#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 4.48 0.05 1.55 -1.09 -1.26 -3.69 121.20 121.23 1snx s ILE 358 Ca 0.00 1.93 0.05 0.00 -2.23 0.00 0.00 60.65 60.40 1snx s ILE 358 Cb 0.00 -4.23 -0.04 0.00 -1.58 0.00 0.00 42.46 36.61 1snx s ILE 358 CO 0.00 0.23 -0.09 -1.81 -1.23 0.00 0.00 174.94 172.04 1snx s ASP 359 N 0.45 4.42 0.00 3.58 1.01 0.14 -4.84 116.67 121.42 1snx s ASP 359 Ca 0.50 -0.28 0.00 0.00 0.71 0.00 0.00 52.55 53.48 1snx s ASP 359 Cb -0.24 -0.92 0.00 0.00 1.01 0.00 0.00 42.92 42.77 1snx s ASP 359 CO 0.30 0.24 0.00 -0.81 0.21 0.00 0.00 175.17 175.10 1snx n PRO 360 N 1.20 2.64 -2.77 8.23 -0.04 -1.26 -3.76 135.00 139.24 1snx n PRO 360 Ca -0.15 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.89 1snx n PRO 360 Cb 0.52 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.00 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 0.00 6.85 -0.69 3.54 2.88 -1.26 -4.40 113.62 120.54 1snx n SER 361 Ca 0.00 -3.51 0.13 0.00 -1.33 0.00 0.00 58.87 54.16 1snx n SER 361 Cb 0.00 -1.24 0.27 0.00 -0.75 0.00 0.00 64.21 62.49 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 0.85 1.88 -2.85 -1.46 1.02 -1.26 -4.92 120.64 113.91 1snx n GLU 362 Ca 0.37 -1.39 -0.38 0.00 -0.02 0.00 0.00 57.16 55.75 1snx n GLU 362 Cb 0.30 -1.47 -0.06 0.00 -0.02 0.00 0.00 31.44 30.18 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 -2.07 4.42 -0.58 -4.62 1.43 -1.26 -2.60 118.68 113.40 1snx s LEU 363 Ca 0.31 1.77 -0.04 0.00 -1.03 0.00 0.00 54.13 55.14 1snx s LEU 363 Cb 0.20 -3.80 0.15 0.00 0.03 0.00 0.00 46.19 42.77 1snx s LEU 363 CO 0.35 0.02 0.41 -0.89 0.23 0.00 0.00 176.35 176.47 1snx s THR 364 N -1.48 3.83 0.04 5.49 2.01 0.45 -4.86 115.64 121.12 1snx s THR 364 Ca 0.46 -2.63 -0.30 0.00 0.31 0.00 0.00 61.69 59.53 1snx s THR 364 Cb -0.20 -3.51 -0.09 0.00 0.01 0.00 0.00 72.50 68.71 1snx s THR 364 CO 0.25 -0.84 1.95 -0.36 -0.69 0.00 0.00 174.62 174.93 1snx s PHE 365 N 0.33 1.34 -0.10 4.92 0.40 -1.26 -2.30 117.98 121.31 1snx s PHE 365 Ca 0.14 -0.42 -0.08 0.00 -0.60 0.00 0.00 56.93 55.98 1snx s PHE 365 Cb -0.21 -4.23 -0.03 0.00 0.51 0.00 0.00 43.02 39.07 1snx s PHE 365 CO -0.04 -5.49 -0.15 0.28 0.70 0.00 0.00 175.22 170.53 1snx n VAL 366 N 5.51 0.94 -1.74 -0.44 0.31 0.25 -4.97 118.33 118.21 1snx n VAL 366 Ca 0.20 0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.83 1snx n VAL 366 Cb 0.41 -2.08 0.00 0.00 -0.91 0.00 0.00 33.84 31.26 1snx n VAL 366 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1snx n GLN 367 N -3.80 0.00 -4.01 5.55 1.13 -1.11 -5.00 117.38 110.13 1snx n GLN 367 Ca -0.06 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 54.92 1snx n GLN 367 Cb 0.22 0.00 -0.11 0.00 0.11 0.00 0.00 30.24 30.46 1snx n GLN 367 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1snx s GLU 368 N 2.34 0.40 -0.45 -1.09 2.12 -1.26 -3.49 118.70 117.27 1snx s GLU 368 Ca 0.00 -0.80 0.04 0.00 0.36 0.00 0.00 54.97 54.57 1snx s GLU 368 Cb 0.00 0.14 0.25 0.00 0.26 0.00 0.00 34.13 34.78 1snx s GLU 368 CO 0.00 -0.07 0.97 0.44 -0.54 0.00 0.00 175.26 176.06 1snx n ILE 369 N 1.14 0.00 0.00 -3.70 -5.35 -0.14 -4.87 119.36 106.44 1snx n ILE 369 Ca -0.21 -1.29 0.00 0.00 -0.27 0.00 0.00 62.75 60.98 1snx n ILE 369 Cb 0.57 1.39 0.00 0.00 -1.74 0.00 0.00 39.64 39.86 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 1.63 3.06 3.86 3.28 0.00 -1.26 -4.58 105.19 111.18 1snx n GLY 370 Ca 0.07 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 45.13 1snx n GLY 370 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1snx s SER 371 N 0.00 4.44 0.00 1.61 1.04 -1.26 -1.57 113.70 117.96 1snx s SER 371 Ca 0.00 -1.44 0.00 0.00 0.48 0.00 0.00 55.95 54.99 1snx s SER 371 Cb 0.00 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1snx s SER 371 CO 0.00 -1.06 0.00 0.61 0.98 0.00 0.00 173.24 173.77 1snx n GLY 372 N -1.61 3.39 3.31 7.32 0.00 -1.26 -4.98 105.19 111.36 1snx n GLY 372 Ca -0.09 -1.61 -0.44 0.00 0.00 0.00 0.00 46.02 43.88 1snx n GLY 372 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1snx n GLN 373 N -1.90 3.54 0.00 1.61 7.27 -1.26 -3.69 117.38 122.95 1snx n GLN 373 Ca 0.00 -4.04 0.00 0.00 0.07 0.00 0.00 57.00 53.03 1snx n GLN 373 Cb 0.00 -2.84 0.00 0.00 2.41 0.00 0.00 30.24 29.81 1snx n GLN 373 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1snx n PHE 374 N 4.19 0.00 0.00 3.69 7.35 -1.26 -4.96 117.46 126.47 1snx n PHE 374 Ca 0.33 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.02 1snx n PHE 374 Cb 0.40 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.23 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 1.42 3.57 7.13 0.00 -1.12 -4.37 105.19 111.82 1snx n GLY 375 Ca 0.00 0.45 -0.42 0.00 0.00 0.00 0.00 46.02 46.05 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 4.21 0.03 0.99 1.43 -0.97 -4.51 118.68 119.87 1snx s LEU 376 Ca 0.00 0.13 -0.30 0.00 -1.03 0.00 0.00 54.13 52.93 1snx s LEU 376 Cb 0.00 -2.94 -0.08 0.00 0.03 0.00 0.00 46.19 43.19 1snx s LEU 376 CO 0.00 -0.76 1.85 -0.69 0.23 0.00 0.00 176.35 176.98 1snx s VAL 377 N 3.07 3.08 -0.31 -1.59 1.01 -0.61 -2.89 120.40 122.16 1snx s VAL 377 Ca 0.29 0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.52 1snx s VAL 377 Cb -0.13 -3.14 0.09 0.00 0.00 0.00 0.00 36.38 33.20 1snx s VAL 377 CO 0.18 -0.02 0.00 -1.00 0.00 0.00 0.00 175.10 174.27 1snx s HIS 378 N 3.99 3.50 -0.09 5.22 3.76 1.12 -0.96 115.29 131.82 1snx s HIS 378 Ca 0.83 -2.73 -0.31 0.00 -0.15 0.00 0.00 55.06 52.70 1snx s HIS 378 Cb -0.41 -2.56 -0.09 0.00 1.11 0.00 0.00 32.58 30.64 1snx s HIS 378 CO 0.37 -0.92 2.03 -0.11 -0.85 0.00 0.00 174.74 175.26 1snx n LEU 379 N 4.34 3.61 -4.13 0.89 7.94 -1.23 -0.50 117.00 127.92 1snx n LEU 379 Ca -0.02 0.71 -0.11 0.00 -1.11 0.00 0.00 56.01 55.48 1snx n LEU 379 Cb 0.42 -1.47 -0.08 0.00 0.53 0.00 0.00 43.42 42.82 1snx n LEU 379 CO 0.21 -0.16 -0.08 -0.83 -1.11 0.00 0.00 177.39 175.43 1snx s GLY 380 N 5.56 1.15 -0.09 -3.96 0.00 -1.24 0.88 107.32 109.62 1snx s GLY 380 Ca 0.95 -1.41 0.04 0.00 0.00 0.00 0.00 44.72 44.29 1snx s GLY 380 CO 0.43 -1.12 -0.22 -0.19 0.00 0.00 0.00 173.10 172.01 1snx s TYR 381 N -4.05 2.34 -0.21 1.90 1.51 -0.97 -1.95 117.35 115.92 1snx s TYR 381 Ca 0.33 -0.92 -0.12 0.00 -1.01 0.00 0.00 57.07 55.35 1snx s TYR 381 Cb 0.04 -1.58 -0.05 0.00 -0.11 0.00 0.00 41.96 40.26 1snx s TYR 381 CO 0.12 -0.37 0.22 -0.46 -1.11 0.00 0.00 175.55 173.95 1snx s TRP 382 N 0.34 3.38 0.00 2.71 -0.00 -0.91 0.17 118.94 124.63 1snx s TRP 382 Ca -0.16 0.40 0.00 0.00 -0.00 0.00 0.00 56.10 56.33 1snx s TRP 382 Cb -0.17 -2.30 0.00 0.00 -0.00 0.00 0.00 33.47 31.00 1snx s TRP 382 CO 0.07 0.14 0.00 1.28 -0.00 0.00 0.00 176.95 178.45 1snx n LEU 383 N 3.98 0.87 0.00 5.86 4.77 -1.07 -2.13 117.00 129.28 1snx n LEU 383 Ca -0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 1snx n LEU 383 Cb 0.52 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.24 1snx n LEU 383 CO 0.37 -0.44 0.00 -3.20 -1.33 0.00 0.00 177.39 172.80 1snx n ASN 384 N 0.00 0.00 -0.18 -1.43 5.15 -1.26 -4.74 115.26 112.81 1snx n ASN 384 Ca 0.00 0.00 0.20 0.00 -0.60 0.00 0.00 54.58 54.18 1snx n ASN 384 Cb 0.00 0.00 0.57 0.00 -0.53 0.00 0.00 39.78 39.82 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 0.00 0.28 -5.98 1.20 3.11 -1.79 -3.43 116.57 109.95 1snx h LYS 385 Ca 0.00 -0.02 -0.53 0.00 -2.81 0.00 0.00 60.65 57.29 1snx h LYS 385 Cb 0.00 -0.06 -0.19 0.00 -1.00 0.00 0.00 32.23 30.98 1snx h LYS 385 CO 0.00 0.18 -0.79 -0.51 -2.81 0.00 0.00 179.45 175.52 1snx s ASP 386 N -5.80 2.63 0.25 4.20 1.01 -0.91 -5.01 116.67 113.05 1snx s ASP 386 Ca -0.07 -0.81 -0.06 0.00 0.71 0.00 0.00 52.55 52.32 1snx s ASP 386 Cb 0.22 -0.15 -0.06 0.00 1.01 0.00 0.00 42.92 43.94 1snx s ASP 386 CO 0.77 -0.01 0.52 -0.75 0.21 0.00 0.00 175.17 175.91 1snx s LYS 387 N -2.56 3.66 0.13 8.23 2.20 -1.26 -2.14 119.74 128.01 1snx s LYS 387 Ca 0.13 0.04 -0.04 0.00 -0.36 0.00 