0.78 0.18 0.43 -0.94 0.23 0.00 0.00 176.35 177.04 1snx s SER 414 N -0.70 -0.26 -0.16 2.29 1.04 -1.26 -4.93 113.70 109.72 1snx s SER 414 Ca 0.31 0.88 -0.10 0.00 0.48 0.00 0.00 55.95 57.52 1snx s SER 414 Cb -0.20 1.40 0.05 0.00 0.10 0.00 0.00 66.02 67.38 1snx s SER 414 CO 0.19 -0.25 0.40 -2.28 0.98 0.00 0.00 173.24 172.29 1snx s HIS 415 N 2.63 -0.56 -0.60 5.02 5.04 -1.26 -5.01 115.29 120.54 1snx s HIS 415 Ca 0.02 1.23 0.00 0.00 -1.54 0.00 0.00 55.06 54.76 1snx s HIS 415 Cb -0.13 0.23 0.00 0.00 0.04 0.00 0.00 32.58 32.73 1snx s HIS 415 CO -0.14 -0.31 0.00 -2.30 -2.34 0.00 0.00 174.74 169.65 1snx n PRO 416 N 3.92 0.00 0.00 2.88 -0.02 -1.26 0.23 135.00 140.75 1snx n PRO 416 Ca -0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.27 1snx n PRO 416 Cb 0.56 -0.94 0.00 0.00 -0.02 0.00 0.00 33.50 33.10 1snx n PRO 416 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1snx n LYS 417 N -0.11 3.38 -4.14 -0.52 4.76 -1.26 -4.84 118.16 115.42 1snx n LYS 417 Ca 0.00 -0.09 -0.35 0.00 -2.87 0.00 0.00 58.31 55.00 1snx n LYS 417 Cb 0.00 -0.48 -0.13 0.00 -1.84 0.00 0.00 35.03 32.58 1snx n LYS 417 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1snx s LEU 418 N -1.02 3.09 -0.49 -0.35 1.43 0.61 0.61 118.68 122.56 1snx s LEU 418 Ca 0.00 -0.26 -0.45 0.00 -1.03 0.00 0.00 54.13 52.39 1snx s LEU 418 Cb 0.00 -1.77 -0.19 0.00 0.03 0.00 0.00 46.19 44.26 1snx s LEU 418 CO 0.00 0.06 1.84 0.52 0.23 0.00 0.00 176.35 179.01 1snx n VAL 419 N 4.24 0.00 -2.39 -1.59 0.31 -0.71 -4.54 118.33 113.65 1snx n VAL 419 Ca -0.18 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.74 1snx n VAL 419 Cb 0.52 -0.49 -0.04 0.00 -0.91 0.00 0.00 33.84 32.92 1snx n VAL 419 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1snx s GLN 420 N 4.43 4.51 0.04 5.55 -0.21 -1.26 -4.94 119.66 127.77 1snx s GLN 420 Ca 1.11 1.86 0.01 0.00 0.02 0.00 0.00 55.36 58.35 1snx s GLN 420 Cb -1.48 -3.24 -0.04 0.00 1.00 0.00 0.00 33.01 29.25 1snx s GLN 420 CO 0.73 -0.04 0.12 -1.17 -2.12 0.00 0.00 175.29 172.81 1snx s LEU 421 N -0.40 4.02 0.00 2.90 2.96 -1.26 -1.32 118.68 125.58 1snx s LEU 421 Ca 0.52 0.15 0.00 0.00 -0.22 0.00 0.00 54.13 54.57 1snx s LEU 421 Cb -0.32 -2.52 0.00 0.00 0.50 0.00 0.00 46.19 43.84 1snx s LEU 421 CO 0.37 0.22 0.00 -1.22 -1.32 0.00 0.00 176.35 174.40 1snx n TYR 422 N 0.74 0.00 -4.14 5.38 4.02 0.32 -4.84 117.16 118.64 1snx n TYR 422 Ca -0.10 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.65 1snx n TYR 422 Cb 0.52 -0.02 -0.05 0.00 -0.02 0.00 0.00 39.34 39.77 1snx n TYR 422 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1snx n GLY 423 N 2.08 2.86 3.14 2.72 0.00 -0.98 -4.92 105.19 110.09 1snx n GLY 423 Ca 0.00 -1.75 -0.14 0.00 0.00 0.00 0.00 46.02 44.13 1snx n GLY 423 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1snx s VAL 424 N -2.96 0.82 -0.79 1.61 1.01 -1.24 -1.55 120.40 117.30 1snx s VAL 424 Ca 0.29 -1.42 0.02 0.00 0.00 0.00 0.00 61.98 60.87 1snx s VAL 424 Cb 0.01 -1.09 0.26 0.00 0.00 0.00 0.00 36.38 35.56 1snx s VAL 424 CO 0.20 -0.47 0.96 0.00 0.00 0.00 0.00 175.10 175.80 1snx n LEU 426 N 1.14 0.17 -1.81 0.00 4.77 -1.26 -3.54 117.00 116.47 1snx n LEU 426 Ca 0.28 0.24 -0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1snx n LEU 426 Cb 0.38 -0.30 -0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1snx n LEU 426 CO 0.49 0.03 0.48 -0.62 -1.33 0.00 0.00 177.39 176.45 1snx n GLU 427 N -1.26 0.48 -1.34 3.23 -0.58 -1.26 -4.87 120.64 115.04 1snx n GLU 427 Ca 0.12 -0.03 0.16 0.00 -0.42 0.00 0.00 57.16 56.99 1snx n GLU 427 Cb 0.28 -1.31 -0.07 0.00 -0.57 0.00 0.00 31.44 29.77 1snx n GLU 427 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1snx n GLN 428 N 1.84 -2.87 0.00 3.49 1.13 -1.26 -4.96 117.38 114.75 1snx n GLN 428 Ca 0.01 2.27 0.00 0.00 -1.94 0.00 0.00 57.00 57.34 1snx n GLN 428 Cb 0.24 -3.45 0.00 0.00 0.11 0.00 0.00 30.24 27.14 1snx n GLN 428 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1snx n ALA 429 N -3.77 0.00 -2.47 -1.58 0.00 -1.26 -4.61 120.51 106.82 1snx n ALA 429 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 52.99 1snx n ALA 429 Cb 0.63 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.05 1snx n ALA 429 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1snx s PRO 430 N 0.00 3.44 -0.42 0.00 0.04 -1.26 -4.90 135.00 131.91 1snx s PRO 430 Ca 0.00 -1.07 -0.31 0.00 0.04 0.00 0.00 61.00 59.66 1snx s PRO 430 Cb 0.00 -5.33 -0.10 0.00 0.04 0.00 0.00 34.50 29.11 1snx s PRO 430 CO 0.00 -2.44 2.30 -0.89 0.04 0.00 0.00 177.00 176.01 1snx n ILE 431 N 7.02 0.14 -4.60 0.56 5.41 -1.25 -4.70 119.36 121.93 1snx n ILE 431 Ca 0.36 -0.41 -0.27 0.00 1.00 0.00 0.00 62.75 63.42 1snx n ILE 431 Cb 0.50 -2.03 -0.10 0.00 -0.71 0.00 0.00 39.64 37.30 1snx n ILE 431 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1snx s LEU 433 N -3.69 2.24 -0.28 0.00 2.96 0.98 -1.02 118.68 119.87 1snx s LEU 433 Ca 0.30 -0.56 -0.07 0.00 -0.22 0.00 0.00 54.13 53.58 1snx s LEU 433 Cb 0.08 -1.49 0.00 0.00 0.50 0.00 0.00 46.19 45.28 1snx s LEU 433 CO 0.15 0.08 0.08 -0.69 -1.32 0.00 0.00 176.35 174.64 1snx s VAL 434 N 0.85 4.03 0.41 1.68 1.01 -0.59 0.10 120.40 127.88 1snx s VAL 434 Ca -0.06 -0.58 0.08 0.00 0.00 0.00 0.00 61.98 61.42 1snx s VAL 434 Cb -0.15 -3.03 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 1snx s VAL 434 CO -0.02 0.14 0.40 -0.36 0.00 0.00 0.00 175.10 175.26 1snx s PHE 435 N 1.52 2.74 0.81 5.22 0.40 0.96 0.12 117.98 129.75 1snx s PHE 435 Ca 0.04 -0.47 -0.13 0.00 -0.60 0.00 0.00 56.93 55.76 1snx s PHE 435 Cb -0.17 -2.17 0.21 0.00 0.51 0.00 0.00 43.02 41.40 1snx s PHE 435 CO 0.02 -0.14 0.51 -0.85 0.70 0.00 0.00 175.22 175.47 1snx n GLU 436 N -1.58 -3.39 -4.06 0.44 0.28 -0.43 -0.57 120.64 111.33 1snx n GLU 436 Ca 0.04 -0.85 -0.32 0.00 -0.16 0.00 0.00 57.16 55.87 1snx n GLU 436 Cb 0.61 -1.04 -0.16 0.00 1.43 0.00 0.00 31.44 32.28 1snx n GLU 436 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 1snx s PHE 437 N -1.71 2.68 -0.36 -1.84 5.36 -1.21 -2.76 117.98 118.13 1snx s PHE 437 Ca 0.38 -1.69 -0.29 0.00 -0.96 0.00 0.00 56.93 54.37 1snx s PHE 437 Cb -0.06 -1.80 0.01 0.00 -0.34 0.00 0.00 43.02 40.84 1snx s PHE 437 CO 0.31 -0.78 1.20 -1.64 -1.46 0.00 0.00 175.22 172.85 1snx s MET 438 N 1.31 3.89 0.00 10.12 -1.94 -1.26 -4.88 119.30 126.54 1snx s MET 438 Ca 0.01 