#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3naf s TYR 332 N 0.00 3.06 0.13 2.13 2.02 -1.26 -5.07 117.35 118.35 3naf s TYR 332 Ca 0.00 -2.82 -0.03 0.00 -0.37 0.00 0.00 57.07 53.85 3naf s TYR 332 Cb 0.00 -2.59 0.01 0.00 -0.40 0.00 0.00 41.96 38.98 3naf s TYR 332 CO 0.00 -0.85 0.22 0.41 -1.57 0.00 0.00 175.55 173.76 3naf n GLY 333 N 3.84 2.15 0.35 0.71 0.00 -1.26 -2.69 105.19 108.28 3naf n GLY 333 Ca 0.04 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.81 3naf n GLY 333 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3naf n GLY 334 N -0.19 -3.58 3.16 -0.02 0.00 -1.26 -4.60 105.19 98.71 3naf n GLY 334 Ca -0.02 -0.91 -0.31 0.00 0.00 0.00 0.00 46.02 44.79 3naf n GLY 334 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3naf n SER 335 N -0.45 1.64 0.08 1.61 3.41 -1.26 -4.54 113.62 114.11 3naf n SER 335 Ca 0.00 -2.40 0.03 0.00 -0.26 0.00 0.00 58.87 56.24 3naf n SER 335 Cb 0.00 -0.72 -0.03 0.00 -0.26 0.00 0.00 64.21 63.19 3naf n SER 335 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 3naf h TYR 336 N 8.53 0.00 -2.83 7.33 3.20 -1.81 -3.44 116.97 127.95 3naf h TYR 336 Ca 0.27 0.00 -0.54 0.00 3.14 0.00 0.00 58.73 61.59 3naf h TYR 336 Cb 0.45 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.72 3naf h TYR 336 CO 1.44 0.44 0.90 0.45 -1.64 0.00 0.00 178.16 179.75 3naf s SER 337 N -5.90 6.77 -0.00 -2.11 0.15 -1.26 -4.99 113.70 106.36 3naf s SER 337 Ca -0.00 2.21 0.08 0.00 0.70 0.00 0.00 55.95 58.93 3naf s SER 337 Cb 0.08 -2.56 -0.02 0.00 -1.71 0.00 0.00 66.02 61.81 3naf s SER 337 CO 0.79 -0.78 -0.25 0.00 1.20 0.00 0.00 173.24 174.20 3naf s ALA 338 N 2.63 2.09 0.38 5.45 0.00 -1.26 -4.73 121.76 126.32 3naf s ALA 338 Ca 0.67 -1.11 -0.26 0.00 0.00 0.00 0.00 51.96 51.26 3naf s ALA 338 Cb -0.33 -0.50 -0.11 0.00 0.00 0.00 0.00 23.12 22.17 3naf s ALA 338 CO 0.28 0.51 1.15 1.33 0.00 0.00 0.00 175.76 179.02 3naf n VAL 339 N 2.28 2.31 -2.50 0.00 0.24 -1.26 -4.98 118.33 114.42 3naf n VAL 339 Ca -0.16 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.64 3naf n VAL 339 Cb 0.52 -1.35 0.00 0.00 -1.47 0.00 0.00 33.84 31.54 3naf n VAL 339 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3naf n SER 340 N 0.58 0.00 -0.05 -1.34 7.64 -1.26 -5.01 113.62 114.19 3naf n SER 340 Ca 0.07 -0.39 0.15 0.00 1.01 0.00 0.00 58.87 59.71 3naf n SER 340 Cb 0.37 0.00 0.71 0.00 -1.01 0.00 0.00 64.21 64.28 3naf n SER 340 