0.00 55.97 55.74 1snx s LYS 387 Cb -0.07 -2.68 0.02 0.00 -1.51 0.00 0.00 37.83 33.59 1snx s LYS 387 CO 0.06 0.28 0.25 1.33 -0.36 0.00 0.00 175.35 176.90 1snx n VAL 388 N -0.62 0.00 -3.49 4.02 0.24 -0.82 -3.90 118.33 113.76 1snx n VAL 388 Ca -0.01 -0.40 -0.20 0.00 -2.04 0.00 0.00 64.34 61.68 1snx n VAL 388 Cb 0.53 0.35 -0.13 0.00 -1.47 0.00 0.00 33.84 33.12 1snx n VAL 388 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1snx s ALA 389 N -1.51 -0.13 -0.12 2.33 0.00 -1.13 -3.66 121.76 117.54 1snx s ALA 389 Ca 0.06 -0.11 -0.21 0.00 0.00 0.00 0.00 51.96 51.70 1snx s ALA 389 Cb -0.01 -1.42 -0.03 0.00 0.00 0.00 0.00 23.12 21.65 1snx s ALA 389 CO 0.05 -1.38 0.62 0.42 0.00 0.00 0.00 175.76 175.46 1snx s ILE 390 N 2.29 5.08 -0.39 0.00 1.01 0.34 -2.23 121.20 127.29 1snx s ILE 390 Ca 0.07 1.23 -0.08 0.00 0.00 0.00 0.00 60.65 61.88 1snx s ILE 390 Cb -0.15 -3.95 0.07 0.00 0.01 0.00 0.00 42.46 38.43 1snx s ILE 390 CO -0.20 0.23 0.20 -0.75 0.00 0.00 0.00 174.94 174.41 1snx s LYS 391 N 1.10 2.56 0.58 2.79 2.20 0.39 0.36 119.74 129.72 1snx s LYS 391 Ca 0.32 -1.38 -0.06 0.00 -0.36 0.00 0.00 55.97 54.48 1snx s LYS 391 Cb -0.16 -3.65 -0.00 0.00 -1.51 0.00 0.00 37.83 32.51 1snx s LYS 391 CO 0.13 -0.86 0.90 0.95 -0.36 0.00 0.00 175.35 176.12 1snx s THR 392 N 1.39 3.90 0.00 3.43 -4.23 -1.14 0.89 115.64 119.89 1snx s THR 392 Ca 0.02 0.12 0.00 0.00 -1.18 0.00 0.00 61.69 60.65 1snx s THR 392 Cb -0.22 -3.54 0.00 0.00 1.34 0.00 0.00 72.50 70.08 1snx s THR 392 CO 0.02 -0.58 0.00 -0.38 -0.54 0.00 0.00 174.62 173.14 1snx n ILE 393 N -2.57 0.00 0.00 2.99 2.08 -1.06 -2.28 119.36 118.51 1snx n ILE 393 Ca 0.04 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.35 1snx n ILE 393 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.46 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 -3.58 116.66 117.32 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 -4.93 120.64 121.03 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 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 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 0.00 -0.14 0.14 0.62 0.00 -1.26 -4.85 105.19 99.70 1snx n GLY 396 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.96 -1.87 4.61 0.00 -1.92 -3.46 119.26 117.57 1snx h ALA 397 Ca 0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1snx h ALA 397 Cb 0.53 -0.09 -0.22 0.00 0.00 0.00 0.00 17.79 18.00 1snx h ALA 397 CO 0.00 0.74 0.25 1.41 0.00 0.00 0.00 179.25 181.65 1snx s MET 398 N -3.57 0.77 1.16 0.00 -2.45 -1.26 -5.03 119.30 108.91 1snx s MET 398 Ca -0.01 0.72 -0.14 0.00 -1.25 0.00 0.00 55.69 55.00 1snx s MET 398 Cb 0.12 0.37 0.23 0.00 1.25 0.00 0.00 34.83 36.81 1snx s MET 398 CO 0.75 -0.13 0.72 0.43 1.05 0.00 0.00 175.02 177.83 1snx n SER 399 N 2.14 -1.90 0.10 1.11 7.64 -1.26 -4.82 113.62 116.62 1snx n SER 399 Ca -0.14 -0.13 -0.07 0.00 1.01 0.00 0.00 58.87 59.54 1snx n SER 399 Cb 0.56 -1.18 -0.04 0.00 -1.01 0.00 0.00 64.21 62.54 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 -2.49 -0.33 0.13 1.43 5.08 -2.01 -2.95 114.58 113.44 1snx h GLU 400 Ca -0.59 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 57.81 1snx h GLU 400 Cb 1.34 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.62 1snx h GLU 400 CO 0.46 -0.12 -0.37 1.05 -1.00 0.00 0.00 179.01 179.02 1snx h GLU 401 N -1.05 -0.58 0.00 2.33 4.11 -1.97 0.29 114.58 117.70 1snx h GLU 401 Ca -0.03 0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.44 1snx h GLU 401 Cb 0.35 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1snx h GLU 401 CO 0.06 -0.39 0.00 -3.47 0.07 0.00 0.00 179.01 175.28 1snx n ASP 402 N -5.44 0.00 0.05 3.06 -0.08 -1.25 0.24 116.55 113.12 1snx n ASP 402 Ca -0.07 0.64 0.14 0.00 -1.51 0.00 0.00 54.79 53.99 1snx n ASP 402 Cb 0.36 -0.26 0.62 0.00 2.34 0.00 0.00 41.12 44.17 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 0.14 -0.83 -0.67 3.57 -1.42 -0.74 116.94 116.98 1snx h PHE 403 Ca 0.00 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 1snx h PHE 403 Cb 0.00 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.66 1snx h PHE 403 CO -0.49 0.07 0.37 0.82 -2.23 0.00 0.00 178.31 176.85 1snx h ILE 404 N 0.13 1.26 0.85 1.41 2.04 0.20 -1.97 117.51 121.43 1snx h ILE 404 Ca 0.19 -0.77 -0.04 0.00 1.00 0.00 0.00 64.86 65.23 1snx h ILE 404 Cb 0.57 0.22 0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1snx h ILE 404 CO -0.02 0.32 -0.41 -0.08 0.00 0.00 0.00 178.15 177.96 1snx h GLU 405 N 1.20 -1.10 -0.37 2.37 4.81 0.12 -1.25 114.58 120.35 1snx h GLU 405 Ca 0.28 0.07 0.08 0.00 -0.13 0.00 0.00 59.36 59.66 1snx h GLU 405 Cb 0.16 0.25 -0.07 0.00 0.63 0.00 0.00 28.75 29.71 1snx h GLU 405 CO -0.03 -0.73 -0.11 1.49 -0.73 0.00 0.00 179.01 178.89 1snx h GLU 406 N -1.17 -0.03 0.00 1.92 4.81 -1.48 0.19 114.58 118.82 1snx h GLU 406 Ca -0.12 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1snx h GLU 406 Cb 0.87 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.26 1snx h GLU 406 CO 0.19 -0.02 0.00 0.00 -0.73 0.00 0.00 179.01 178.45 1snx n ALA 407 N -2.70 1.94 0.01 2.92 0.00 -0.75 -1.97 120.51 119.96 1snx n ALA 407 Ca 0.02 -0.08 -0.14 0.00 0.00 0.00 0.00 53.44 53.24 1snx n ALA 407 Cb 0.22 -1.25 -0.14 0.00 0.00 0.00 0.00 19.45 18.28 1snx n ALA 407 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1snx h GLU 408 N 0.00 0.13 0.00 0.00 5.08 0.62 -3.35 114.58 117.07 1snx h GLU 408 Ca 0.00 -0.23 -0.19 0.00 -1.00 0.00 0.00 59.36 57.95 1snx h GLU 408 Cb 0.09 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 1snx h GLU 408 CO 0.00 0.86 -1.29 -0.24 -1.00 0.00 0.00 179.01 177.34 1snx h VAL 409 N 0.04 0.74 -0.01 3.13 3.04 -1.12 -3.28 116.25 118.80 1snx h VAL 409 Ca -0.30 -2.31 0.00 0.00 -1.01 0.00 0.00 66.70 63.08 1snx h VAL 409 Cb 2.01 2.25 -0.00 0.00 -2.01 0.00 0.00 31.29 33.54 1snx h VAL 409 CO 0.10 0.42 0.00 0.24 -1.01 0.00 0.00 177.57 177.33 1snx h MET 410 N 0.00 0.00 0.00 4.17 2.86 -1.53 0.33 114.93 120.75 1snx h MET 410 Ca -0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.49 1snx h MET 410 Cb 1.66 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.32 1snx h MET 410 CO 0.06 0.00 -0.15 -1.33 1.06 0.00 0.00 176.91 176.55 1snx n MET 411 N -4.22 0.23 0.09 1.72 2.81 -1.24 -3.53 117.12 112.99 1snx n MET 411 Ca -0.03 0.16 -0.13 0.00 -1.81 0.00 0.00 57.70 55.89 1snx n MET 411 Cb 0.09 -1.74 -0.08 0.00 -0.71 0.00 0.00 33.22 30.78 1snx n MET 411 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1snx h LYS 412 N 0.00 0.26 -6.03 0.03 1.63 -0.45 -3.45 116.57 108.56 1snx h LYS 412 Ca 0.00 -0.35 -0.66 0.00 -0.85 0.00 0.00 60.65 58.78 1snx h LYS 412 Cb 0.71 0.12 -0.12 0.00 -0.60 0.00 0.00 32.23 32.34 1snx h LYS 412 CO 0.00 1.10 -0.60 -0.51 -3.45 0.00 0.00 179.45 175.99 1snx s LEU 413 N -7.31 3.72 -0.29 5.20 1.43 -1.04 -5.11 118.68 115.28 1snx s LEU 413 Ca -0.04 0.11 -0.16 0.00 -1.03 0.00 0.00 54.13 53.01 1snx s LEU 413 Cb 0.09 -2.08 0.14 0.00 0.03 0.00 0.00 46.19 44.37 1snx s LEU 413 CO 0.86 0.30 0.94 -0.94 0.23 0.00 0.00 176.35 177.74 1snx s SER 414 N -1.46 -0.58 0.01 2.29 1.04 -1.26 -4.91 113.70 108.83 1snx s SER 414 Ca 0.19 0.90 -0.14 0.00 0.48 0.00 0.00 55.95 57.38 1snx s SER 414 Cb -0.12 1.32 0.02 0.00 0.10 0.00 0.00 66.02 67.35 1snx s SER 414 CO 0.10 -0.14 0.30 -2.28 0.98 0.00 0.00 173.24 172.20 1snx s HIS 415 N 1.58 -0.14 -1.57 5.02 5.04 -1.26 -5.00 115.29 118.95 1snx s HIS 415 Ca -0.08 0.14 0.00 0.00 -1.54 0.00 0.00 55.06 53.58 1snx s HIS 415 Cb -0.04 0.09 0.00 0.00 0.04 0.00 0.00 32.58 32.66 1snx s HIS 415 CO -0.16 -0.42 0.20 -2.30 -2.34 0.00 0.00 174.74 169.72 1snx n PRO 416 N 1.04 0.00 0.00 2.88 -0.02 -1.26 0.11 135.00 137.75 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 0.57 -1.26 0.00 0.00 -0.02 0.00 0.00 33.50 32.79 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 -0.65 2.96 -4.13 -0.52 4.76 -1.26 -4.82 118.16 114.49 1snx n LYS 417 