0.99 0.02 0.00 -1.71 0.00 0.00 55.69 54.99 1snx s MET 438 Cb -0.15 -3.85 0.10 0.00 2.01 0.00 0.00 34.83 32.94 1snx s MET 438 CO -0.10 -1.16 0.38 0.39 -0.01 0.00 0.00 175.02 174.53 1snx n GLU 439 N 7.37 0.12 -2.94 2.03 -0.58 -1.25 -3.91 120.64 121.47 1snx n GLU 439 Ca 0.13 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.73 1snx n GLU 439 Cb 0.47 -1.23 0.01 0.00 -0.57 0.00 0.00 31.44 30.13 1snx n GLU 439 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1snx n HIS 440 N -0.73 -1.80 0.00 -0.32 8.25 -0.89 -4.97 115.22 114.76 1snx n HIS 440 Ca 0.01 -2.70 0.00 0.00 -0.26 0.00 0.00 57.72 54.77 1snx n HIS 440 Cb 0.01 0.71 0.00 0.00 1.12 0.00 0.00 29.99 31.82 1snx n HIS 440 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1snx n GLY 441 N 1.05 0.48 3.81 -1.41 0.00 -1.25 -3.73 105.19 104.14 1snx n GLY 441 Ca 0.14 -0.48 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 1snx n GLY 441 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1snx n LEU 443 N 2.13 0.13 0.00 0.00 7.94 -1.11 -1.11 117.00 124.98 1snx n LEU 443 Ca -0.19 1.15 0.00 0.00 -1.11 0.00 0.00 56.01 55.86 1snx n LEU 443 Cb 0.54 -0.51 0.00 0.00 0.53 0.00 0.00 43.42 43.98 1snx n LEU 443 CO 0.31 -1.25 0.07 -0.24 -1.11 0.00 0.00 177.39 175.17 1snx n SER 444 N -4.69 0.00 -0.35 1.96 2.88 -1.05 -0.52 113.62 111.85 1snx n SER 444 Ca 0.23 0.15 0.10 0.00 -1.33 0.00 0.00 58.87 58.02 1snx n SER 444 Cb 0.76 0.00 0.21 0.00 -0.75 0.00 0.00 64.21 64.43 1snx n SER 444 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1snx h ASP 445 N 0.00 -0.70 -0.40 -3.46 3.32 -1.46 0.79 116.42 114.51 1snx h ASP 445 Ca 0.00 0.29 0.10 0.00 0.02 0.00 0.00 57.03 57.44 1snx h ASP 445 Cb 0.00 0.55 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 1snx h ASP 445 CO 0.00 -0.34 0.28 0.22 -1.72 0.00 0.00 179.24 177.68 1snx h TYR 446 N 0.00 0.09 0.00 4.55 3.20 -1.21 0.24 116.97 123.85 1snx h TYR 446 Ca 0.54 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 62.24 1snx h TYR 446 Cb 0.98 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 39.19 1snx h TYR 446 CO -0.63 0.04 -0.81 -0.07 -1.64 0.00 0.00 178.16 175.05 1snx h LEU 447 N 0.09 0.00 0.35 2.82 3.38 0.32 -3.35 115.31 118.92 1snx h LEU 447 Ca 0.19 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 1snx h LEU 447 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1snx h LEU 447 CO -0.02 0.81 -0.17 0.03 0.09 0.00 0.00 178.44 179.19 1snx h ARG 448 N 0.00 -0.45 0.00 1.13 3.08 -0.02 -3.37 114.38 114.75 1snx h ARG 448 Ca -0.01 0.03 -0.37 0.00 0.07 0.00 0.00 59.98 59.71 1snx h ARG 448 Cb 1.50 0.10 0.17 0.00 0.08 0.00 0.00 29.97 31.83 1snx h ARG 448 CO 0.11 -0.30 0.20 -2.37 -1.07 0.00 0.00 179.97 176.53 1snx n THR 449 N -3.67 0.00 0.00 2.04 5.66 -0.91 -3.10 114.28 114.30 1snx n THR 449 Ca -0.06 -0.58 0.00 0.00 -3.05 0.00 0.00 64.05 60.36 1snx n THR 449 Cb 0.18 -1.33 0.00 0.00 -1.55 0.00 0.00 70.33 67.64 1snx n THR 449 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 175.07 173.69 1snx n GLN 450 N -4.18 0.00 -1.00 1.09 -0.06 -1.26 -4.84 117.38 107.12 1snx n GLN 450 Ca 0.14 0.00 -0.31 0.00 -2.00 0.00 0.00 57.00 54.83 1snx n GLN 450 Cb 0.53 -3.30 0.01 0.00 -4.06 0.00 0.00 30.24 23.41 1snx n GLN 450 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 1snx n ARG 451 N -1.71 0.00 0.00 3.69 0.63 -1.18 -3.23 116.66 114.86 1snx n ARG 451 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1snx n ARG 451 Cb 0.00 -0.80 0.00 0.00 0.45 0.00 0.00 32.46 32.11 1snx n ARG 451 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1snx n GLY 452 N 1.99 2.08 0.00 5.14 0.00 -1.26 -4.72 105.19 108.42 1snx n GLY 452 Ca 0.07 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1snx n GLY 452 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1snx n LEU 453 N 0.00 0.00 -4.71 0.99 -0.00 -1.20 -4.51 117.00 107.56 1snx n LEU 453 Ca 0.00 0.01 -0.41 0.00 -0.00 0.00 0.00 56.01 55.61 1snx n LEU 453 Cb 0.00 -0.01 -0.04 0.00 -0.00 0.00 0.00 43.42 43.37 1snx n LEU 453 CO 0.00 -0.01 0.51 -0.36 -0.00 0.00 0.00 177.39 177.53 1snx s PHE 454 N -1.29 3.60 0.55 1.47 0.40 -1.26 -5.06 117.98 116.38 1snx s PHE 454 Ca 0.00 1.40 0.04 0.00 -0.60 0.00 0.00 56.93 57.77 1snx s PHE 454 Cb 0.00 -2.93 0.10 0.00 0.51 0.00 0.00 43.02 40.71 1snx s PHE 454 CO 0.00 0.03 0.75 0.00 0.70 0.00 0.00 175.22 176.71 1snx n ALA 455 N 3.91 0.58 0.00 5.36 0.00 -1.26 -5.02 120.51 124.08 1snx n ALA 455 Ca 0.02 -1.68 -0.21 0.00 0.00 0.00 0.00 53.44 51.56 1snx n ALA 455 Cb 0.51 0.37 -0.14 0.00 0.00 0.00 0.00 19.45 20.19 1snx n ALA 455 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1snx n ALA 456 N -2.69 0.87 0.24 0.00 0.00 -1.26 -3.11 120.51 114.55 1snx n ALA 456 Ca -0.13 -0.57 0.16 0.00 0.00 0.00 0.00 53.44 52.90 1snx n ALA 456 Cb 0.49 -0.68 0.84 0.00 0.00 0.00 0.00 19.45 20.10 1snx n ALA 456 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1snx h GLU 457 N 0.01 0.00 0.04 0.00 5.08 -1.97 -1.10 114.58 116.63 1snx h GLU 457 Ca -0.42 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 57.61 1snx h GLU 457 Cb 2.00 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 31.21 1snx h GLU 457 CO 0.07 0.00 -1.83 2.41 -1.00 0.00 0.00 179.01 178.67 1snx n THR 458 N -2.59 1.60 -0.29 1.13 -1.04 -1.26 -2.09 114.28 109.74 1snx n THR 458 Ca -0.02 -0.32 0.06 0.00 -2.04 0.00 0.00 64.05 61.73 1snx n THR 458 Cb 0.07 -1.86 0.28 0.00 -1.82 0.00 0.00 70.33 67.00 1snx n THR 458 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1snx h LEU 459 N -0.60 0.82 -0.82 -4.42 3.38 -1.42 1.07 115.31 113.33 1snx h LEU 459 Ca -0.46 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.46 1snx h LEU 459 Cb 1.63 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 42.21 1snx h LEU 459 CO -0.15 0.50 -0.35 0.25 0.09 0.00 0.00 178.44 178.78 1snx h LEU 460 N 0.92 0.00 -1.52 1.67 5.85 -1.34 -3.04 115.31 117.84 1snx h LEU 460 Ca 0.40 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.12 1snx h LEU 460 Cb 0.35 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1snx h LEU 460 CO -0.17 0.35 0.00 0.61 -0.34 0.00 0.00 178.44 178.89 1snx n GLY 461 N 0.38 1.72 1.61 3.75 0.00 0.37 -2.98 105.19 110.04 1snx n GLY 461 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1snx n GLY 461 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1snx n MET 462 N 0.27 