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3naf n GLY 341 N 0.00 -1.13 3.91 0.23 0.00 -1.26 -4.85 105.19 102.09 3naf n GLY 341 Ca 0.00 -0.20 -0.25 0.00 0.00 0.00 0.00 46.02 45.58 3naf n GLY 341 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3naf s ARG 342 N -2.50 3.29 0.21 1.61 0.52 -1.26 -5.12 118.95 115.70 3naf s ARG 342 Ca 0.30 -0.73 0.03 0.00 -0.52 0.00 0.00 55.73 54.81 3naf s ARG 342 Cb 0.20 -2.85 -0.03 0.00 0.52 0.00 0.00 34.95 32.79 3naf s ARG 342 CO 0.46 0.48 0.36 0.15 0.02 0.00 0.00 175.30 176.78 3naf s LYS 343 N -3.43 3.46 -0.03 3.54 1.02 -1.19 -5.04 119.74 118.08 3naf s LYS 343 Ca 0.34 -0.58 -0.10 0.00 0.02 0.00 0.00 55.97 55.65 3naf s LYS 343 Cb -0.10 -2.88 0.02 0.00 -0.52 0.00 0.00 37.83 34.34 3naf s LYS 343 CO 0.27 0.43 0.23 -3.38 -0.92 0.00 0.00 175.35 171.98 3naf s HIS 344 N -1.91 -0.12 -0.04 3.18 -3.43 -1.26 -2.01 115.29 109.71 3naf s HIS 344 Ca 0.36 0.22 0.06 0.00 -0.80 0.00 0.00 55.06 54.90 3naf s HIS 344 Cb -0.10 0.04 -0.01 0.00 -1.43 0.00 0.00 32.58 31.08 3naf s HIS 344 CO 0.30 -0.28 -0.22 0.96 -2.00 0.00 0.00 174.74 173.50 3naf s ILE 345 N -0.95 1.78 0.41 -5.38 -4.36 -0.98 0.26 121.20 111.98 3naf s ILE 345 Ca -0.10 -0.93 -0.15 0.00 -0.26 0.00 0.00 60.65 59.20 3naf s ILE 345 Cb -0.05 -1.49 -0.08 0.00 1.25 0.00 0.00 42.46 42.08 3naf s ILE 345 CO 0.02 0.50 0.85 -0.69 0.24 0.00 0.00 174.94 175.86 3naf s VAL 346 N -0.28 4.62 -0.32 8.37 1.01 -0.97 -1.42 120.40 131.41 3naf s VAL 346 Ca 0.02 1.03 -0.00 0.00 0.00 0.00 0.00 61.98 63.03 3naf s VAL 346 Cb -0.11 -3.67 0.10 0.00 0.00 0.00 0.00 36.38 32.70 3naf s VAL 346 CO 0.01 -0.43 0.10 -0.69 0.00 0.00 0.00 175.10 174.09 3naf s VAL 347 N -2.29 1.07 0.00 2.92 1.01 0.06 -1.83 120.40 121.35 3naf s VAL 347 Ca 0.56 -1.58 0.00 0.00 0.00 0.00 0.00 61.98 60.96 3naf s VAL 347 Cb -0.10 -1.81 0.00 0.00 0.00 0.00 0.00 36.38 34.47 3naf s VAL 347 CO 0.24 -0.68 0.00 0.00 0.00 0.00 0.00 175.10 174.66 3naf n GLY 349 N 5.00 1.56 3.34 0.00 0.00 -1.26 -2.58 105.19 111.25 3naf n GLY 349 Ca 0.00 -0.78 -0.45 0.00 0.00 0.00 0.00 46.02 44.79 3naf n GLY 349 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3naf s HIS 350 N 0.00 3.21 -0.48 1.61 5.65 -1.00 -4.92 115.29 119.37 3naf s HIS 350 Ca 0.00 -1.12 -0.12 0.00 0.25 0.00 0.00 55.06 54.07 3naf s HIS 350 Cb 0.00 -3.65 0.11 0.00 -1.18 0.00 0.00 32.58 27.85 3naf s HIS 350 CO 0.00 -1.00 0.37 0.42 -0.65 0.00 0.00 