Ca 0.00 -0.19 -0.36 0.00 -2.87 0.00 0.00 58.31 54.89 1snx n LYS 417 Cb 0.00 -0.65 -0.08 0.00 -1.84 0.00 0.00 35.03 32.46 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 -0.95 3.95 0.02 -0.35 1.43 0.30 0.24 118.68 123.31 1snx s LEU 418 Ca 0.00 0.29 -0.33 0.00 -1.03 0.00 0.00 54.13 53.05 1snx s LEU 418 Cb 0.00 -1.94 -0.12 0.00 0.03 0.00 0.00 46.19 44.16 1snx s LEU 418 CO 0.00 0.38 1.82 0.52 0.23 0.00 0.00 176.35 179.30 1snx n VAL 419 N 2.15 0.44 -3.07 -1.59 0.31 -0.24 -4.52 118.33 111.81 1snx n VAL 419 Ca -0.19 -0.08 -0.40 0.00 -0.01 0.00 0.00 64.34 63.67 1snx n VAL 419 Cb 0.54 -1.89 -0.05 0.00 -0.91 0.00 0.00 33.84 31.53 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 3.19 4.42 0.13 5.55 -0.21 -1.26 -4.97 119.66 126.51 1snx s GLN 420 Ca 0.87 0.87 0.04 0.00 0.02 0.00 0.00 55.36 57.17 1snx s GLN 420 Cb -0.63 -3.42 -0.04 0.00 1.00 0.00 0.00 33.01 29.93 1snx s GLN 420 CO 0.45 0.15 0.11 -1.17 -2.12 0.00 0.00 175.29 172.71 1snx s LEU 421 N 0.51 3.79 0.00 2.90 2.96 -1.26 -0.08 118.68 127.50 1snx s LEU 421 Ca 0.36 -0.09 0.00 0.00 -0.22 0.00 0.00 54.13 54.18 1snx s LEU 421 Cb -0.18 -2.43 0.00 0.00 0.50 0.00 0.00 46.19 44.08 1snx s LEU 421 CO 0.18 0.11 0.00 -1.22 -1.32 0.00 0.00 176.35 174.10 1snx n TYR 422 N -0.02 0.00 -4.31 5.38 4.02 0.37 -4.83 117.16 117.76 1snx n TYR 422 Ca -0.08 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.63 1snx n TYR 422 Cb 0.53 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.80 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 2.62 3.31 3.16 2.72 0.00 -1.18 -4.83 105.19 110.99 1snx n GLY 423 Ca 0.00 -1.97 -0.17 0.00 0.00 0.00 0.00 46.02 43.88 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 -2.88 1.02 -0.75 1.61 1.01 -1.24 -0.35 120.40 118.80 1snx s VAL 424 Ca 0.23 -1.38 0.03 0.00 0.00 0.00 0.00 61.98 60.86 1snx s VAL 424 Cb 0.01 -1.10 0.33 0.00 0.00 0.00 0.00 36.38 35.62 1snx s VAL 424 CO 0.16 -0.33 1.28 0.00 0.00 0.00 0.00 175.10 176.21 1snx n LEU 426 N -0.14 0.00 -1.54 0.00 4.77 -1.26 -3.61 117.00 115.22 1snx n LEU 426 Ca 0.37 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.61 1snx n LEU 426 Cb 0.34 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1snx n LEU 426 CO 0.41 -0.15 0.03 -0.62 -1.33 0.00 0.00 177.39 175.73 1snx n GLU 427 N -1.27 0.03 -1.57 3.23 -0.58 -1.26 -4.78 120.64 114.44 1snx n GLU 427 Ca 0.07 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.81 1snx n GLU 427 Cb 0.10 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.49 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 1.53 -3.84 0.00 3.49 1.13 -1.24 -4.93 117.38 113.52 1snx n GLN 428 Ca 0.00 2.91 0.00 0.00 -1.94 0.00 0.00 57.00 57.97 1snx n GLN 428 Cb 0.02 -3.53 0.00 0.00 0.11 0.00 0.00 30.24 26.83 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 -1.69 0.00 -2.04 -1.58 0.00 -1.26 -4.81 120.51 109.13 1snx n ALA 429 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 1snx n ALA 429 Cb 0.20 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.59 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 2.50 -0.38 0.00 0.04 -1.26 -4.85 135.00 131.04 1snx s PRO 430 Ca 0.00 -0.50 -0.40 0.00 0.04 0.00 0.00 61.00 60.14 1snx s PRO 430 Cb 0.00 -5.10 -0.16 0.00 0.04 0.00 0.00 34.50 29.28 1snx s PRO 430 CO 0.00 -3.58 1.97 -0.89 0.04 0.00 0.00 177.00 174.54 1snx n ILE 431 N 7.89 0.16 -4.43 0.56 5.41 -1.26 -4.54 119.36 123.16 1snx n ILE 431 Ca 0.42 -0.10 -0.21 0.00 1.00 0.00 0.00 62.75 63.85 1snx n ILE 431 Cb 0.47 -1.09 -0.10 0.00 -0.71 0.00 0.00 39.64 38.21 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 -3.48 2.70 -0.42 0.00 2.96 0.26 -1.28 118.68 119.42 1snx s LEU 433 Ca 0.33 -0.42 0.04 0.00 -0.22 0.00 0.00 54.13 53.86 1snx s LEU 433 Cb 0.06 -1.57 0.11 0.00 0.50 0.00 0.00 46.19 45.30 1snx s LEU 433 CO 0.15 0.24 0.14 -0.69 -1.32 0.00 0.00 176.35 174.87 1snx s VAL 434 N -0.98 2.43 0.75 1.68 1.01 0.52 0.15 120.40 125.95 1snx s VAL 434 Ca 0.16 -2.75 -0.10 0.00 0.00 0.00 0.00 61.98 59.28 1snx s VAL 434 Cb -0.11 -2.75 0.17 0.00 0.00 0.00 0.00 36.38 33.69 1snx s VAL 434 CO 0.07 -0.69 1.02 0.49 0.00 0.00 0.00 175.10 175.99 1snx n PHE 435 N 3.78 -3.77 -1.72 5.22 3.01 -0.95 0.14 117.46 123.17 1snx n PHE 435 Ca 0.04 -1.06 -0.29 0.00 1.01 0.00 0.00 57.45 57.15 1snx n PHE 435 Cb 0.38 -0.78 0.09 0.00 -0.01 0.00 0.00 39.48 39.16 1snx n PHE 435 CO 0.00 0.00 0.00 -1.83 1.01 0.00 0.00 176.76 175.94 1snx s GLU 436 N -5.18 1.98 -0.44 -1.08 -1.05 0.89 -2.82 118.70 111.00 1snx s GLU 436 Ca 0.59 0.37 -0.17 0.00 -0.15 0.00 0.00 54.97 55.61 1snx s GLU 436 Cb -0.02 -1.93 0.04 0.00 -0.44 0.00 0.00 34.13 31.78 1snx s GLU 436 CO 0.41 -1.63 0.44 0.12 0.95 0.00 0.00 175.26 175.55 1snx s PHE 437 N -3.35 3.17 -0.04 4.83 5.36 -1.25 -3.79 117.98 122.91 1snx s PHE 437 Ca 0.61 -0.53 -0.30 0.00 -0.96 0.00 0.00 56.93 55.76 1snx s PHE 437 Cb -0.13 -3.01 -0.05 0.00 -0.34 0.00 0.00 43.02 39.49 1snx s PHE 437 CO 0.52 -0.76 1.51 -1.64 -1.46 0.00 0.00 175.22 173.39 1snx s MET 438 N 2.07 4.22 0.00 10.12 -1.94 -1.26 -4.86 119.30 127.65 1snx s MET 438 Ca 0.10 2.04 0.10 0.00 -1.71 0.00 0.00 55.69 56.23 1snx s MET 438 Cb -0.19 -3.78 0.60 0.00 2.01 0.00 0.00 34.83 33.47 1snx s MET 438 CO 0.12 -0.73 1.11 0.39 -0.01 0.00 0.00 175.02 175.90 1snx n GLU 439 N 6.34 0.28 -2.75 2.03 -0.58 -1.24 -3.86 120.64 120.85 1snx n GLU 439 Ca 0.15 0.05 -0.03 0.00 -0.42 0.00 0.00 57.16 56.91 1snx n GLU 439 Cb 0.43 -1.50 0.06 0.00 -0.57 0.00 0.00 31.44 29.86 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 -1.08 0.39 -1.05 -0.32 8.25 -0.48 -4.95 115.22 115.99 1snx n HIS 440 Ca 0.07 -2.22 0.08 0.00 -0.26 0.00 0.00 57.72 55.38 1snx n HIS 440 Cb 0.05 0.17 -0.02 0.00 1.12 0.00 0.00 29.99 31.31 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 -0.61 -0.81 3.70 -1.41 0.00 -1.25 -4.17 105.19 100.63 1snx n GLY 441 Ca 0.03 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 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 4.44 0.04 0.00 0.00 7.94 -0.43 -1.02 117.00 127.98 1snx n LEU 443 Ca 0.09 0.22 0.00 0.00 -1.11 0.00 0.00 56.01 55.22 1snx n LEU 443 Cb 0.47 -0.11 0.00 0.00 0.53 0.00 0.00 43.42 44.31 1snx n LEU 443 CO 0.55 -0.25 0.23 -0.24 -1.11 0.00 0.00 177.39 176.57 1snx n SER 444 N -3.36 0.00 0.21 1.96 2.88 0.33 -0.52 113.62 115.13 1snx n SER 444 Ca 0.05 0.46 0.18 0.00 -1.33 0.00 0.00 58.87 58.23 1snx n SER 444 Cb 0.17 0.00 0.84 0.00 -0.75 0.00 0.00 64.21 64.47 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 0.00 1.01 -3.46 3.32 -1.36 0.15 116.42 116.09 1snx h ASP 445 Ca 0.00 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 1snx h ASP 445 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1snx h ASP 445 CO 0.00 0.00 -0.34 0.22 -1.72 0.00 0.00 179.24 177.40 1snx h TYR 446 N 0.00 0.00 -0.02 4.55 3.20 -1.29 -3.06 116.97 120.34 1snx h TYR 446 Ca 0.09 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.89 1snx h TYR 446 Cb 0.54 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.81 1snx h TYR 446 CO 0.00 0.34 -0.25 -0.07 -1.64 0.00 0.00 178.16 176.54 1snx h LEU 447 N 0.00 0.26 0.00 2.82 3.38 0.13 -3.39 115.31 118.51 1snx h LEU 447 Ca -0.00 -0.72 0.00 0.00 0.09 0.00 0.00 57.88 57.25 1snx h LEU 447 Cb 0.93 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.61 1snx h LEU 447 CO 0.04 0.94 0.00 0.54 0.09 0.00 0.00 178.44 180.05 1snx n ARG 448 N -4.51 0.00 -0.36 1.13 1.74 -1.10 -3.63 116.66 109.93 1snx n ARG 448 Ca -0.09 0.07 -0.20 0.00 -0.77 0.00 0.00 57.85 56.86 1snx n ARG 448 Cb 0.48 -0.61 0.19 0.00 -1.02 0.00 0.00 32.46 31.51 1snx n ARG 448 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1snx n THR 449 N -0.18 0.00 0.00 0.55 5.66 -1.19 -1.79 114.28 117.32 1snx n THR 449 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1snx n THR 449 Cb 0.00 -0.64 0.00 0.00 -1.55 0.00 0.00 70.33 68.14 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 -2.94 0.00 -0.99 1.09 -0.06 -1.26 -4.85 117.38 108.36 1snx n GLN 450 Ca 0.09 0.00 -0.36 0.00 -2.00 0.00 0.00 57.00 54.73 1snx n GLN 450 Cb 0.39 -3.92 0.04 0.00 -4.06 0.00 0.00 30.24 22.70 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 -1.90 -0.02 0.00 3.69 0.63 -0.74 -3.10 116.66 115.22 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 -1.05 0.00 0.00 0.45 0.00 0.00 32.46 31.86 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 3.39 0.63 0.00 5.14 0.00 -1.26 -4.56 105.19 108.54 1snx n GLY 452 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -4.79 0.99 -0.00 -1.18 -4.60 117.00 107.41 1snx n LEU 453 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 56.01 55.63 1snx n LEU 453 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.36 1snx n LEU 453 CO 0.00 0.00 0.24 -0.36 -0.00 0.00 0.00 177.39 177.27 1snx s PHE 454 N -1.64 3.74 0.00 1.47 0.40 -1.26 -5.10 117.98 115.59 1snx s PHE 454 Ca 0.00 1.18 0.00 0.00 -0.60 0.00 0.00 56.93 57.51 1snx s PHE 454 Cb 0.00 -2.50 0.00 0.00 0.51 0.00 0.00 43.02 41.03 1snx s PHE 454 CO 0.00 0.50 0.00 0.00 0.70 0.00 0.00 175.22 176.42 1snx n ALA 455 N 2.16 0.00 -0.10 5.36 0.00 -1.26 -5.04 120.51 121.63 1snx n ALA 455 Ca -0.10 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.13 1snx n ALA 455 Cb 0.51 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.84 1snx n ALA 455 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1snx h ALA 456 N -0.02 0.23 0.00 0.00 0.00 -1.99 -3.30 119.26 114.19 1snx h ALA 456 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.79 1snx h ALA 456 Cb 0.00 0.64 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1snx h ALA 456 CO 0.00 0.62 0.00 0.39 0.00 0.00 0.00 179.25 180.26 1snx n GLU 457 N -4.43 0.03 -0.10 0.00 1.02 -1.26 -2.35 120.64 113.55 1snx n GLU 457 Ca -0.29 0.28 -0.21 0.00 -0.02 0.00 0.00 57.16 56.93 1snx n GLU 457 Cb 0.67 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 30.46 1snx n GLU 457 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1snx n THR 458 N -1.31 1.57 0.17 2.62 -1.04 -1.26 -2.93 114.28 112.11 1snx n THR 458 Ca 0.01 -0.54 -0.14 0.00 -2.04 0.00 0.00 64.05 61.34 1snx n THR 458 Cb 0.02 -1.58 -0.08 0.00 -1.82 0.00 0.00 70.33 66.87 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 -0.16 -0.32 -1.35 -4.42 3.38 -1.54 -1.08 115.31 109.82 1snx h LEU 459 Ca -0.55 0.01 0.19 0.00 0.09 0.00 0.00 57.88 57.62 1snx h LEU 459 Cb 1.87 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 42.63 1snx h LEU 459 CO -0.10 -0.22 0.60 0.25 0.09 0.00 0.00 178.44 179.06 1snx h LEU 460 N -0.36 0.55 -2.14 1.67 5.85 -1.66 0.16 115.31 119.37 1snx h LEU 460 Ca -0.03 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1snx h LEU 460 Cb 0.29 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1snx h LEU 460 CO 0.05 0.23 0.00 0.61 -0.34 0.00 0.00 178.44 178.99 1snx n GLY 461 N -1.46 1.65 1.79 3.75 0.00 -0.42 -2.49 105.19 108.02 1snx n GLY 461 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 0.72 0.00 0.33 1.61 2.81 0.53 -4.74 117.12 118.38 1snx n MET 462 Ca 0.00 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 56.01 1snx n MET 462 Cb 0.40 -0.11 0.63 0.00 -0.71 0.00 0.00 33.22 33.43 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 0.00 0.74 -0.83 0.00 3.38 -1.82 0.48 115.31 117.26 1snx h LEU 464 Ca 0.00 -0.89 0.05 0.00 0.09 0.00 0.00 57.88 57.13 1snx h LEU 464 Cb 0.98 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.43 1snx h LEU 464 CO -0.00 1.72 0.52 0.44 0.09 0.00 0.00 178.44 181.21 1snx h ASP 465 N 0.13 0.84 -0.00 -0.43 3.32 0.30 3.22 116.42 123.79 1snx h ASP 465 Ca -0.28 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 56.74 1snx h ASP 465 Cb 2.14 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 41.52 1snx h ASP 465 CO 0.24 0.55 -0.13 0.58 -1.72 0.00 0.00 179.24 178.76 1snx h VAL 466 N 0.98 1.59 -0.24 -1.35 2.07 -1.10 -1.35 116.25 116.84 1snx h VAL 466 Ca 0.35 -1.91 0.05 0.00 0.82 0.00 0.00 66.70 66.01 1snx h VAL 466 Cb 0.11 2.83 -0.05 0.00 -1.52 0.00 0.00 31.29 32.66 1snx h VAL 466 CO -0.15 0.51 -0.06 0.00 0.02 0.00 0.00 177.57 177.89 1snx h GLU 468 N 0.00 -0.43 -0.21 0.00 5.08 0.58 0.16 114.58 119.77 1snx h GLU 468 Ca 0.11 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1snx h GLU 468 Cb 0.17 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 1snx h GLU 468 CO -0.24 -0.29 -0.13 0.41 -1.00 0.00 0.00 179.01 177.76 1snx n GLY 469 N -1.25 -1.23 0.17 -3.84 0.00 -0.51 0.24 105.19 98.78 1snx n GLY 469 Ca -0.05 0.38 -0.11 0.00 0.00 0.00 0.00 46.02 46.24 1snx n GLY 469 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1snx h MET 470 N 0.00 -0.20 -0.60 1.61 2.86 0.65 -2.97 114.93 116.28 1snx h MET 470 Ca 0.03 0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.76 1snx h MET 470 Cb 0.09 0.05 -0.08 0.00 0.06 0.00 0.00 31.60 31.71 1snx h MET 470 CO -0.20 -0.14 -0.31 0.00 1.06 0.00 0.00 176.91 177.33 1snx n ALA 471 N -2.44 -0.27 -0.07 6.32 0.00 0.14 0.16 120.51 124.36 1snx n ALA 471 Ca -0.05 0.54 -0.11 0.00 0.00 0.00 0.00 53.44 53.82 1snx n ALA 471 Cb 0.18 -0.15 -0.08 0.00 0.00 0.00 0.00 19.45 19.40 1snx n ALA 471 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1snx h TYR 472 N 0.00 -1.32 -0.50 0.00 3.20 -1.34 0.60 116.97 117.61 1snx h TYR 472 Ca 0.14 0.06 0.00 0.00 3.14 0.00 0.00 58.73 62.07 1snx h TYR 472 Cb 0.29 0.61 -0.02 0.00 1.54 0.00 0.00 36.73 39.14 1snx h TYR 472 CO -0.58 -0.40 0.32 -0.07 -1.64 0.00 0.00 178.16 175.79 1snx h LEU 473 N -0.37 0.57 -0.38 2.82 3.38 0.17 3.52 115.31 125.03 1snx h LEU 473 Ca 0.04 -0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.05 1snx h LEU 473 Cb 0.49 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 1snx h LEU 473 CO -0.42 0.42 0.09 -0.08 0.09 0.00 0.00 178.44 178.54 1snx h GLU 474 N 0.67 0.22 0.15 1.13 4.81 0.39 2.10 114.58 124.06 1snx h GLU 474 Ca 0.18 -0.01 -0.30 0.00 -0.13 0.00 0.00 59.36 59.10 1snx h GLU 474 Cb -0.07 -0.05 0.03 0.00 0.63 0.00 0.00 28.75 29.29 1snx h GLU 474 CO -0.04 0.15 -1.30 1.49 -0.73 0.00 0.00 179.01 178.58 1snx h GLU 475 N 0.23 0.52 0.00 1.92 4.81 0.41 -2.08 114.58 120.40 1snx h GLU 475 Ca 0.18 -0.77 0.00 0.00 -0.13 0.00 0.00 59.36 58.64 1snx h GLU 475 Cb 0.20 0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1snx h GLU 475 CO -0.22 1.35 0.00 0.00 -0.73 0.00 0.00 179.01 179.41 1snx n ALA 476 N -2.66 1.76 -3.29 2.92 0.00 1.13 -4.75 120.51 115.63 1snx n ALA 476 Ca -0.13 -0.02 -0.23 0.00 0.00 0.00 0.00 53.44 53.06 1snx n ALA 476 Cb 1.02 -1.05 0.02 0.00 0.00 0.00 0.00 19.45 19.45 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 -1.54 0.07 -0.74 0.00 1.01 0.69 -4.97 120.40 114.91 1snx s VAL 478 Ca 0.25 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.06 1snx s VAL 478 Cb -0.03 -0.09 0.18 0.00 0.00 0.00 0.00 36.38 36.44 1snx s VAL 478 CO 0.66 -0.07 0.56 -0.63 0.00 0.00 0.00 175.10 175.62 1snx s ILE 479 N -0.25 3.61 -0.97 2.22 -1.09 -1.26 -4.25 121.20 119.21 1snx s ILE 479 Ca -0.02 -3.71 -0.25 0.00 -2.23 0.00 0.00 60.65 54.44 1snx s ILE 479 Cb -0.02 -3.32 -0.10 0.00 -1.58 0.00 0.00 42.46 37.45 1snx s ILE 479 CO -0.00 -0.98 2.06 -2.28 -1.23 0.00 0.00 174.94 172.50 1snx s HIS 480 N -0.96 1.63 0.00 3.97 5.65 -1.26 -4.77 115.29 119.55 1snx s HIS 480 Ca 0.23 1.08 -0.02 0.00 0.25 0.00 0.00 55.06 56.60 1snx s HIS 480 Cb -0.12 -3.82 -0.08 0.00 -1.18 0.00 0.00 32.58 27.39 1snx s HIS 480 CO -0.10 -1.44 1.44 0.54 -0.65 0.00 0.00 174.74 174.53 1snx n ARG 481 N 8.63 0.63 0.00 2.88 1.74 -1.26 -3.48 116.66 125.79 1snx n ARG 481 Ca 0.43 -0.29 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 1snx n ARG 481 Cb 0.46 -1.62 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 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 2.70 0.00 -4.72 0.55 2.03 -1.26 -5.13 116.55 110.73 1snx n ASP 482 Ca 0.13 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 