0.00 -0.31 1.61 2.81 -1.05 -4.68 117.12 115.78 1snx n MET 462 Ca 0.00 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.87 1snx n MET 462 Cb 0.37 -0.20 0.04 0.00 -0.71 0.00 0.00 33.22 32.72 1snx n MET 462 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1snx h LEU 464 N -0.05 0.99 -0.18 0.00 3.38 -1.87 0.60 115.31 118.19 1snx h LEU 464 Ca 0.32 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.33 1snx h LEU 464 Cb 0.59 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 1snx h LEU 464 CO -0.88 0.68 -0.20 0.44 0.09 0.00 0.00 178.44 178.58 1snx h ASP 465 N 1.15 -0.62 0.12 -0.43 3.32 0.14 2.68 116.42 122.78 1snx h ASP 465 Ca 0.36 0.11 0.01 0.00 0.02 0.00 0.00 57.03 57.54 1snx h ASP 465 Cb 0.01 0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 1snx h ASP 465 CO -0.11 -0.24 -0.16 0.58 -1.72 0.00 0.00 179.24 177.59 1snx h VAL 466 N -0.23 0.64 0.00 -1.35 2.07 0.81 -1.08 116.25 117.11 1snx h VAL 466 Ca 0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.64 1snx h VAL 466 Cb 0.40 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1snx h VAL 466 CO -0.31 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.28 1snx n GLU 468 N -2.35 -0.22 -0.08 0.00 1.02 0.88 0.23 120.64 120.11 1snx n GLU 468 Ca 0.00 1.06 -0.05 0.00 -0.02 0.00 0.00 57.16 58.15 1snx n GLU 468 Cb 0.00 -1.57 -0.04 0.00 -0.02 0.00 0.00 31.44 29.81 1snx n GLU 468 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1snx h GLY 469 N 0.00 -1.66 2.00 0.62 0.00 0.19 -2.20 103.07 102.02 1snx h GLY 469 Ca 0.19 0.84 -0.00 0.00 0.00 0.00 0.00 47.33 48.36 1snx h GLY 469 CO -0.67 -0.51 -0.00 -0.33 0.00 0.00 0.00 176.54 175.02 1snx h MET 470 N -0.13 0.00 -0.20 4.80 2.86 0.76 -1.69 114.93 121.33 1snx h MET 470 Ca 0.04 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.49 1snx h MET 470 Cb 0.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.89 1snx h MET 470 CO -0.28 0.00 -0.64 0.00 1.06 0.00 0.00 176.91 177.06 1snx h ALA 471 N 2.00 0.49 0.37 6.32 0.00 -0.12 0.12 119.26 128.44 1snx h ALA 471 Ca -0.00 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 1snx h ALA 471 Cb 0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1snx h ALA 471 CO 0.00 0.69 -0.31 -0.92 0.00 0.00 0.00 179.25 178.71 1snx h TYR 472 N 0.53 -0.83 0.00 0.00 3.20 -1.09 0.40 116.97 119.18 1snx h TYR 472 Ca -0.01 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.79 1snx h TYR 472 Cb 1.23 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 39.81 1snx h TYR 472 CO 0.07 -0.45 -0.32 -0.07 -1.64 0.00 0.00 178.16 175.74 1snx h LEU 473 N -0.69 0.00 0.04 2.82 3.38 -1.57 2.58 115.31 121.87 1snx h LEU 473 Ca -0.03 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1snx h LEU 473 Cb 0.61 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1snx h LEU 473 CO -0.02 0.32 -0.07 -0.08 0.09 0.00 0.00 178.44 178.68 1snx h GLU 474 N 0.00 -0.14 0.00 1.13 4.81 0.00 0.26 114.58 120.64 1snx h GLU 474 Ca -0.00 0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.11 1snx h GLU 474 Cb 0.71 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.11 1snx h GLU 474 CO 0.04 -0.09 -0.62 1.49 -0.73 0.00 0.00 179.01 179.10 1snx h GLU 475 N -0.14 0.00 0.00 1.92 4.81 0.82 -2.13 114.58 119.86 1snx h GLU 475 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1snx h GLU 475 Cb 0.15 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.53 1snx h GLU 475 CO -0.04 0.62 0.00 0.00 -0.73 0.00 0.00 179.01 178.86 1snx n ALA 476 N -2.29 1.92 -3.85 2.92 0.00 0.86 -4.75 120.51 115.31 1snx n ALA 476 Ca 0.01 -0.04 -0.30 0.00 0.00 0.00 0.00 53.44 53.11 1snx n ALA 476 Cb 0.73 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 19.09 1snx n ALA 476 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1snx s VAL 478 N -3.11 -0.09 -0.53 0.00 1.01 0.80 -5.03 120.40 113.45 1snx s VAL 478 Ca 0.12 0.26 -0.16 0.00 0.00 0.00 0.00 61.98 62.19 1snx s VAL 478 Cb -0.07 -0.16 0.13 0.00 0.00 0.00 0.00 36.38 36.28 1snx s VAL 478 CO 0.89 0.11 0.49 -0.63 0.00 0.00 0.00 175.10 175.96 1snx s ILE 479 N 1.41 5.18 -0.45 2.22 -1.09 -1.26 -4.18 121.20 123.04 1snx s ILE 479 Ca -0.06 -1.48 -0.28 0.00 -2.23 0.00 0.00 60.65 56.61 1snx s ILE 479 Cb -0.12 -4.31 -0.02 0.00 -1.58 0.00 0.00 42.46 36.43 1snx s ILE 479 CO -0.04 -0.85 1.82 -2.28 -1.23 0.00 0.00 174.94 172.35 1snx s HIS 480 N 1.60 1.77 -0.09 3.97 5.65 -1.26 -4.74 115.29 122.19 1snx s HIS 480 Ca 0.03 0.72 -0.00 0.00 0.25 0.00 0.00 55.06 56.06 1snx s HIS 480 Cb -0.30 -4.11 0.06 0.00 -1.18 0.00 0.00 32.58 27.06 1snx s HIS 480 CO 0.03 -2.63 1.98 0.54 -0.65 0.00 0.00 174.74 174.01 1snx n ARG 481 N 8.71 1.22 0.00 2.88 1.74 -1.26 -4.09 116.66 125.85 1snx n ARG 481 Ca 0.22 -0.42 0.00 0.00 -0.77 0.00 0.00 57.85 56.88 1snx n ARG 481 Cb 0.49 -1.17 0.00 0.00 -1.02 0.00 0.00 32.46 30.76 1snx n ARG 481 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1snx n ASP 482 N 1.16 0.00 -4.59 0.55 2.03 -1.26 -5.12 116.55 109.33 1snx n ASP 482 Ca 0.08 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.97 1snx n ASP 482 Cb 0.52 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.90 1snx n ASP 482 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1snx s LEU 483 N 0.00 3.48 0.20 -2.67 2.96 -1.26 -4.75 118.68 116.65 1snx s LEU 483 Ca 0.00 0.50 -0.13 0.00 -0.22 0.00 0.00 54.13 54.28 1snx s LEU 483 Cb 0.00 -3.26 0.01 0.00 0.50 0.00 0.00 46.19 43.44 1snx s LEU 483 CO 0.00 -1.59 0.43 0.00 -1.32 0.00 0.00 176.35 173.87 1snx s ALA 484 N 5.80 -0.40 0.21 5.97 0.00 -1.26 -4.44 121.76 127.63 1snx s ALA 484 Ca 0.56 -0.66 -0.16 0.00 0.00 0.00 0.00 51.96 51.70 1snx s ALA 484 Cb -0.12 0.93 0.21 0.00 0.00 0.00 0.00 23.12 24.14 1snx s ALA 484 CO 0.28 -0.77 1.60 0.00 0.00 0.00 0.00 175.76 176.87 1snx h ALA 485 N 2.33 0.23 0.00 0.00 0.00 -1.92 0.21 119.26 120.11 1snx h ALA 485 Ca -0.29 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1snx h ALA 485 Cb 1.25 0.67 0.00 0.00 0.00 0.00 0.00 17.79 19.71 1snx h ALA 485 CO 0.40 -0.54 0.00 2.89 0.00 0.00 0.00 179.25 182.00 1snx n ARG 486 N -5.46 0.16 0.00 0.00 1.85 -1.26 -2.54 116.66 109.42 1snx n ARG 486 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.92 1snx n ARG 486 Cb 0.36 -1.40 0.00 0.00 -1.05 0.00 0.00 32.46 30.37 1snx n ARG 486 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1snx n ASN 487 N -0.90 