174.74 173.88 3naf s ILE 351 N 1.80 4.60 0.17 0.89 -1.09 -1.26 -4.73 121.20 121.58 3naf s ILE 351 Ca 0.05 -1.53 -0.02 0.00 -2.23 0.00 0.00 60.65 56.92 3naf s ILE 351 Cb -0.27 -3.92 -0.04 0.00 -1.58 0.00 0.00 42.46 36.65 3naf s ILE 351 CO 0.05 -0.71 0.12 -0.89 -1.23 0.00 0.00 174.94 172.28 3naf s THR 352 N 1.47 0.05 0.27 2.92 2.01 -1.26 -4.98 115.64 116.12 3naf s THR 352 Ca 0.04 -1.90 -0.00 0.00 0.31 0.00 0.00 61.69 60.13 3naf s THR 352 Cb -0.26 -2.26 0.25 0.00 0.01 0.00 0.00 72.50 70.24 3naf s THR 352 CO 0.02 -0.21 1.71 0.17 -0.69 0.00 0.00 174.62 175.62 3naf h LEU 353 N 2.70 0.29 0.00 4.42 8.10 -1.96 0.21 115.31 129.07 3naf h LEU 353 Ca -0.35 0.13 -0.10 0.00 0.11 0.00 0.00 57.88 57.67 3naf h LEU 353 Cb 1.23 0.11 -0.02 0.00 -0.44 0.00 0.00 40.66 41.54 3naf h LEU 353 CO 0.55 0.05 -1.26 -1.84 -4.11 0.00 0.00 178.44 171.83 3naf n GLU 354 N -5.03 0.61 0.00 0.17 0.00 -1.26 -1.39 120.64 113.76 3naf n GLU 354 Ca 0.18 0.18 0.10 0.00 0.00 0.00 0.00 57.16 57.63 3naf n GLU 354 Cb 0.53 -1.82 0.46 0.00 0.00 0.00 0.00 31.44 30.61 3naf n GLU 354 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 3naf n SER 355 N -2.80 0.03 -0.06 -1.84 7.64 -0.48 -3.28 113.62 112.83 3naf n SER 355 Ca -0.06 0.50 -0.09 0.00 1.01 0.00 0.00 58.87 60.23 3naf n SER 355 Cb 0.73 -0.51 -0.05 0.00 -1.01 0.00 0.00 64.21 63.37 3naf n SER 355 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3naf n VAL 356 N -1.53 0.64 0.18 0.44 0.31 0.61 -4.58 118.33 114.40 3naf n VAL 356 Ca 0.05 -0.22 -0.12 0.00 -0.01 0.00 0.00 64.34 64.05 3naf n VAL 356 Cb 0.25 -1.14 -0.06 0.00 -0.91 0.00 0.00 33.84 31.98 3naf n VAL 356 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 3naf h SER 357 N -0.14 -0.91 -0.99 4.52 4.64 -1.28 0.28 113.55 119.67 3naf h SER 357 Ca -0.26 0.08 0.25 0.00 -0.47 0.00 0.00 61.79 61.38 3naf h SER 357 Cb 1.34 0.30 -0.07 0.00 -0.31 0.00 0.00 62.40 63.67 3naf h SER 357 CO -0.08 -0.42 0.66 0.78 -0.87 0.00 0.00 176.83 176.89 3naf h ASN 358 N -0.63 0.33 0.18 4.97 2.35 -1.82 0.89 115.58 121.85 3naf h ASN 358 Ca -0.04 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 3naf h ASN 358 Cb 0.56 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.92 3naf h ASN 358 CO -0.06 0.09 -0.08 0.15 -1.65 0.00 0.00 177.43 175.88 3naf h PHE 359 N 0.31 -0.22 -0.39 1.19 3.57 -1.69 -3.31 116.94 116.40 3naf h PHE 359 Ca 0.53 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 