55.02 1snx n ASP 482 Cb 0.29 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.66 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 4.38 0.13 -2.67 2.96 -1.23 -4.83 118.68 117.42 1snx s LEU 483 Ca 0.00 2.15 -0.25 0.00 -0.22 0.00 0.00 54.13 55.80 1snx s LEU 483 Cb 0.00 -3.59 0.08 0.00 0.50 0.00 0.00 46.19 43.18 1snx s LEU 483 CO 0.00 -0.50 1.06 0.00 -1.32 0.00 0.00 176.35 175.59 1snx s ALA 484 N 0.86 -1.78 0.46 5.97 0.00 -1.26 -4.64 121.76 121.38 1snx s ALA 484 Ca 0.59 0.05 0.17 0.00 0.00 0.00 0.00 51.96 52.78 1snx s ALA 484 Cb -0.32 0.65 1.15 0.00 0.00 0.00 0.00 23.12 24.59 1snx s ALA 484 CO 0.31 -1.06 1.98 0.00 0.00 0.00 0.00 175.76 176.99 1snx h ALA 485 N 2.00 2.16 -0.36 0.00 0.00 -1.92 -1.50 119.26 119.65 1snx h ALA 485 Ca -0.26 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1snx h ALA 485 Cb 1.22 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1snx h ALA 485 CO 0.30 -0.31 0.00 2.89 0.00 0.00 0.00 179.25 182.13 1snx n ARG 486 N -4.45 3.41 0.00 0.00 1.85 -1.26 0.12 116.66 116.33 1snx n ARG 486 Ca 0.10 -1.96 0.00 0.00 -1.00 0.00 0.00 57.85 54.99 1snx n ARG 486 Cb 0.45 -1.97 0.00 0.00 -1.05 0.00 0.00 32.46 29.89 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 0.40 0.97 -4.91 2.89 3.02 -0.58 -4.94 115.26 112.12 1snx n ASN 487 Ca 0.17 -0.08 -0.27 0.00 -0.03 0.00 0.00 54.58 54.37 1snx n ASN 487 Cb 0.83 0.35 0.01 0.00 -0.61 0.00 0.00 39.78 40.37 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 -4.88 2.28 -0.02 0.00 1.43 -0.09 -1.31 118.68 116.09 1snx s LEU 489 Ca 0.51 -0.61 -0.06 0.00 -1.03 0.00 0.00 54.13 52.94 1snx s LEU 489 Cb -0.10 -0.32 -0.04 0.00 0.03 0.00 0.00 46.19 45.75 1snx s LEU 489 CO 0.46 -0.16 0.23 -0.69 0.23 0.00 0.00 176.35 176.42 1snx s VAL 490 N -1.47 5.35 0.00 -1.59 1.01 0.07 -2.17 120.40 121.60 1snx s VAL 490 Ca -0.05 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.07 1snx s VAL 490 Cb -0.09 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.75 1snx s VAL 490 CO 0.01 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.14 1snx n GLY 491 N 1.28 4.32 1.34 4.51 0.00 -0.06 -1.38 105.19 115.20 1snx n GLY 491 Ca -0.13 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 0.00 0.00 1.61 4.71 -1.26 -4.19 120.64 121.51 1snx n GLU 492 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1snx n GLU 492 Cb 0.00 -1.41 0.00 0.00 -1.01 0.00 0.00 31.44 29.02 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 1.25 0.00 0.00 1.62 6.94 -1.26 -4.78 115.26 119.02 1snx n ASN 493 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 1snx n ASN 493 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 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 0.00 0.00 -1.74 -3.83 1.13 -1.26 -4.88 117.38 106.80 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 -3.51 -0.01 0.00 0.11 0.00 0.00 30.24 26.83 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 -1.06 1.40 -4.22 5.09 0.31 -1.26 -4.78 118.33 113.81 1snx n VAL 495 Ca 0.00 -0.35 -0.30 0.00 -0.01 0.00 0.00 64.34 63.68 1snx n VAL 495 Cb 0.00 -1.87 -0.16 0.00 -0.91 0.00 0.00 33.84 30.90 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 -0.45 1.66 0.01 2.52 -1.09 -1.26 -0.88 121.20 121.71 1snx s ILE 496 Ca 0.60 -0.71 0.04 0.00 -2.23 0.00 0.00 60.65 58.36 1snx s ILE 496 Cb -0.52 -1.53 -0.03 0.00 -1.58 0.00 0.00 42.46 38.80 1snx s ILE 496 CO 0.55 0.47 -0.10 -0.54 -1.23 0.00 0.00 174.94 174.09 1snx s LYS 497 N 1.26 2.43 0.53 2.79 1.02 -0.92 -4.29 119.74 122.55 1snx s LYS 497 Ca 0.01 -0.78 -0.05 0.00 0.02 0.00 0.00 55.97 55.16 1snx s LYS 497 Cb -0.14 -2.41 -0.01 0.00 -0.52 0.00 0.00 37.83 34.75 1snx s LYS 497 CO -0.08 0.59 0.83 0.08 -0.92 0.00 0.00 175.35 175.85 1snx s VAL 498 N -0.96 4.22 0.07 3.17 1.01 0.64 -0.91 120.40 127.65 1snx s VAL 498 Ca 0.16 0.04 -0.08 0.00 0.00 0.00 0.00 61.98 62.09 1snx s VAL 498 Cb -0.11 -3.63 0.03 0.00 0.00 0.00 0.00 36.38 32.67 1snx s VAL 498 CO 0.06 -0.62 0.40 -1.54 0.00 0.00 0.00 175.10 173.41 1snx n SER 499 N -2.40 -0.68 0.00 3.32 3.41 -1.11 -1.08 113.62 115.08 1snx n SER 499 Ca 0.03 -1.36 0.00 0.00 -0.26 0.00 0.00 58.87 57.28 1snx n SER 499 Cb 0.57 1.10 0.00 0.00 -0.26 0.00 0.00 64.21 65.62 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 -0.86 -1.02 -3.47 4.04 8.00 -1.26 -4.67 116.55 117.30 1snx n ASP 500 Ca -0.01 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.49 1snx n ASP 500 Cb 0.23 -1.77 0.00 0.00 -0.02 0.00 0.00 41.12 39.56 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 -2.08 -0.39 0.00 1.24 -0.00 -1.26 -4.99 117.46 109.98 1snx n PHE 501 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1snx n PHE 501 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.55 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 2.63 2.21 0.00 4.97 0.00 -1.26 -5.02 105.19 108.72 1snx n GLY 502 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.09 1.61 -0.02 -1.26 -4.90 135.00 128.35 1snx n PRO 521 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.38 1snx n PRO 521 Cb 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 33.50 33.52 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 1.28 -0.77 -1.45 2.07 -1.99 -3.20 116.25 112.18 1snx h VAL 522 Ca 0.00 -1.51 0.08 0.00 0.82 0.00 0.00 66.70 66.09 1snx h VAL 522 Cb 0.00 1.38 -0.10 0.00 -1.52 0.00 0.00 31.29 31.05 1snx h VAL 522 CO 0.00 0.50 -0.41 0.29 0.02 0.00 0.00 177.57 177.97 1snx n LYS 523 N -4.06 -0.29 -0.16 1.57 5.02 -1.26 0.28 118.16 119.26 1snx n LYS 523 Ca -0.01 1.17 0.03 0.00 -2.02 0.00 0.00 58.31 57.48 1snx n LYS 523 Cb 0.51 -1.73 0.11 0.00 -0.02 0.00 0.00 35.03 33.90 1snx n LYS 523 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1snx n TRP 524 N -5.02 0.39 -3.45 2.13 8.01 -1.23 -4.88 117.44 113.40 1snx n TRP 524 Ca 0.03 -0.17 -0.28 0.00 -1.31 0.00 0.00 57.50 55.78 1snx n TRP 524 Cb 0.23 -0.05 -0.03 0.00 -2.01 0.00 0.00 31.31 29.45 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 -1.66 3.70 0.52 6.99 0.00 0.79 -3.51 121.76 128.58 1snx s ALA 525 Ca 0.16 -0.69 0.05 0.00 0.00 0.00 0.00 51.96 51.48 1snx s ALA 525 Cb 0.09 -2.18 0.04 0.00 0.00 0.00 0.00 23.12 21.07 1snx s ALA 525 CO 0.09 0.26 0.72 -1.54 0.00 0.00 0.00 175.76 175.29 1snx s SER 526 N -3.29 5.32 0.33 0.00 1.04 -1.26 -4.90 113.70 110.94 1snx s SER 526 Ca 0.42 -0.31 0.09 0.00 0.48 0.00 0.00 55.95 56.63 1snx s SER 526 Cb -0.11 -0.56 0.84 0.00 0.10 0.00 0.00 66.02 66.29 1snx s SER 526 CO 0.31 -1.08 1.79 -0.65 0.98 0.00 0.00 173.24 174.58 1snx h PRO 527 N 0.26 0.64 -0.00 4.02 0.11 -1.95 -1.27 132.00 133.81 1snx h PRO 527 Ca -0.39 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1snx h PRO 527 Cb 1.29 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1snx h PRO 527 CO 0.47 0.42 -0.03 -0.85 -0.21 0.00 0.00 178.00 177.80 1snx n GLU 528 N -4.71 0.77 0.02 1.05 -0.00 -1.26 -3.23 120.64 113.28 1snx n GLU 528 Ca 0.23 -0.12 0.11 0.00 -0.00 0.00 0.00 57.16 57.38 1snx n GLU 528 Cb 0.63 -1.50 -0.13 0.00 -0.00 0.00 0.00 31.44 30.45 1snx n GLU 528 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1snx n VAL 529 N -1.00 0.16 0.00 3.84 0.31 -0.49 0.12 118.33 121.27 1snx n VAL 529 Ca 0.18 -0.51 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1snx n VAL 529 Cb 0.21 -0.09 0.00 0.00 -0.91 0.00 0.00 33.84 33.05 1snx n VAL 529 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1snx n PHE 530 N -2.37 0.00 0.08 3.52 0.99 -1.12 -2.25 117.46 116.32 1snx n PHE 530 Ca -0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 57.45 57.41 1snx n PHE 530 Cb 0.57 -0.11 0.27 0.00 -1.00 0.00 0.00 39.48 39.20 1snx n PHE 530 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.76 177.53 1snx h SER 531 N 0.00 0.29 0.00 4.37 0.02 -1.81 -3.37 113.55 113.05 1snx h SER 531 Ca 0.00 -0.10 -0.13 0.00 -0.84 0.00 0.00 61.79 60.73 1snx h SER 531 Cb 0.00 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 