4.78 -4.78 2.89 3.02 0.69 -4.94 115.26 116.02 1snx n ASN 487 Ca 0.03 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.29 1snx n ASN 487 Cb 0.01 0.53 0.12 0.00 -0.61 0.00 0.00 39.78 39.84 1snx n ASN 487 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1snx s LEU 489 N -5.97 2.43 -0.12 0.00 1.43 0.30 -2.75 118.68 114.00 1snx s LEU 489 Ca 0.62 -0.86 -0.02 0.00 -1.03 0.00 0.00 54.13 52.85 1snx s LEU 489 Cb -0.15 -0.11 -0.03 0.00 0.03 0.00 0.00 46.19 45.93 1snx s LEU 489 CO 0.55 -0.37 -0.06 -0.69 0.23 0.00 0.00 176.35 176.01 1snx s VAL 490 N -2.87 3.76 0.00 -1.59 1.01 -1.02 -1.24 120.40 118.44 1snx s VAL 490 Ca 0.05 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1snx s VAL 490 Cb 0.00 -2.60 0.00 0.00 0.00 0.00 0.00 36.38 33.78 1snx s VAL 490 CO -0.03 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.22 1snx n GLY 491 N 3.05 3.04 2.58 4.51 0.00 -0.24 -2.09 105.19 116.03 1snx n GLY 491 Ca -0.18 -0.36 -0.14 0.00 0.00 0.00 0.00 46.02 45.35 1snx n GLY 491 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1snx n GLU 492 N 0.00 1.41 -1.05 1.61 4.71 -1.26 -4.48 120.64 121.58 1snx n GLU 492 Ca 0.00 -1.02 0.00 0.00 -0.01 0.00 0.00 57.16 56.13 1snx n GLU 492 Cb 0.00 -2.17 0.00 0.00 -1.01 0.00 0.00 31.44 28.26 1snx n GLU 492 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1snx n ASN 493 N 3.92 -1.40 0.00 1.62 6.94 -1.26 -4.47 115.26 120.61 1snx n ASN 493 Ca 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.86 1snx n ASN 493 Cb 0.19 -0.70 0.00 0.00 -2.36 0.00 0.00 39.78 36.91 1snx n ASN 493 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1snx n GLN 494 N 0.17 0.00 -1.72 -3.83 1.13 -1.26 -4.84 117.38 107.03 1snx n GLN 494 Ca 0.00 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.64 1snx n GLN 494 Cb 0.00 -2.34 -0.03 0.00 0.11 0.00 0.00 30.24 27.98 1snx n GLN 494 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1snx n VAL 495 N -0.75 0.17 -4.36 5.09 0.31 -1.26 -4.82 118.33 112.71 1snx n VAL 495 Ca 0.00 -0.04 -0.33 0.00 -0.01 0.00 0.00 64.34 63.96 1snx n VAL 495 Cb 0.00 -1.93 -0.16 0.00 -0.91 0.00 0.00 33.84 30.84 1snx n VAL 495 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1snx s ILE 496 N 0.95 2.41 0.12 2.52 -1.09 -1.26 -1.08 121.20 123.76 1snx s ILE 496 Ca 0.74 -0.84 0.10 0.00 -2.23 0.00 0.00 60.65 58.42 1snx s ILE 496 Cb -0.52 -2.01 -0.04 0.00 -1.58 0.00 0.00 42.46 38.31 1snx s ILE 496 CO 0.35 0.52 -0.25 -0.54 -1.23 0.00 0.00 174.94 173.80 1snx s LYS 497 N 1.04 1.54 0.01 2.79 1.02 -0.38 -4.28 119.74 121.49 1snx s LYS 497 Ca -0.01 -1.28 -0.02 0.00 0.02 0.00 0.00 55.97 54.68 1snx s LYS 497 Cb -0.14 -1.96 -0.04 0.00 -0.52 0.00 0.00 37.83 35.16 1snx s LYS 497 CO -0.05 0.47 0.18 0.08 -0.92 0.00 0.00 175.35 175.11 1snx s VAL 498 N -1.04 5.37 0.00 3.17 1.01 0.20 0.11 120.40 129.22 1snx s VAL 498 Ca 0.15 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.88 1snx s VAL 498 Cb -0.10 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.74 1snx s VAL 498 CO 0.06 0.27 0.00 -1.54 0.00 0.00 0.00 175.10 173.89 1snx n SER 499 N 0.75 0.00 -0.43 3.32 3.41 -1.19 -1.73 113.62 117.75 1snx n SER 499 Ca -0.09 -0.74 -0.05 0.00 -0.26 0.00 0.00 58.87 57.72 1snx n SER 499 Cb 0.52 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.45 1snx n SER 499 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1snx n ASP 500 N -1.60 -5.52 -2.47 4.04 8.00 -1.26 -4.70 116.55 113.04 1snx n ASP 500 Ca 0.00 0.13 -0.06 0.00 0.71 0.00 0.00 54.79 55.57 1snx n ASP 500 Cb 0.00 -3.67 0.04 0.00 -0.02 0.00 0.00 41.12 37.47 1snx n ASP 500 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1snx n PHE 501 N -2.00 -3.86 -0.21 1.24 -0.00 -1.26 -4.96 117.46 106.41 1snx n PHE 501 Ca -0.05 -0.30 0.00 0.00 -0.00 0.00 0.00 57.45 57.10 1snx n PHE 501 Cb 0.52 -0.22 0.00 0.00 -0.00 0.00 0.00 39.48 39.78 1snx n PHE 501 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1snx n GLY 502 N 3.05 0.65 0.00 4.97 0.00 -1.26 -5.04 105.19 107.55 1snx n GLY 502 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1snx n GLY 502 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1snx n PRO 521 N -2.00 0.00 0.26 1.61 -0.02 -1.26 -4.93 135.00 128.66 1snx n PRO 521 Ca 0.00 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.58 1snx n PRO 521 Cb 0.00 0.00 0.69 0.00 -0.02 0.00 0.00 33.50 34.17 1snx n PRO 521 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1snx h VAL 522 N 0.00 0.84 -0.61 -1.45 2.07 -1.98 -2.29 116.25 112.82 1snx h VAL 522 Ca 0.00 -0.25 0.13 0.00 0.82 0.00 0.00 66.70 67.39 1snx h VAL 522 Cb 0.00 1.14 -0.11 0.00 -1.52 0.00 0.00 31.29 30.80 1snx h VAL 522 CO 0.00 0.07 -0.08 0.11 0.02 0.00 0.00 177.57 177.69 1snx h LYS 523 N 0.00 0.05 -0.00 1.57 1.57 -1.98 0.22 116.57 118.00 1snx h LYS 523 Ca -0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1snx h LYS 523 Cb 0.14 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1snx h LYS 523 CO 0.01 0.03 -0.25 0.91 -0.57 0.00 0.00 179.45 179.59 1snx n TRP 524 N -5.36 0.00 -1.34 -1.35 8.01 -0.89 -4.91 117.44 111.60 1snx n TRP 524 Ca 0.08 0.00 -0.30 0.00 -1.31 0.00 0.00 57.50 55.97 1snx n TRP 524 Cb 0.34 -0.27 0.21 0.00 -2.01 0.00 0.00 31.31 29.58 1snx n TRP 524 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1snx s ALA 525 N -2.79 1.15 0.32 6.99 0.00 0.76 -2.58 121.76 125.61 1snx s ALA 525 Ca 0.18 -0.90 0.10 0.00 0.00 0.00 0.00 51.96 51.34 1snx s ALA 525 Cb 0.19 -2.90 -0.06 0.00 0.00 0.00 0.00 23.12 20.35 1snx s ALA 525 CO 0.57 -3.10 -0.09 -1.54 0.00 0.00 0.00 175.76 171.60 1snx s SER 526 N -4.10 3.86 0.35 0.00 1.04 -1.26 -4.71 113.70 108.87 1snx s SER 526 Ca 0.70 -1.05 0.15 0.00 0.48 0.00 0.00 55.95 56.23 1snx s SER 526 Cb -0.10 -0.42 1.14 0.00 0.10 0.00 0.00 66.02 66.74 1snx s SER 526 CO 0.55 -0.12 1.60 -0.65 0.98 0.00 0.00 173.24 175.61 1snx h PRO 527 N 2.04 0.10 -1.00 4.02 0.11 -1.94 0.17 132.00 135.49 1snx h PRO 527 Ca -0.42 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.54 1snx h PRO 527 Cb 1.25 -0.02 -0.09 0.00 0.11 0.00 0.00 31.00 32.25 1snx h PRO 527 CO 0.65 0.06 0.19 0.39 -0.21 0.00 0.00 178.00 179.09 1snx n GLU 528 N -5.24 1.37 0.00 1.05 4.71 -1.26 -3.28 120.64 117.99 1snx n GLU 528 Ca 0.33 -0.88 0.00 0.00 -0.01 0.00 0.00 57.16 56.60 1snx n GLU 528 Cb 1.08 -1.35 0.00 0.00 -1.01 0.00 0.00 31.44 30.16 