62.09 3naf h PHE 359 Cb 1.50 0.07 -0.06 0.00 2.79 0.00 0.00 35.95 40.24 3naf h PHE 359 CO -0.00 -0.14 0.00 -0.07 -2.23 0.00 0.00 178.31 175.87 3naf h LEU 360 N -0.78 -0.16 -1.48 0.59 3.38 -0.05 0.28 115.31 117.08 3naf h LEU 360 Ca -0.02 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3naf h LEU 360 Cb 0.18 0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3naf h LEU 360 CO 0.04 -0.04 0.22 0.11 0.09 0.00 0.00 178.44 178.85 3naf h LYS 361 N 0.11 0.00 0.00 1.13 1.57 -1.01 -0.24 116.57 118.13 3naf h LYS 361 Ca 0.19 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.71 3naf h LYS 361 Cb 0.27 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.53 3naf h LYS 361 CO -0.32 0.00 -1.99 -3.47 -0.57 0.00 0.00 179.45 173.10 3naf n ASP 362 N -2.41 2.29 0.07 0.86 2.03 0.24 -4.13 116.55 115.51 3naf n ASP 362 Ca -0.01 -0.07 -0.10 0.00 0.52 0.00 0.00 54.79 55.13 3naf n ASP 362 Cb 0.25 0.07 0.01 0.00 -0.72 0.00 0.00 41.12 40.73 3naf n ASP 362 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 3naf h PHE 363 N 0.00 0.44 -1.23 -0.67 3.57 0.33 -3.23 116.94 116.16 3naf h PHE 363 Ca -0.39 -0.22 -0.60 0.00 3.53 0.00 0.00 57.97 60.29 3naf h PHE 363 Cb 1.69 -0.06 -0.40 0.00 2.79 0.00 0.00 35.95 39.97 3naf h PHE 363 CO 0.01 1.00 -0.45 1.47 -2.23 0.00 0.00 178.31 178.11 3naf n LEU 364 N -3.75 5.32 -4.76 0.59 -0.00 -0.19 -5.07 117.00 109.15 3naf n LEU 364 Ca -0.04 -4.93 -0.39 0.00 -0.00 0.00 0.00 56.01 50.66 3naf n LEU 364 Cb 0.76 -0.52 0.02 0.00 -0.00 0.00 0.00 43.42 43.68 3naf n LEU 364 CO 0.48 2.08 0.96 -2.28 -0.00 0.00 0.00 177.39 178.63 3naf s HIS 365 N -3.64 2.55 0.08 1.47 2.46 -1.22 -4.91 115.29 112.08 3naf s HIS 365 Ca 0.51 1.39 -0.27 0.00 0.47 0.00 0.00 55.06 57.17 3naf s HIS 365 Cb 0.42 -3.71 -0.16 0.00 -0.13 0.00 0.00 32.58 29.00 3naf s HIS 365 CO -0.11 -2.45 1.70 1.57 -2.47 0.00 0.00 174.74 172.98 3naf h LYS 366 N 2.00 -0.32 -1.38 2.88 2.10 -1.94 -2.68 116.57 117.23 3naf h LYS 366 Ca -0.50 0.02 -0.09 0.00 -2.00 0.00 0.00 60.65 58.07 3naf h LYS 366 Cb 1.27 0.07 -0.05 0.00 -0.90 0.00 0.00 32.23 32.63 3naf h LYS 366 CO 0.60 -0.21 0.12 -3.47 -2.00 0.00 0.00 179.45 174.49 3naf n ASP 367 N -5.23 4.30 -4.66 7.07 2.03 -1.26 -4.85 116.55 113.94 3naf n ASP 367 Ca -0.09 -2.43 -0.35 0.00 0.52 0.00 0.00 54.79 52.45 3naf n ASP 367 Cb 0.15 -0.80 -0.09 0.00 -0.72 0.00 0.00 41.12 39.66 3naf n ASP 367 