1snx h SER 531 CO 0.00 0.58 -1.48 0.49 -1.14 0.00 0.00 176.83 175.28 1snx n PHE 532 N -4.12 0.00 -2.78 3.45 3.01 -1.21 -5.04 117.46 110.76 1snx n PHE 532 Ca -0.01 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.37 1snx n PHE 532 Cb 0.40 -0.32 0.04 0.00 -0.01 0.00 0.00 39.48 39.58 1snx n PHE 532 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1snx n SER 533 N -2.74 -5.83 -3.04 4.37 2.88 0.32 -4.91 113.62 104.67 1snx n SER 533 Ca -0.15 -0.38 -0.25 0.00 -1.33 0.00 0.00 58.87 56.76 1snx n SER 533 Cb 0.66 -4.15 -0.04 0.00 -0.75 0.00 0.00 64.21 59.92 1snx n SER 533 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1snx n ARG 534 N -2.41 2.69 -0.85 -1.46 0.63 0.11 -4.90 116.66 110.46 1snx n ARG 534 Ca -0.04 -4.54 -0.34 0.00 -0.92 0.00 0.00 57.85 52.02 1snx n ARG 534 Cb 0.56 -2.12 0.10 0.00 0.45 0.00 0.00 32.46 31.45 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 0.01 -2.55 -2.64 -0.14 4.02 -1.26 -4.78 117.16 109.82 1snx n TYR 535 Ca 0.30 0.18 -0.03 0.00 -0.01 0.00 0.00 57.90 58.33 1snx n TYR 535 Cb 0.44 -1.61 -0.00 0.00 -0.02 0.00 0.00 39.34 38.15 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 0.46 -1.04 0.00 7.72 3.41 -1.26 -4.91 113.62 118.00 1snx n SER 536 Ca 0.02 -1.62 0.00 0.00 -0.26 0.00 0.00 58.87 57.01 1snx n SER 536 Cb 0.58 0.86 0.00 0.00 -0.26 0.00 0.00 64.21 65.39 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 -0.49 0.00 0.15 4.04 2.88 -1.26 -3.74 113.62 115.19 1snx n SER 537 Ca -0.22 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.37 1snx n SER 537 Cb 0.64 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.15 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 -0.65 -1.46 1.79 -1.94 -2.30 116.57 112.01 1snx h LYS 538 Ca 0.00 0.00 0.13 0.00 -2.18 0.00 0.00 60.65 58.60 1snx h LYS 538 Cb 0.00 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 30.55 1snx h LYS 538 CO 0.00 0.29 0.13 0.66 -1.08 0.00 0.00 179.45 179.45 1snx h SER 539 N 0.00 -0.03 0.06 0.86 4.64 -1.91 -1.55 113.55 115.62 1snx h SER 539 Ca -0.02 0.13 -0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1snx h SER 539 Cb 1.27 0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.54 1snx h SER 539 CO 0.04 -0.02 -0.03 0.44 -0.87 0.00 0.00 176.83 176.39 1snx h ASP 540 N 0.25 -0.07 -0.48 4.97 3.32 -1.86 -2.81 116.42 119.73 1snx h ASP 540 Ca 0.35 -0.51 0.20 0.00 0.02 0.00 0.00 57.03 57.09 1snx h ASP 540 Cb 0.55 0.02 -0.08 0.00 0.22 0.00 0.00 39.33 40.03 1snx h ASP 540 CO -0.45 0.50 0.26 0.52 -1.72 0.00 0.00 179.24 178.35 1snx n VAL 541 N -4.85 -0.19 -0.04 -1.35 0.31 -0.62 0.53 118.33 112.11 1snx n VAL 541 Ca -0.09 0.95 -0.12 0.00 -0.01 0.00 0.00 64.34 65.07 1snx n VAL 541 Cb 0.29 -1.54 -0.11 0.00 -0.91 0.00 0.00 33.84 31.57 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 -0.03 0.00 3.52 2.91 -1.35 -0.63 115.95 120.37 1snx h TRP 542 Ca 0.40 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.42 1snx h TRP 542 Cb 1.07 0.01 0.00 0.00 -0.51 0.00 0.00 29.16 29.73 1snx h TRP 542 CO -0.00 0.70 0.00 0.43 -1.03 0.00 0.00 178.44 178.54 1snx n SER 543 N -4.72 0.00 -0.03 2.65 7.64 2.03 0.18 113.62 121.37 1snx n SER 543 Ca -0.09 0.07 0.05 0.00 1.01 0.00 0.00 58.87 59.92 1snx n SER 543 Cb 0.36 -0.08 -0.14 0.00 -1.01 0.00 0.00 64.21 63.35 1snx n SER 543 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1snx n PHE 544 N -1.08 0.00 0.07 1.43 7.35 1.16 -3.63 117.46 122.76 1snx n PHE 544 Ca 0.00 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.63 1snx n PHE 544 Cb 0.00 -0.51 -0.04 0.00 0.35 0.00 0.00 39.48 39.29 1snx n PHE 544 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 1snx h GLY 545 N 3.29 -0.28 -0.20 7.13 0.00 0.34 -2.42 103.07 110.93 1snx h GLY 545 Ca -0.11 0.10 0.03 0.00 0.00 0.00 0.00 47.33 47.35 1snx h GLY 545 CO 0.01 -0.10 -0.41 -2.08 0.00 0.00 0.00 176.54 173.95 1snx h VAL 546 N -1.04 0.00 -0.55 4.60 2.07 -1.41 0.40 116.25 120.33 1snx h VAL 546 Ca -0.03 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.54 1snx h VAL 546 Cb 0.32 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.02 1snx h VAL 546 CO 0.04 0.00 -0.40 0.25 0.02 0.00 0.00 177.57 177.48 1snx h LEU 547 N -0.37 -1.42 -0.80 2.57 6.46 -1.69 0.98 115.31 121.03 1snx h LEU 547 Ca 0.04 0.21 0.18 0.00 -0.12 0.00 0.00 57.88 58.18 1snx h LEU 547 Cb 0.48 0.61 -0.15 0.00 -0.73 0.00 0.00 40.66 40.87 1snx h LEU 547 CO -0.38 -0.20 -0.14 0.80 -0.62 0.00 0.00 178.44 177.90 1snx n MET 548 N -4.55 -0.07 -0.03 1.25 1.56 0.03 0.27 117.12 115.58 1snx n MET 548 Ca 0.00 1.24 -0.08 0.00 -0.27 0.00 0.00 57.70 58.59 1snx n MET 548 Cb 0.20 -1.88 -0.05 0.00 2.15 0.00 0.00 33.22 33.63 1snx n MET 548 CO 0.00 0.00 0.00 2.35 -0.73 0.00 0.00 175.97 177.59 1snx h TRP 549 N 0.00 -0.90 -1.41 1.12 7.01 0.51 0.66 115.95 122.94 1snx h TRP 549 Ca 0.41 0.04 0.48 0.00 2.11 0.00 0.00 58.89 61.93 1snx h TRP 549 Cb 0.71 0.41 -0.13 0.00 -2.10 0.00 0.00 29.16 28.05 1snx h TRP 549 CO -0.56 -0.29 0.92 0.39 -2.79 0.00 0.00 178.44 176.12 1snx n GLU 550 N -4.13 -0.03 0.15 2.65 1.02 0.75 0.46 120.64 121.50 1snx n GLU 550 Ca -0.03 1.20 -0.06 0.00 -0.02 0.00 0.00 57.16 58.25 1snx n GLU 550 Cb 0.20 -2.41 -0.03 0.00 -0.02 0.00 0.00 31.44 29.18 1snx n GLU 550 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1snx h VAL 551 N 0.00 0.00 -0.95 2.62 2.07 0.11 0.55 116.25 120.65 1snx h VAL 551 Ca 0.86 0.00 0.09 0.00 0.82 0.00 0.00 66.70 68.47 1snx h VAL 551 Cb 2.86 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 32.56 1snx h VAL 551 CO -0.40 0.00 0.59 -0.26 0.02 0.00 0.00 177.57 177.52 1snx h PHE 552 N -0.38 1.08 0.00 1.57 -1.00 0.40 0.53 116.94 119.14 1snx h PHE 552 Ca -0.04 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.77 1snx h PHE 552 Cb 0.29 -0.35 0.00 0.00 3.61 0.00 0.00 35.95 39.50 1snx h PHE 552 CO 0.17 0.49 0.00 0.43 -1.61 0.00 0.00 178.31 177.79 1snx n SER 553 N -4.61 3.33 -0.87 2.17 7.64 0.73 -4.57 113.62 117.44 1snx n SER 553 Ca 0.16 -1.84 -0.00 0.00 1.01 0.00 0.00 58.87 58.19 1snx n SER 553 Cb 0.26 -0.66 -0.00 0.00 -1.01 0.00 0.00 64.21 62.80 1snx n SER 553 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1snx n GLU 554 N 1.20 -1.35 -0.20 1.43 1.02 0.18 -0.97 120.64 121.95 1snx n GLU 554 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1snx n GLU 554 Cb 0.38 -0.80 0.00 0.00 -0.02 0.00 0.00 31.44 31.00 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 -0.09 0.85 2.96 0.62 0.00 0.19 -3.57 105.19 106.14 1snx n GLY 555 Ca 0.00 -0.66 -0.24 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.78 1.43 0.45 1.61 1.02 -0.14 -4.54 119.74 117.78 1snx s LYS 556 Ca 0.00 -0.29 -0.24 0.00 0.02 0.00 0.00 55.97 55.46 1snx s LYS 556 Cb 0.00 -1.31 -0.09 0.00 -0.52 0.00 0.00 37.83 35.91 1snx s LYS 556 CO 0.00 -0.08 1.19 -0.89 -0.92 0.00 0.00 175.35 174.65 1snx n ILE 557 N 4.17 2.75 -3.61 2.17 5.41 -1.26 -4.71 119.36 124.29 1snx n ILE 557 Ca -0.20 -0.50 -0.37 0.00 1.00 0.00 0.00 62.75 62.67 1snx n ILE 557 Cb 0.51 -1.43 -0.06 0.00 -0.71 0.00 0.00 39.64 37.94 1snx n ILE 557 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1snx s PRO 558 N -2.27 3.89 -0.76 0.38 0.04 -1.26 -4.46 135.00 130.56 1snx s PRO 558 Ca 0.64 0.19 -0.03 0.00 0.04 0.00 0.00 61.00 61.83 1snx s PRO 558 Cb -0.50 -3.27 -0.04 0.00 0.04 0.00 0.00 34.50 30.73 1snx s PRO 558 CO 0.56 0.58 0.66 0.66 0.04 0.00 0.00 177.00 179.50 1snx n TYR 559 N 2.37 -1.68 0.00 0.56 4.02 -1.26 -4.97 117.16 116.20 1snx n TYR 559 Ca -0.15 0.62 0.00 0.00 -0.01 0.00 0.00 57.90 58.36 1snx n TYR 559 Cb 0.53 -3.78 0.00 0.00 -0.02 0.00 0.00 39.34 36.07 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 -2.84 0.00 -0.32 -0.72 2.13 -1.26 -4.03 120.64 113.60 1snx n GLU 560 Ca -0.09 0.37 -0.02 0.00 0.66 0.00 0.00 57.16 58.07 1snx n GLU 560 Cb 0.59 -0.93 -0.03 0.00 0.27 0.00 0.00 31.44 31.34 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 -1.60 2.36 -3.84 4.31 3.02 -1.26 -4.71 115.26 113.54 1snx n ASN 561 Ca 0.00 -1.76 -0.12 0.00 -0.03 0.00 0.00 54.58 52.67 1snx n ASN 561 Cb 0.00 -0.56 -0.12 0.00 -0.61 0.00 0.00 39.78 38.49 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 1.55 0.20 0.28 3.52 0.52 -1.26 -5.13 118.95 118.63 1snx s ARG 562 Ca 0.13 0.07 -0.26 0.00 -0.52 0.00 0.00 55.73 55.15 1snx s ARG 562 Cb 0.06 0.09 -0.09 0.00 0.52 0.00 0.00 34.95 35.53 1snx s ARG 562 CO 0.00 -0.03 0.89 0.45 0.02 0.00 0.00 175.30 176.63 1snx s SER 563 N -0.20 7.36 0.29 0.23 0.15 -1.26 -4.80 113.70 115.47 1snx s SER 563 Ca -0.03 1.77 0.05 0.00 0.70 0.00 0.00 55.95 58.44 1snx s SER 563 Cb -0.02 -2.55 0.71 0.00 -1.71 0.00 0.00 66.02 62.45 1snx s SER 563 CO 0.00 0.02 1.76 0.78 1.20 0.00 0.00 173.24 177.00 1snx h ASN 564 N 3.51 0.65 -0.03 5.45 2.35 -1.98 1.34 115.58 126.88 1snx h ASN 564 Ca -0.47 0.11 -0.07 0.00 -0.55 0.00 0.00 56.30 55.32 1snx h ASN 564 Cb 1.19 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.54 1snx h ASN 564 CO 0.66 0.20 -0.09 -1.20 -1.65 0.00 0.00 177.43 175.35 1snx n SER 565 N -4.84 5.37 0.00 5.81 7.64 -1.26 -2.56 113.62 123.78 1snx n SER 565 Ca 0.22 -2.46 0.00 0.00 1.01 0.00 0.00 58.87 57.64 1snx n SER 565 Cb 0.57 -1.21 0.00 0.00 -1.01 0.00 0.00 64.21 62.56 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 1.74 0.00 -0.15 1.43 2.13 0.32 -4.95 120.64 121.16 1snx n GLU 566 Ca 0.14 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.85 1snx n GLU 566 Cb 0.62 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 32.27 1snx n GLU 566 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1snx h VAL 567 N 0.00 0.07 -0.36 6.31 2.07 0.15 -0.37 116.25 124.12 1snx h VAL 567 Ca 0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1snx h VAL 567 Cb 0.00 0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 29.80 1snx h VAL 567 CO 0.00 0.00 -0.21 0.52 0.02 0.00 0.00 177.57 177.90 1snx n VAL 568 N -5.40 -0.25 0.00 2.57 0.31 -1.17 -0.98 118.33 113.41 1snx n VAL 568 Ca -0.01 1.79 0.00 0.00 -0.01 0.00 0.00 64.34 66.11 1snx n VAL 568 Cb 0.35 -2.30 0.00 0.00 -0.91 0.00 0.00 33.84 30.98 1snx n VAL 568 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1snx n GLU 569 N -3.81 0.00 -0.20 5.55 2.13 -0.65 0.29 120.64 123.95 1snx n GLU 569 Ca 0.01 0.70 0.03 0.00 0.66 0.00 0.00 57.16 58.56 1snx n GLU 569 Cb 0.09 -1.27 0.08 0.00 0.27 0.00 0.00 31.44 30.62 1snx n GLU 569 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1snx n ASP 570 N -1.96 -0.20 0.10 4.31 8.00 -0.24 0.18 116.55 126.74 1snx n ASP 570 Ca 0.00 0.96 -0.17 0.00 0.71 0.00 0.00 54.79 56.28 1snx n ASP 570 Cb 0.00 -0.29 -0.12 0.00 -0.02 0.00 0.00 41.12 40.70 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 1.42 -0.63 0.53 2.04 0.71 0.19 117.51 121.77 1snx h ILE 571 Ca 0.27 -2.78 0.05 0.00 1.00 0.00 0.00 64.86 63.39 1snx h ILE 571 Cb 0.41 2.79 -0.05 0.00 -0.74 0.00 0.00 36.82 39.23 1snx h ILE 571 CO -0.57 0.82 0.36 0.28 0.00 0.00 0.00 178.15 179.04 1snx h SER 572 N 0.15 0.55 -0.71 1.72 0.02 1.52 0.35 113.55 117.15 1snx h SER 572 Ca -0.14 0.02 0.06 0.00 -0.84 0.00 0.00 61.79 60.89 1snx h SER 572 Cb 1.89 -0.09 -0.06 0.00 0.14 0.00 0.00 62.40 64.28 1snx h SER 572 CO 0.21 0.37 0.41 0.71 -1.14 0.00 0.00 176.83 177.39 1snx h THR 573 N 0.69 0.98 0.00 -2.27 1.35 -0.69 -3.45 112.91 109.51 1snx h THR 573 Ca 0.27 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.87 1snx h THR 573 Cb 0.12 0.17 0.00 0.00 -1.73 0.00 0.00 68.15 66.70 1snx h THR 573 CO -0.15 0.14 0.00 0.61 -0.25 0.00 0.00 175.52 175.87 1snx n GLY 574 N -1.30 -0.85 3.72 5.82 0.00 0.11 -5.13 105.19 107.57 1snx n GLY 574 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 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 3.39 0.17 1.61 5.36 0.67 -4.94 117.98 124.24 1snx s PHE 575 Ca 0.00 1.26 0.07 0.00 -0.96 0.00 0.00 56.93 57.31 1snx s PHE 575 Cb 0.00 -3.48 -0.04 0.00 -0.34 0.00 0.00 43.02 39.15 1snx s PHE 575 CO 0.00 -1.51 -0.15 1.03 -1.46 0.00 0.00 175.22 173.13 1snx s ARG 576 N 0.65 1.24 0.26 10.12 1.81 -1.26 -3.99 118.95 127.78 1snx s ARG 576 Ca 0.58 -1.46 -0.31 0.00 -1.72 0.00 0.00 55.73 52.83 1snx s ARG 576 Cb -0.32 -1.12 -0.13 0.00 -0.45 0.00 0.00 34.95 32.93 1snx s ARG 576 CO 0.32 0.20 1.49 1.28 -0.68 0.00 0.00 175.30 177.91 1snx n LEU 577 N 0.02 3.63 -4.19 2.53 4.77 -1.26 -4.94 117.00 117.56 1snx n LEU 577 Ca -0.11 1.14 -0.35 0.00 -0.03 0.00 0.00 56.01 56.67 1snx n LEU 577 Cb 0.59 -1.50 0.11 0.00 -2.33 0.00 0.00 43.42 40.29 1snx n LEU 577 CO 0.31 -0.22 -0.99 0.00 -1.33 0.00 0.00 177.39 175.16 1snx n TYR 578 N 2.02 -1.77 -2.80 -1.77 0.18 -1.26 -4.83 117.16 106.92 1snx n TYR 578 Ca 0.10 0.28 -0.42 0.00 1.88 0.00 0.00 57.90 59.74 1snx n TYR 578 Cb 0.34 -1.53 -0.03 0.00 -0.38 0.00 0.00 39.34 37.73 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 -2.94 4.24 0.33 -3.48 2.20 -1.26 -5.00 119.74 113.83 1snx s LYS 579 Ca 0.49 1.12 -0.29 0.00 -0.36 0.00 0.00 55.97 56.93 1snx s LYS 579 Cb -0.08 -3.63 -0.10 0.00 -1.51 0.00 0.00 37.83 32.51 1snx s LYS 579 CO 0.68 -0.52 1.32 -1.25 -0.36 0.00 0.00 175.35 175.22 1snx s PRO 580 N 2.83 4.34 0.29 4.03 0.04 -1.26 -4.88 135.00 140.39 1snx s PRO 580 Ca 0.39 2.24 -0.04 0.00 0.04 0.00 0.00 61.00 63.63 1snx s PRO 580 Cb -0.15 -3.07 0.58 0.00 0.04 0.00 0.00 34.50 31.90 1snx s PRO 580 CO 0.08 -0.22 1.57 0.07 0.04 0.00 0.00 177.00 178.54 1snx h ARG 581 N 3.42 0.00 0.00 4.56 0.11 -1.94 1.81 114.38 122.35 1snx h ARG 581 Ca -0.49 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.59 1snx h ARG 581 Cb 1.23 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.31 1snx h ARG 581 CO 0.66 0.00 0.00 -0.07 0.10 0.00 0.00 179.97 180.66 1snx h LEU 582 N 0.01 0.00-10.03 0.08 3.38 -1.91 -3.44 115.31 103.39 1snx h LEU 582 Ca 0.52 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.95 1snx h LEU 582 Cb 0.93 0.00 0.12 0.00 0.09 0.00 0.00 40.66 41.81 1snx h LEU 582 CO -0.97 0.00 0.60 0.00 0.09 0.00 0.00 178.44 178.17 1snx s ALA 583 N -3.15 2.90 0.36 1.53 0.00 0.62 -4.98 121.76 119.03 1snx s ALA 583 Ca 0.09 1.30 0.07 0.00 0.00 0.00 0.00 51.96 53.42 1snx s ALA 583 Cb 0.11 -3.55 -0.01 0.00 0.00 0.00 0.00 23.12 19.67 1snx s ALA 583 CO 0.58 -1.25 0.42 -1.12 0.00 0.00 0.00 175.76 174.39 1snx s SER 584 N -0.94 5.60 0.17 0.00 0.01 -1.26 -4.81 113.70 112.47 1snx s SER 584 Ca 0.69 -0.38 -0.14 0.00 1.31 0.00 0.00 55.95 57.43 1snx s SER 584 Cb -0.39 -0.99 0.06 0.00 0.21 0.00 0.00 66.02 64.90 1snx s SER 584 CO 0.47 -0.48 1.80 0.71 0.41 0.00 0.00 173.24 176.15 1snx h THR 585 N 0.99 1.16 0.00 1.44 1.35 -1.94 2.65 112.91 118.56 1snx h THR 585 Ca -0.44 -0.36 -0.14 0.00 -0.55 0.00 0.00 66.41 64.91 1snx h THR 585 Cb 1.26 0.46 -0.02 0.00 -1.73 0.00 0.00 68.15 68.12 1snx h THR 585 CO 0.54 0.16 -0.72 0.45 -0.25 0.00 0.00 175.52 175.70 1snx h HIS 586 N 0.70 0.00 0.12 4.73 3.86 -1.95 -2.81 115.15 119.80 1snx h HIS 586 Ca 0.19 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.39 1snx h HIS 586 Cb -0.01 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1snx h HIS 586 CO -0.03 0.66 -0.06 0.28 0.86 0.00 0.00 177.93 179.65 1snx h VAL 587 N 0.00 0.77 0.00 2.45 2.07 -1.82 -2.96 116.25 116.76 1snx h VAL 587 Ca -0.02 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.22 1snx h VAL 587 Cb 1.52 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 32.65 1snx h VAL 587 CO 0.08 0.22 0.11 0.00 0.02 0.00 0.00 177.57 178.01 1snx n TYR 588 N -4.85 0.01 0.08 1.57 9.36 0.89 -0.98 117.16 123.23 1snx n TYR 588 Ca -0.06 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 61.06 1snx n TYR 588 Cb 0.24 -0.39 -0.07 0.00 -0.63 0.00 0.00 39.34 38.49 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 -0.27 0.24 2.98 4.20 -1.32 -3.30 115.11 117.63 1snx h GLN 589 Ca 0.00 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1snx h GLN 589 Cb 0.23 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.03 