1snx n GLU 528 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1snx n VAL 529 N 0.02 0.00 -0.00 2.62 0.31 0.58 0.79 118.33 122.64 1snx n VAL 529 Ca 0.17 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.50 1snx n VAL 529 Cb 0.84 0.21 -0.00 0.00 -0.91 0.00 0.00 33.84 33.97 1snx n VAL 529 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1snx h PHE 530 N 0.00 -0.05 -0.43 3.52 0.05 -1.53 -3.14 116.94 115.36 1snx h PHE 530 Ca 0.00 -0.00 -0.13 0.00 3.82 0.00 0.00 57.97 61.66 1snx h PHE 530 Cb 0.01 0.02 -0.01 0.00 2.00 0.00 0.00 35.95 37.97 1snx h PHE 530 CO 0.00 -0.03 -0.23 0.66 -0.18 0.00 0.00 178.31 178.53 1snx h SER 531 N -0.56 0.95 0.00 2.17 4.64 -1.88 -3.41 113.55 115.47 1snx h SER 531 Ca -0.01 -0.41 -0.17 0.00 -0.47 0.00 0.00 61.79 60.73 1snx h SER 531 Cb 0.04 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 61.84 1snx h SER 531 CO 0.01 1.15 -1.61 0.49 -0.87 0.00 0.00 176.83 175.99 1snx n PHE 532 N -4.16 0.00 -1.99 4.77 3.01 -1.26 -5.03 117.46 112.80 1snx n PHE 532 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1snx n PHE 532 Cb 0.46 -0.41 0.00 0.00 -0.01 0.00 0.00 39.48 39.52 1snx n PHE 532 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1snx n SER 533 N -3.13 -1.99 -3.07 4.37 7.64 -1.11 -4.93 113.62 111.40 1snx n SER 533 Ca -0.20 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.34 1snx n SER 533 Cb 0.68 -0.50 -0.00 0.00 -1.01 0.00 0.00 64.21 63.38 1snx n SER 533 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1snx n ARG 534 N -0.99 3.89 -0.77 1.43 0.63 0.24 -4.94 116.66 116.14 1snx n ARG 534 Ca 0.00 -4.52 -0.33 0.00 -0.92 0.00 0.00 57.85 52.07 1snx n ARG 534 Cb 0.50 -2.32 0.13 0.00 0.45 0.00 0.00 32.46 31.22 1snx n ARG 534 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1snx n TYR 535 N -0.28 -1.71 -2.46 -0.14 4.02 -1.26 -4.83 117.16 110.51 1snx n TYR 535 Ca 0.41 0.20 -0.01 0.00 -0.01 0.00 0.00 57.90 58.49 1snx n TYR 535 Cb 0.37 -1.64 0.03 0.00 -0.02 0.00 0.00 39.34 38.09 1snx n TYR 535 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1snx n SER 536 N -0.84 -0.43 0.00 7.72 3.41 -1.26 -4.89 113.62 117.34 1snx n SER 536 Ca 0.03 -1.29 0.00 0.00 -0.26 0.00 0.00 58.87 57.35 1snx n SER 536 Cb 0.59 0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 1snx n SER 536 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1snx n SER 537 N -0.42 0.00 0.09 4.04 2.88 -1.26 -3.94 113.62 115.01 1snx n SER 537 Ca -0.06 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.60 1snx n SER 537 Cb 0.59 0.00 0.18 0.00 -0.75 0.00 0.00 64.21 64.23 1snx n SER 537 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1snx h LYS 538 N 0.00 0.00 -0.29 -1.46 1.79 -1.93 -2.68 116.57 111.99 1snx h LYS 538 Ca 0.00 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.39 1snx h LYS 538 Cb 0.00 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.63 1snx h LYS 538 CO 0.00 0.00 -0.16 0.66 -1.08 0.00 0.00 179.45 178.87 1snx h SER 539 N 0.00 0.51 0.03 0.86 4.64 -1.91 -2.94 113.55 114.74 1snx h SER 539 Ca 0.00 -0.14 -0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1snx h SER 539 Cb 0.81 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1snx h SER 539 CO 0.00 0.69 -0.02 0.44 -0.87 0.00 0.00 176.83 177.07 1snx h ASP 540 N 0.47 -0.04 -1.06 4.97 3.32 -1.86 -3.25 116.42 118.97 1snx h ASP 540 Ca 0.08 -0.67 0.31 0.00 0.02 0.00 0.00 57.03 56.78 1snx h ASP 540 Cb 0.55 0.01 -0.05 0.00 0.22 0.00 0.00 39.33 40.06 1snx h ASP 540 CO 0.04 0.70 0.75 0.52 -1.72 0.00 0.00 179.24 179.53 1snx n VAL 541 N -4.75 -0.02 -0.05 -1.35 0.31 -1.02 0.38 118.33 111.83 1snx n VAL 541 Ca -0.09 0.86 -0.07 0.00 -0.01 0.00 0.00 64.34 65.03 1snx n VAL 541 Cb 0.34 -1.43 -0.06 0.00 -0.91 0.00 0.00 33.84 31.79 1snx n VAL 541 CO 0.00 0.00 0.00 -0.25 -1.32 0.00 0.00 176.83 175.26 1snx h TRP 542 N 0.00 -0.01 -0.28 3.52 2.91 -1.59 -2.85 115.95 117.65 1snx h TRP 542 Ca 0.52 -0.00 0.08 0.00 1.13 0.00 0.00 58.89 60.62 1snx h TRP 542 Cb 2.04 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 30.68 1snx h TRP 542 CO -0.00 0.46 0.36 0.77 -1.03 0.00 0.00 178.44 179.01 1snx h SER 543 N -1.00 0.00 1.12 2.65 0.02 0.73 2.82 113.55 119.90 1snx h SER 543 Ca -0.00 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 1snx h SER 543 Cb 0.48 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 1snx h SER 543 CO 0.00 0.00 -0.38 0.15 -1.14 0.00 0.00 176.83 175.47 1snx h PHE 544 N 0.00 0.00 0.23 3.45 3.57 0.53 -2.26 116.94 122.46 1snx h PHE 544 Ca 0.13 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 1snx h PHE 544 Cb 0.86 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.60 1snx h PHE 544 CO 0.00 0.38 -0.11 0.78 -2.23 0.00 0.00 178.31 177.13 1snx h GLY 545 N 2.62 -0.32 -0.32 2.40 0.00 0.52 -1.80 103.07 106.17 1snx h GLY 545 Ca -0.00 0.12 0.15 0.00 0.00 0.00 0.00 47.33 47.60 1snx h GLY 545 CO 0.05 -0.12 -0.06 -2.08 0.00 0.00 0.00 176.54 174.33 1snx h VAL 546 N -1.06 0.35 0.08 4.60 2.07 -1.21 0.41 116.25 121.49 1snx h VAL 546 Ca -0.03 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.47 1snx h VAL 546 Cb 0.24 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 1snx h VAL 546 CO 0.05 0.01 -0.31 0.25 0.02 0.00 0.00 177.57 177.59 1snx h LEU 547 N 0.06 -0.93 -0.75 2.57 6.46 -1.48 -0.96 115.31 120.29 1snx h LEU 547 Ca 0.37 0.10 0.11 0.00 -0.12 0.00 0.00 57.88 58.34 1snx h LEU 547 Cb 0.61 0.34 -0.12 0.00 -0.73 0.00 0.00 40.66 40.76 1snx h LEU 547 CO -0.66 -0.33 -0.30 0.23 -0.62 0.00 0.00 178.44 176.76 1snx n MET 548 N -4.20 -0.18 -0.01 1.25 2.81 0.10 0.30 117.12 117.18 1snx n MET 548 Ca -0.05 1.15 -0.00 0.00 -1.81 0.00 0.00 57.70 56.99 1snx n MET 548 Cb 0.24 -1.71 -0.00 0.00 -0.71 0.00 0.00 33.22 31.04 1snx n MET 548 CO 0.00 0.00 0.00 2.35 1.51 0.00 0.00 175.97 179.83 1snx h TRP 549 N 0.00 -0.07 -0.90 2.03 7.01 0.86 0.99 115.95 125.86 1snx h TRP 549 Ca 0.26 0.00 0.10 0.00 2.11 0.00 0.00 58.89 61.36 1snx h TRP 549 Cb 0.44 0.03 -0.12 0.00 -2.10 0.00 0.00 29.16 27.41 1snx h TRP 549 CO -0.66 -0.01 -0.46 0.39 -2.79 0.00 0.00 178.44 174.90 1snx n GLU 550 N -3.01 -0.32 -0.12 2.65 1.02 0.86 0.18 120.64 121.89 1snx n GLU 550 Ca 0.00 1.37 -0.03 0.00 -0.02 0.00 0.00 57.16 58.48 1snx n GLU 550 Cb 0.01 -2.03 -0.03 0.00 -0.02 0.00 0.00 31.44 29.38 1snx n GLU 550 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1snx n VAL 551 N -5.21 -0.19 0.13 2.62 0.31 0.24 -1.47 118.33 114.76 1snx n VAL 551 Ca 0.05 1.44 -0.13 0.00 -0.01 0.00 0.00 64.34 65.69 1snx n VAL 551 Cb 0.28 -1.85 -0.06 0.00 -0.91 0.00 0.00 33.84 31.30 1snx n VAL 551 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1snx h PHE 552 N 0.00 -0.52 0.00 3.52 -1.00 0.78 -2.50 116.94 117.22 1snx h PHE 552 Ca 0.04 0.01 -0.33 0.00 2.81 0.00 0.00 57.97 60.50 1snx h PHE 552 Cb 0.11 0.21 -0.02 0.00 3.61 0.00 0.00 35.95 39.86 1snx h PHE 552 CO -0.77 -0.29 1.34 -1.13 -1.61 0.00 0.00 178.31 175.85 1snx n SER 553 N -5.32 5.66 -1.95 2.17 3.41 -0.13 -4.70 113.62 112.76 1snx n SER 553 Ca -0.07 -2.39 0.00 0.00 -0.26 0.00 0.00 58.87 56.15 1snx n SER 553 Cb 0.24 -1.27 0.00 0.00 -0.26 0.00 0.00 64.21 62.91 1snx n SER 553 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1snx n GLU 554 N 3.12 -0.62 -2.00 4.33 1.02 -0.94 -0.82 120.64 124.73 1snx n GLU 554 Ca 0.49 -0.20 -0.01 0.00 -0.02 0.00 0.00 57.16 57.41 1snx n GLU 554 Cb 0.52 0.36 0.01 0.00 -0.02 0.00 0.00 31.44 32.30 1snx n GLU 554 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1snx n GLY 555 N -0.57 0.47 3.49 0.62 0.00 -0.54 -4.17 105.19 104.49 1snx n GLY 555 Ca 0.00 -0.37 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 1snx n GLY 555 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1snx s LYS 556 N -3.85 2.32 -0.07 1.61 1.02 -0.01 -4.68 119.74 116.08 1snx s LYS 556 Ca 0.01 -0.83 -0.30 0.00 0.02 0.00 0.00 55.97 54.88 1snx s LYS 556 Cb -0.00 -2.31 -0.04 0.00 -0.52 0.00 0.00 37.83 34.95 1snx s LYS 556 CO 0.06 0.58 1.46 0.42 -0.92 0.00 0.00 175.35 176.96 1snx s ILE 557 N -0.86 3.83 0.27 2.17 1.01 -1.26 -4.65 121.20 121.70 1snx s ILE 557 Ca 0.14 1.07 -0.29 0.00 0.00 0.00 0.00 60.65 61.57 1snx s ILE 557 Cb -0.11 -3.69 -0.09 0.00 0.01 0.00 0.00 42.46 38.58 1snx s ILE 557 CO 0.04 -0.07 0.94 -2.16 0.00 0.00 0.00 174.94 173.69 1snx s PRO 558 N 3.40 4.76 -0.77 2.79 0.04 -1.26 -3.94 135.00 140.02 1snx s PRO 558 Ca 0.65 1.43 -0.04 0.00 0.04 0.00 0.00 61.00 63.08 1snx s PRO 558 Cb -0.29 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.14 1snx s PRO 558 CO 0.24 0.44 0.46 0.66 0.04 0.00 0.00 177.00 178.84 1snx n TYR 559 N 1.17 -1.26 0.00 0.56 4.02 -1.26 -5.01 117.16 115.38 1snx n TYR 559 Ca -0.01 0.40 0.00 0.00 -0.01 0.00 0.00 57.90 58.28 1snx n TYR 559 Cb 0.48 -2.98 0.00 0.00 -0.02 0.00 0.00 39.34 36.82 1snx n TYR 559 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 1snx n GLU 560 N -2.66 0.00 -0.33 -0.72 2.13 -1.25 -3.45 120.64 114.36 1snx n GLU 560 Ca -0.03 0.28 -0.05 0.00 0.66 0.00 0.00 57.16 58.02 1snx n GLU 560 Cb 0.55 -1.19 -0.05 0.00 0.27 0.00 0.00 31.44 31.02 1snx n GLU 560 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1snx n ASN 561 N -1.33 1.85 -3.72 4.31 3.02 -1.26 -4.62 115.26 113.51 1snx n ASN 561 Ca 0.00 -1.87 -0.13 0.00 -0.03 0.00 0.00 54.58 52.54 1snx n ASN 561 Cb 0.00 -0.51 -0.10 0.00 -0.61 0.00 0.00 39.78 38.56 1snx n ASN 561 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1snx s ARG 562 N 2.66 0.52 0.08 3.52 0.52 -1.22 -5.09 118.95 119.93 1snx s ARG 562 Ca 0.21 0.60 -0.23 0.00 -0.52 0.00 0.00 55.73 55.79 1snx s ARG 562 Cb 0.09 0.25 -0.06 0.00 0.52 0.00 0.00 34.95 35.75 1snx s ARG 562 CO -0.00 -0.07 0.70 0.45 0.02 0.00 0.00 175.30 176.40 1snx s SER 563 N 0.20 7.19 0.24 0.23 0.15 -1.26 -4.79 113.70 115.67 1snx s SER 563 Ca -0.00 1.42 -0.08 0.00 0.70 0.00 0.00 55.95 57.99 1snx s SER 563 Cb -0.03 -2.44 0.41 0.00 -1.71 0.00 0.00 66.02 62.25 1snx s SER 563 CO 0.01 0.14 1.62 0.78 1.20 0.00 0.00 173.24 176.99 1snx h ASN 564 N 5.03 -0.46 0.00 5.45 2.35 -1.96 3.13 115.58 129.12 1snx h ASN 564 Ca -0.46 0.21 -0.16 0.00 -0.55 0.00 0.00 56.30 55.34 1snx h ASN 564 Cb 1.21 0.39 -0.06 0.00 0.05 0.00 0.00 38.32 39.91 1snx h ASN 564 CO 0.68 -0.21 -0.25 -1.20 -1.65 0.00 0.00 177.43 174.80 1snx n SER 565 N -5.40 4.48 0.10 5.81 7.64 -1.26 -2.29 113.62 122.71 1snx n SER 565 Ca 0.13 -2.33 0.00 0.00 1.01 0.00 0.00 58.87 57.68 1snx n SER 565 Cb 0.46 -1.20 0.00 0.00 -1.01 0.00 0.00 64.21 62.46 1snx n SER 565 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1snx n GLU 566 N 2.53 0.00 -0.24 1.43 2.13 0.35 -4.93 120.64 121.90 1snx n GLU 566 Ca 0.35 0.00 0.02 0.00 0.66 0.00 0.00 57.16 58.19 1snx n GLU 566 Cb 0.77 0.00 0.06 0.00 0.27 0.00 0.00 31.44 32.54 1snx n GLU 566 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1snx n VAL 567 N -3.00 -0.31 0.05 6.31 0.31 0.96 0.16 118.33 122.81 1snx n VAL 567 Ca 0.00 1.51 -0.09 0.00 -0.01 0.00 0.00 64.34 65.75 1snx n VAL 567 Cb 0.00 -2.05 -0.05 0.00 -0.91 0.00 0.00 33.84 30.83 1snx n VAL 567 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1snx h VAL 568 N 0.00 0.00 -0.19 2.52 2.07 -1.74 -2.40 116.25 116.52 1snx h VAL 568 Ca 0.27 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.81 1snx h VAL 568 Cb 0.43 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.18 1snx h VAL 568 CO -0.66 0.00 -0.13 -0.08 0.02 0.00 0.00 177.57 176.72 1snx h GLU 569 N -0.39 -0.02 -0.61 1.57 4.81 -0.59 1.69 114.58 121.04 1snx h GLU 569 Ca 0.00 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.34 1snx h GLU 569 Cb 0.41 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 29.68 1snx h GLU 569 CO -0.18 -0.01 -0.21 -0.25 -0.73 0.00 0.00 179.01 177.64 1snx n ASP 570 N -3.45 -0.33 0.11 1.04 8.00 -0.91 0.27 116.55 121.28 1snx n ASP 570 Ca 0.00 1.06 -0.01 0.00 0.71 0.00 0.00 54.79 56.55 1snx n ASP 570 Cb 0.06 -0.27 0.00 0.00 -0.02 0.00 0.00 41.12 40.89 1snx n ASP 570 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1snx h ILE 571 N 0.00 1.26 -0.41 0.53 2.04 -0.42 0.13 117.51 120.64 1snx h ILE 571 Ca 0.25 -2.65 -0.01 0.00 1.00 0.00 0.00 64.86 63.44 1snx h ILE 571 Cb 0.40 2.54 -0.02 0.00 -0.74 0.00 0.00 36.82 39.00 1snx h ILE 571 CO -0.62 0.69 0.22 0.28 0.00 0.00 0.00 178.15 178.72 1snx h SER 572 N 0.00 0.53 0.44 1.72 0.02 1.60 -2.63 113.55 115.22 1snx h SER 572 Ca -0.01 -0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 60.82 1snx h SER 572 Cb 1.48 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 63.89 1snx h SER 572 CO 0.09 0.48 -0.24 0.71 -1.14 0.00 0.00 176.83 176.73 1snx h THR 573 N 0.53 0.51 0.00 -2.27 1.35 -0.49 -3.46 112.91 109.08 1snx h THR 573 Ca 0.14 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.00 