1snx h GLN 589 CO 0.00 0.08 -0.52 0.82 -0.67 0.00 0.00 178.83 178.55 1snx h ILE 590 N -0.93 0.01 -0.56 2.54 2.04 -1.08 -2.10 117.51 117.42 1snx h ILE 590 Ca -0.03 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.02 1snx h ILE 590 Cb 0.49 0.01 -0.10 0.00 -0.74 0.00 0.00 36.82 36.47 1snx h ILE 590 CO 0.05 0.00 0.12 0.23 0.00 0.00 0.00 178.15 178.55 1snx n MET 591 N -5.51 -0.04 0.16 2.37 2.81 -1.14 0.48 117.12 116.24 1snx n MET 591 Ca -0.10 0.82 0.03 0.00 -1.81 0.00 0.00 57.70 56.64 1snx n MET 591 Cb 0.43 -1.36 0.22 0.00 -0.71 0.00 0.00 33.22 31.80 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 -0.75 7.83 2.35 -1.46 -0.90 115.58 122.65 1snx h ASN 592 Ca 0.39 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.09 1snx h ASN 592 Cb 0.92 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.26 1snx h ASN 592 CO -0.49 0.50 0.24 0.45 -1.65 0.00 0.00 177.43 176.47 1snx h HIS 593 N 0.00 1.20 0.00 1.19 3.86 1.09 0.53 115.15 123.02 1snx h HIS 593 Ca -0.00 -0.12 -0.02 0.00 -1.16 0.00 0.00 60.37 59.07 1snx h HIS 593 Cb 1.08 -0.35 -0.00 0.00 1.06 0.00 0.00 27.41 29.20 1snx h HIS 593 CO 0.00 0.94 -0.09 0.00 0.86 0.00 0.00 177.93 179.64 1snx n TRP 595 N -3.20 1.16 -2.02 0.00 8.01 0.50 -3.90 117.44 117.99 1snx n TRP 595 Ca 0.01 -0.54 -0.42 0.00 -1.31 0.00 0.00 57.50 55.24 1snx n TRP 595 Cb 0.39 -0.08 -0.03 0.00 -2.01 0.00 0.00 31.31 29.58 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 -1.29 4.19 0.60 -0.99 -0.14 0.16 -4.85 119.74 117.42 1snx s LYS 596 Ca 0.50 2.18 0.30 0.00 -1.36 0.00 0.00 55.97 57.59 1snx s LYS 596 Cb 0.28 -3.90 1.67 0.00 -1.68 0.00 0.00 37.83 34.21 1snx s LYS 596 CO 0.30 -0.81 2.07 0.93 -0.76 0.00 0.00 175.35 177.09 1snx h GLU 597 N 9.22 0.00 -5.12 1.68 5.08 -1.91 -3.39 114.58 120.14 1snx h GLU 597 Ca -0.39 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.34 1snx h GLU 597 Cb 1.18 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.28 1snx h GLU 597 CO 0.95 0.00 -0.29 1.03 -1.00 0.00 0.00 179.01 179.70 1snx s ARG 598 N -4.56 4.01 0.00 2.33 0.52 -1.26 -4.76 118.95 115.23 1snx s ARG 598 Ca -0.04 -0.02 0.00 0.00 -0.52 0.00 0.00 55.73 55.14 1snx s ARG 598 Cb 0.15 -3.65 0.00 0.00 0.52 0.00 0.00 34.95 31.97 1snx s ARG 598 CO 0.52 -0.24 0.69 -2.30 0.02 0.00 0.00 175.30 173.98 1snx n PRO 599 N 5.23 0.00 0.00 3.54 -0.02 -1.26 -2.55 135.00 139.94 1snx n PRO 599 Ca -0.10 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1snx n PRO 599 Cb 0.51 -1.19 0.00 0.00 -0.02 0.00 0.00 33.50 32.80 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 -1.36 0.00 -0.22 -0.52 0.00 -1.26 0.67 120.64 117.95 1snx n GLU 600 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.25 1snx n GLU 600 Cb 0.00 0.00 0.25 0.00 0.00 0.00 0.00 31.44 31.69 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 -3.12 2.68 -4.77 -1.84 5.75 -1.06 -4.80 116.55 109.39 1snx n ASP 601 Ca 0.00 -1.95 -0.38 0.00 -0.01 0.00 0.00 54.79 52.46 1snx n ASP 601 Cb 0.00 -0.29 -0.06 0.00 -1.03 0.00 0.00 41.12 39.74 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 -1.42 4.16 0.94 0.11 0.52 3.12 -4.93 118.95 121.45 1snx s ARG 602 Ca 0.35 0.39 -0.15 0.00 -0.52 0.00 0.00 55.73 55.80 1snx s ARG 602 Cb 0.19 -3.35 0.23 0.00 0.52 0.00 0.00 34.95 32.54 1snx s ARG 602 CO 0.25 0.39 0.51 -2.30 0.02 0.00 0.00 175.30 174.18 1snx n PRO 603 N 2.88 -2.95 -5.04 3.54 -0.02 -1.26 -4.99 135.00 127.17 1snx n PRO 603 Ca -0.11 -0.86 -0.29 0.00 -2.02 0.00 0.00 63.50 60.22 1snx n PRO 603 Cb 0.52 -1.27 -0.16 0.00 -0.02 0.00 0.00 33.50 32.57 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 -2.06 1.85 0.18 3.55 0.00 -1.26 -4.92 121.76 119.10 1snx s ALA 604 Ca 0.40 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.53 1snx s ALA 604 Cb -0.07 -0.63 0.46 0.00 0.00 0.00 0.00 23.12 22.89 1snx s ALA 604 CO 0.33 0.31 0.90 1.19 0.00 0.00 0.00 175.76 178.50 1snx n PHE 605 N 3.20 0.39 -0.08 0.00 3.01 -1.26 0.00 117.46 122.72 1snx n PHE 605 Ca -0.18 0.69 -0.11 0.00 1.01 0.00 0.00 57.45 58.86 1snx n PHE 605 Cb 0.52 -0.95 -0.07 0.00 -0.01 0.00 0.00 39.48 38.98 1snx n PHE 605 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1snx h SER 606 N 0.00 -1.37 -0.71 4.37 4.64 -1.91 -0.53 113.55 118.04 1snx h SER 606 Ca 0.36 0.18 0.02 0.00 -0.47 0.00 0.00 61.79 61.88 1snx h SER 606 Cb 0.76 0.56 -0.04 0.00 -0.31 0.00 0.00 62.40 63.37 1snx h SER 606 CO -0.53 -0.31 0.47 -0.09 -0.87 0.00 0.00 176.83 175.49 1snx h ARG 607 N -0.33 0.87 -1.00 4.77 2.43 -0.84 -2.36 114.38 117.93 1snx h ARG 607 Ca 0.05 -0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.21 1snx h ARG 607 Cb 0.46 -0.20 -0.06 0.00 -0.42 0.00 0.00 29.97 29.75 1snx h ARG 607 CO -0.42 0.58 0.65 -0.07 -1.51 0.00 0.00 179.97 179.20 1snx h LEU 608 N 0.90 1.08 -0.91 3.80 3.38 -0.95 0.52 115.31 123.13 1snx h LEU 608 Ca 0.27 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.15 1snx h LEU 608 Cb -0.01 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1snx h LEU 608 CO -0.07 0.73 -0.10 0.25 0.09 0.00 0.00 178.44 179.34 1snx h LEU 609 N 1.25 0.67 0.94 1.67 5.85 -0.60 0.91 115.31 126.00 1snx h LEU 609 Ca 0.40 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.89 1snx h LEU 609 Cb 0.03 -0.18 0.01 0.00 0.37 0.00 0.00 40.66 40.89 1snx h LEU 609 CO -0.13 0.80 -0.47 0.03 -0.34 0.00 0.00 178.44 178.33 1snx h ARG 610 N 0.62 -1.24 -0.15 1.25 -0.00 -0.66 -0.81 114.38 113.40 1snx h ARG 610 Ca 0.11 0.08 0.03 0.00 -0.50 0.00 0.00 59.98 59.70 1snx h ARG 610 Cb 0.54 0.28 -0.05 0.00 0.00 0.00 0.00 29.97 30.75 1snx h ARG 610 CO 0.03 -0.83 -0.40 1.96 0.00 0.00 0.00 179.97 180.73 1snx h GLN 611 N -1.29 -0.38 -0.64 0.04 4.20 0.52 -0.71 115.11 116.84 1snx h GLN 611 Ca -0.13 0.03 0.11 0.00 0.06 0.00 0.00 58.65 58.72 1snx h GLN 611 Cb 1.00 0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.83 1snx h GLN 611 CO 0.20 -0.25 0.43 -0.07 -0.67 0.00 0.00 178.83 178.46 1snx h LEU 612 N -0.40 0.37 -0.75 1.46 3.38 0.78 1.19 115.31 121.34 1snx h LEU 612 Ca 0.03 0.01 0.12 0.00 0.09 0.00 0.00 57.88 58.13 1snx h LEU 612 Cb 0.49 -0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.09 1snx h LEU 612 CO -0.35 0.21 0.34 0.00 0.09 0.00 0.00 178.44 178.74 1snx h ALA 613 N 1.68 1.06 -2.64 1.53 0.00 0.33 -2.10 119.26 119.13 1snx h ALA 613 Ca 0.30 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1snx h ALA 613 Cb 0.62 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1snx h ALA 613 CO -0.08 -0.12 0.00 0.39 0.00 0.00 0.00 179.25 179.43 1snx n GLU 614 N -4.92 0.00 -0.33 0.00 1.02 0.41 -3.44 120.64 113.38 1snx n GLU 614 Ca 0.13 0.25 0.24 0.00 -0.02 0.00 0.00 57.16 57.77 1snx n GLU 614 Cb 0.36 -1.06 0.46 0.00 -0.02 0.00 0.00 31.44 31.18 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 0.11 -0.02 -3.67 2.04 -1.37 0.44 117.51 115.03 1snx h ILE 615 Ca 0.00 -0.03 0.01 0.00 1.00 0.00 0.00 64.86 65.83 1snx h ILE 615 Cb 0.00 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1snx h ILE 615 CO 0.00 0.02 0.06 0.00 0.00 0.00 0.00 178.15 178.22 1snx h ALA 616 N 1.94 1.26 -2.64 1.87 0.00 -1.40 -3.35 119.26 116.93 1snx h ALA 616 Ca 0.74 -0.00 -0.77 0.00 0.00 0.00 0.00 54.91 54.88 1snx h ALA 616 Cb 1.77 0.00 -0.24 0.00 0.00 0.00 0.00 17.79 19.32 1snx h ALA 616 CO -0.75 -0.07 0.25 -1.21 0.00 0.00 0.00 179.25 177.47 1snx s GLU 617 N -4.33 3.61 0.00 0.00 2.02 0.16 -4.86 118.70 115.30 1snx s GLU 617 Ca -0.05 -2.33 0.00 0.00 0.02 0.00 0.00 54.97 52.61 1snx s GLU 617 Cb 0.13 -4.53 0.00 0.00 0.10 0.00 0.00 34.13 29.83 1snx s GLU 617 CO 0.45 -1.39 0.00 0.45 0.02 0.00 0.00 175.26 174.79 1snx n SER 618 N 4.48 0.00 0.00 -0.19 2.88 -1.26 -5.00 113.62 114.53 1snx n SER 618 Ca 0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 1snx n SER 618 Cb 0.47 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.93 1snx n SER 618 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42