1snx h THR 573 Cb 0.07 0.51 0.00 0.00 -1.73 0.00 0.00 68.15 67.00 1snx h THR 573 CO -0.02 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.86 1snx n GLY 574 N -1.37 0.00 3.58 5.82 0.00 -0.99 -5.13 105.19 107.10 1snx n GLY 574 Ca -0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 1snx n GLY 574 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1snx s PHE 575 N 0.00 3.04 0.35 1.61 5.36 0.43 -4.95 117.98 123.82 1snx s PHE 575 Ca 0.00 0.49 0.07 0.00 -0.96 0.00 0.00 56.93 56.53 1snx s PHE 575 Cb 0.00 -3.63 -0.01 0.00 -0.34 0.00 0.00 43.02 39.05 1snx s PHE 575 CO 0.00 -0.88 0.49 1.03 -1.46 0.00 0.00 175.22 174.40 1snx s ARG 576 N 3.36 3.06 0.31 10.12 3.00 -1.26 -4.08 118.95 133.46 1snx s ARG 576 Ca 0.34 -1.06 -0.29 0.00 0.00 0.00 0.00 55.73 54.72 1snx s ARG 576 Cb -0.12 -2.81 -0.10 0.00 0.00 0.00 0.00 34.95 31.92 1snx s ARG 576 CO 0.20 0.00 1.33 -0.51 0.00 0.00 0.00 175.30 176.33 1snx s LEU 577 N -4.21 4.42 1.02 2.53 1.43 -1.26 -4.98 118.68 117.64 1snx s LEU 577 Ca 0.47 2.67 -0.15 0.00 -1.03 0.00 0.00 54.13 56.09 1snx s LEU 577 Cb -0.10 -3.64 0.15 0.00 0.03 0.00 0.00 46.19 42.64 1snx s LEU 577 CO 0.31 -0.57 0.23 0.00 0.23 0.00 0.00 176.35 176.55 1snx n TYR 578 N 1.23 -2.22 -3.14 0.29 0.18 -1.26 -4.87 117.16 107.37 1snx n TYR 578 Ca 0.02 0.02 -0.41 0.00 1.88 0.00 0.00 57.90 59.41 1snx n TYR 578 Cb 0.42 -1.41 -0.07 0.00 -0.38 0.00 0.00 39.34 37.90 1snx n TYR 578 CO 0.00 0.00 0.00 0.21 -2.08 0.00 0.00 176.86 174.99 1snx s LYS 579 N -3.43 3.97 0.01 -3.48 2.20 -1.26 -5.03 119.74 112.72 1snx s LYS 579 Ca 0.39 0.34 -0.30 0.00 -0.36 0.00 0.00 55.97 56.03 1snx s LYS 579 Cb -0.06 -3.70 -0.05 0.00 -1.51 0.00 0.00 37.83 32.50 1snx s LYS 579 CO 0.39 -0.50 1.33 -1.25 -0.36 0.00 0.00 175.35 174.96 1snx s PRO 580 N 2.52 4.32 0.04 4.03 0.04 -1.26 -4.90 135.00 139.79 1snx s PRO 580 Ca 0.24 1.90 -0.08 0.00 0.04 0.00 0.00 61.00 63.10 1snx s PRO 580 Cb -0.15 -3.50 -0.02 0.00 0.04 0.00 0.00 34.50 30.87 1snx s PRO 580 CO 0.11 -0.49 0.58 2.89 0.04 0.00 0.00 177.00 180.13 1snx n ARG 581 N 4.95 -0.11 -0.19 4.56 1.85 -1.26 0.35 116.66 126.81 1snx n ARG 581 Ca 0.12 0.58 0.28 0.00 -1.00 0.00 0.00 57.85 57.82 1snx n ARG 581 Cb 0.44 -0.85 0.70 0.00 -1.05 0.00 0.00 32.46 31.70 1snx n ARG 581 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 1snx h LEU 582 N 0.00 0.04 -9.60 2.89 3.38 -1.91 -3.41 115.31 106.71 1snx h LEU 582 Ca 0.04 0.01 -0.57 0.00 0.09 0.00 0.00 57.88 57.45 1snx h LEU 582 Cb 0.11 -0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.93 1snx h LEU 582 CO -0.25 0.02 0.74 0.00 0.09 0.00 0.00 178.44 179.04 1snx n ALA 583 N -2.69 1.51 -2.36 1.53 0.00 1.07 -4.95 120.51 114.62 1snx n ALA 583 Ca 0.19 0.42 -0.23 0.00 0.00 0.00 0.00 53.44 53.81 1snx n ALA 583 Cb 0.94 -2.34 0.01 0.00 0.00 0.00 0.00 19.45 18.05 1snx n ALA 583 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1snx s SER 584 N 0.58 5.92 0.51 0.00 0.01 -1.26 -4.83 113.70 114.63 1snx s SER 584 Ca 0.71 0.36 0.19 0.00 1.31 0.00 0.00 55.95 58.52 1snx s SER 584 Cb -0.63 -1.66 1.26 0.00 0.21 0.00 0.00 66.02 65.21 1snx s SER 584 CO 0.44 -0.64 2.07 0.71 0.41 0.00 0.00 173.24 176.24 1snx h THR 585 N 0.42 0.90 -0.01 1.44 1.35 -1.92 0.14 112.91 115.23 1snx h THR 585 Ca -0.47 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 1snx h THR 585 Cb 1.24 0.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1snx h THR 585 CO 0.58 0.01 -0.45 1.41 -0.25 0.00 0.00 175.52 176.82 1snx n HIS 586 N -4.47 0.00 -0.07 4.73 8.25 -1.26 -3.39 115.22 119.01 1snx n HIS 586 Ca 0.03 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.42 1snx n HIS 586 Cb 0.30 -0.09 -0.05 0.00 1.12 0.00 0.00 29.99 31.27 1snx n HIS 586 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1snx h VAL 587 N 1.27 0.57 0.00 1.59 2.07 -1.40 -3.24 116.25 117.11 1snx h VAL 587 Ca 0.00 -1.50 0.00 0.00 0.82 0.00 0.00 66.70 66.02 1snx h VAL 587 Cb 0.58 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 1snx h VAL 587 CO 0.00 0.19 0.17 0.00 0.02 0.00 0.00 177.57 177.95 1snx n TYR 588 N -4.65 0.30 -0.06 1.57 9.36 0.29 0.34 117.16 124.30 1snx n TYR 588 Ca -0.09 0.16 -0.14 0.00 3.32 0.00 0.00 57.90 61.15 1snx n TYR 588 Cb 0.27 -0.62 -0.06 0.00 -0.63 0.00 0.00 39.34 38.30 1snx n TYR 588 CO 0.00 0.00 0.00 1.96 0.22 0.00 0.00 176.86 179.04 1snx h GLN 589 N 0.00 0.52 0.07 2.98 4.20 -1.58 -3.22 115.11 118.09 1snx h GLN 589 Ca 0.00 -0.31 -0.00 0.00 0.06 0.00 0.00 58.65 58.40 1snx h GLN 589 Cb 0.34 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1snx h GLN 589 CO 0.00 0.91 -0.03 0.82 -0.67 0.00 0.00 178.83 179.85 1snx h ILE 590 N 0.18 1.20 -0.82 2.54 2.04 -0.23 -2.96 117.51 119.47 1snx h ILE 590 Ca 0.02 -1.46 0.34 0.00 1.00 0.00 0.00 64.86 64.77 1snx h ILE 590 Cb 0.85 2.08 -0.15 0.00 -0.74 0.00 0.00 36.82 38.86 1snx h ILE 590 CO 0.06 0.33 0.45 0.23 0.00 0.00 0.00 178.15 179.22 1snx n MET 591 N -4.81 -0.05 0.09 2.37 2.81 -0.79 0.37 117.12 117.11 1snx n MET 591 Ca -0.08 1.13 -0.02 0.00 -1.81 0.00 0.00 57.70 56.91 1snx n MET 591 Cb 0.31 -2.03 -0.05 0.00 -0.71 0.00 0.00 33.22 30.74 1snx n MET 591 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1snx h ASN 592 N 0.00 0.00 0.41 7.83 2.35 -1.60 -0.93 115.58 123.64 1snx h ASN 592 Ca 0.69 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 56.40 1snx h ASN 592 Cb 1.84 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 40.21 1snx h ASN 592 CO -0.63 0.72 -0.22 0.45 -1.65 0.00 0.00 177.43 176.11 1snx h HIS 593 N 0.00 0.00 0.09 1.19 3.86 0.70 0.86 115.15 121.86 1snx h HIS 593 Ca -0.04 0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 58.90 1snx h HIS 593 Cb 1.59 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 30.05 1snx h HIS 593 CO 0.00 0.22 -1.28 0.00 0.86 0.00 0.00 177.93 177.73 1snx n TRP 595 N -3.45 2.04 -1.76 0.00 8.01 0.16 -4.02 117.44 118.42 1snx n TRP 595 Ca -0.09 -0.71 -0.38 0.00 -1.31 0.00 0.00 57.50 55.02 1snx n TRP 595 Cb 1.01 -0.50 0.06 0.00 -2.01 0.00 0.00 31.31 29.87 1snx n TRP 595 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.69 176.83 1snx s LYS 596 N -2.71 2.79 0.11 -0.99 -0.14 0.28 -4.90 119.74 114.19 1snx s LYS 596 Ca 0.54 2.14 -0.12 0.00 -1.36 0.00 0.00 55.97 57.17 1snx s LYS 596 Cb 0.41 -2.02 -0.15 0.00 -1.68 0.00 0.00 37.83 34.39 1snx s LYS 596 CO 0.16 -1.43 1.31 0.93 -0.76 0.00 0.00 175.35 175.56 1snx h GLU 597 N 0.93 0.80 -6.33 1.68 5.08 -1.92 -3.44 114.58 111.37 1snx h GLU 597 Ca -0.51 -0.64 -0.54 0.00 -1.00 0.00 0.00 59.36 56.66 1snx h GLU 597 Cb 1.32 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 30.67 1snx h GLU 597 CO 0.55 1.25 0.15 1.03 -1.00 0.00 0.00 179.01 180.99 1snx s ARG 598 N -3.77 4.49 0.00 2.33 0.52 -1.26 -4.79 118.95 116.47 1snx s ARG 598 Ca -0.10 1.06 0.00 0.00 -0.52 0.00 0.00 55.73 56.16 1snx s ARG 598 Cb 0.09 -3.33 0.00 0.00 0.52 0.00 0.00 34.95 32.22 1snx s ARG 598 CO 0.90 0.37 0.90 -2.30 0.02 0.00 0.00 175.30 175.19 1snx n PRO 599 N 2.49 0.00 -0.07 3.54 -0.02 -1.26 -3.26 135.00 136.42 1snx n PRO 599 Ca -0.04 0.41 0.07 0.00 -2.02 0.00 0.00 63.50 61.92 1snx n PRO 599 Cb 0.50 -1.40 0.12 0.00 -0.02 0.00 0.00 33.50 32.70 1snx n PRO 599 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1snx n GLU 600 N -1.72 -0.01 -0.55 -0.52 0.00 -1.26 0.24 120.64 116.81 1snx n GLU 600 Ca 0.00 0.27 0.08 0.00 0.00 0.00 0.00 57.16 57.51 1snx n GLU 600 Cb 0.00 -0.49 0.32 0.00 0.00 0.00 0.00 31.44 31.26 1snx n GLU 600 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 1snx n ASP 601 N -3.34 4.26 -4.82 -1.84 5.75 -1.20 -4.86 116.55 110.50 1snx n ASP 601 Ca 0.08 -2.41 -0.37 0.00 -0.01 0.00 0.00 54.79 52.08 1snx n ASP 601 Cb 0.27 -0.55 -0.06 0.00 -1.03 0.00 0.00 41.12 39.75 1snx n ASP 601 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1snx s ARG 602 N -1.85 3.82 0.00 0.11 0.52 0.65 -4.94 118.95 117.26 1snx s ARG 602 Ca 0.45 0.09 0.00 0.00 -0.52 0.00 0.00 55.73 55.75 1snx s ARG 602 Cb 0.29 -3.27 0.00 0.00 0.52 0.00 0.00 34.95 32.50 1snx s ARG 602 CO 0.21 0.60 0.00 -2.30 0.02 0.00 0.00 175.30 173.83 1snx n PRO 603 N 2.37 1.18 -4.25 3.54 -0.02 -1.26 -5.03 135.00 131.52 1snx n PRO 603 Ca -0.16 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.14 1snx n PRO 603 Cb 0.53 0.00 -0.15 0.00 -0.02 0.00 0.00 33.50 33.86 1snx n PRO 603 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1snx s ALA 604 N -2.28 0.61 0.42 3.55 0.00 -1.26 -4.98 121.76 117.81 1snx s ALA 604 Ca 0.00 -0.27 0.25 0.00 0.00 0.00 0.00 51.96 51.94 1snx s ALA 604 Cb 0.00 -0.19 1.32 0.00 0.00 0.00 0.00 23.12 24.25 1snx s ALA 604 CO 0.00 0.13 1.65 0.74 0.00 0.00 0.00 175.76 178.28 1snx h PHE 605 N 6.14 0.61 -0.35 0.00 -1.00 -1.93 0.81 116.94 121.23 1snx h PHE 605 Ca -0.31 0.03 0.05 0.00 2.81 0.00 0.00 57.97 60.55 1snx h PHE 605 Cb 1.18 -0.16 -0.04 0.00 3.61 0.00 0.00 35.95 40.54 1snx h PHE 605 CO 0.42 -0.17 0.08 0.66 -1.61 0.00 0.00 178.31 177.69 1snx h SER 606 N 0.17 0.03 -0.16 2.17 4.64 -1.92 -2.08 113.55 116.41 1snx h SER 606 Ca 0.77 0.05 -0.16 0.00 -0.47 0.00 0.00 61.79 61.98 1snx h SER 606 Cb 2.24 0.07 0.01 0.00 -0.31 0.00 0.00 62.40 64.40 1snx h SER 606 CO -0.44 0.06 -0.52 -0.09 -0.87 0.00 0.00 176.83 174.97 1snx h ARG 607 N 0.20 0.63 -0.82 4.77 2.43 0.14 -3.26 114.38 118.48 1snx h ARG 607 Ca 0.16 -0.47 0.20 0.00 -0.81 0.00 0.00 59.98 59.06 1snx h ARG 607 Cb 0.17 0.08 -0.13 0.00 -0.42 0.00 0.00 29.97 29.68 1snx h ARG 607 CO -0.20 1.09 0.19 -0.07 -1.51 0.00 0.00 179.97 179.47 1snx h LEU 608 N 0.30 -0.03 -0.39 3.80 3.38 -0.71 0.13 115.31 121.79 1snx h LEU 608 Ca -0.02 0.18 0.06 0.00 0.09 0.00 0.00 57.88 58.18 1snx h LEU 608 Cb 1.15 0.25 -0.05 0.00 0.09 0.00 0.00 40.66 42.09 1snx h LEU 608 CO 0.11 -0.11 0.10 0.25 0.09 0.00 0.00 178.44 178.88 1snx h LEU 609 N 0.23 0.06 -0.68 1.67 5.85 -1.42 0.88 115.31 121.89 1snx h LEU 609 Ca 0.49 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 59.23 1snx h LEU 609 Cb 0.92 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 1snx h LEU 609 CO -0.60 0.07 0.28 0.03 -0.34 0.00 0.00 178.44 177.88 1snx h ARG 610 N 0.24 1.01 0.38 1.25 -0.00 -0.97 -0.64 114.38 115.65 1snx h ARG 610 Ca 0.19 -0.18 -0.02 0.00 -0.50 0.00 0.00 59.98 59.47 1snx h ARG 610 Cb 0.21 -0.17 0.00 0.00 0.00 0.00 0.00 29.97 30.01 1snx h ARG 610 CO -0.23 0.83 -0.21 1.96 0.00 0.00 0.00 179.97 182.33 1snx h GLN 611 N 0.96 -0.53 0.00 0.04 4.20 0.12 -1.72 115.11 118.19 1snx h GLN 611 Ca 0.23 0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.95 1snx h GLN 611 Cb 0.19 0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 1snx h GLN 611 CO -0.02 -0.35 -0.12 -0.07 -0.67 0.00 0.00 178.83 177.60 1snx h LEU 612 N -0.55 0.00 -0.29 1.46 3.38 0.75 -1.34 115.31 118.72 1snx h LEU 612 Ca -0.05 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1snx h LEU 612 Cb 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1snx h LEU 612 CO 0.07 0.12 -0.02 0.00 0.09 0.00 0.00 178.44 178.69 1snx h ALA 613 N 1.88 0.39 -0.95 1.53 0.00 -0.77 -1.15 119.26 120.20 1snx h ALA 613 Ca -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1snx h ALA 613 Cb 0.44 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1snx h ALA 613 CO 0.02 0.17 0.00 0.39 0.00 0.00 0.00 179.25 179.82 1snx n GLU 614 N -4.55 0.00 -0.24 0.00 1.02 -0.53 -2.92 120.64 113.42 1snx n GLU 614 Ca -0.03 0.54 0.29 0.00 -0.02 0.00 0.00 57.16 57.94 1snx n GLU 614 Cb 0.28 -1.34 0.69 0.00 -0.02 0.00 0.00 31.44 31.04 1snx n GLU 614 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1snx h ILE 615 N 0.00 0.52 0.00 -3.67 2.04 -1.53 0.93 117.51 115.79 1snx h ILE 615 Ca 0.00 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1snx h ILE 615 Cb 0.00 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 1snx h ILE 615 CO 0.00 0.01 0.00 0.00 0.00 0.00 0.00 178.15 178.16 1snx n ALA 616 N -2.69 1.73 -3.38 1.87 0.00 -0.43 -3.62 120.51 113.99 1snx n ALA 616 Ca 0.21 -0.06 -0.33 0.00 0.00 0.00 0.00 53.44 53.27 1snx n ALA 616 Cb 1.01 -1.20 -0.06 0.00 0.00 0.00 0.00 19.45 19.20 1snx n ALA 616 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1snx n GLU 617 N -1.30 3.01 0.00 0.00 1.02 0.32 -4.92 120.64 118.77 1snx n GLU 617 Ca 0.06 -4.61 0.00 0.00 -0.02 0.00 0.00 57.16 52.59 1snx n GLU 617 Cb 0.10 -2.35 0.00 0.00 -0.02 0.00 0.00 31.44 29.17 1snx n GLU 617 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1snx n SER 618 N 1.24 0.00 0.00 1.62 2.88 -1.24 -5.00 113.62 113.12 1snx n SER 618 Ca 0.27 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 1snx n SER 618 Cb 0.38 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 1snx n SER 618 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42