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 3naf s ARG 368 N -0.57 3.94 0.29 -0.67 3.52 -1.01 -5.03 118.95 119.42 3naf s ARG 368 Ca 0.10 -0.32 -0.27 0.00 -0.13 0.00 0.00 55.73 55.11 3naf s ARG 368 Cb 0.08 -3.22 -0.15 0.00 -1.56 0.00 0.00 34.95 30.10 3naf s ARG 368 CO 0.01 0.32 0.72 -0.40 -0.81 0.00 0.00 175.30 175.14 3naf n ASP 369 N 3.38 -0.14 -4.59 -2.12 5.75 -1.26 -4.72 116.55 112.85 3naf n ASP 369 Ca -0.17 1.09 -0.46 0.00 -0.01 0.00 0.00 54.79 55.24 3naf n ASP 369 Cb 0.52 -1.13 -0.04 0.00 -1.03 0.00 0.00 41.12 39.44 3naf n ASP 369 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 3naf n ASP 370 N 1.51 3.16 -4.04 -1.12 5.68 -1.26 -4.97 116.55 115.51 3naf n ASP 370 Ca 0.13 0.53 -0.16 0.00 -0.50 0.00 0.00 54.79 54.79 3naf n ASP 370 Cb 0.32 -1.44 -0.13 0.00 -1.14 0.00 0.00 41.12 38.73 3naf n ASP 370 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3naf s VAL 371 N 6.57 0.63 -0.89 2.12 0.11 -1.26 -5.10 120.40 122.58 3naf s VAL 371 Ca 0.99 -0.71 0.00 0.00 -2.93 0.00 0.00 61.98 59.34 3naf s VAL 371 Cb -0.56 -0.60 0.29 0.00 -1.53 0.00 0.00 36.38 33.98 3naf s VAL 371 CO 0.43 -0.08 1.23 -3.20 -3.33 0.00 0.00 175.10 170.16 3naf n ASN 372 N 2.19 5.48 -4.21 3.54 2.85 -1.26 -5.01 115.26 118.84 3naf n ASN 372 Ca -0.17 -3.47 -0.28 0.00 -0.11 0.00 0.00 54.58 50.55 3naf n ASN 372 Cb 0.56 -1.01 -0.16 0.00 1.24 0.00 0.00 39.78 40.41 3naf n ASN 372 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 3naf s VAL 373 N -2.93 1.65 -0.09 3.44 1.01 -1.26 -3.15 120.40 119.07 3naf s VAL 373 Ca 0.36 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.46 3naf s VAL 373 Cb 0.11 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 3naf s VAL 373 CO 0.03 0.47 -0.09 -1.61 0.00 0.00 0.00 175.10 173.90 3naf s GLU 374 N -0.33 3.01 -0.46 2.72 2.02 -0.85 -5.00 118.70 119.81 3naf s GLU 374 Ca 0.04 -0.59 -0.21 0.00 0.02 0.00 0.00 54.97 54.23 3naf s GLU 374 Cb -0.10 -2.62 0.03 0.00 0.10 0.00 0.00 34.13 31.54 3naf s GLU 374 CO 0.00 0.49 0.66 0.42 0.02 0.00 0.00 175.26 176.86 3naf s ILE 375 N -0.34 4.80 -0.46 -1.63 1.01 -0.23 -2.33 121.20 122.02 3naf s ILE 375 Ca 0.04 -0.02 -0.13 0.00 0.00 0.00 0.00 60.65 60.54 3naf s ILE 375 Cb -0.12 -4.26 0.08 0.00 0.01 0.00 0.00 42.46 38.17 3naf s ILE 375 CO 0.02 -0.69 0.35 -0.69 0.00 0.00 0.00 174.94 173.93 3naf s VAL 376 N 2.87 4.81 0.72 2.92 1.01 -0.51 -1.73 120.40 130.49 3naf s VAL 376 Ca 0.21 -1.25 -0.11 0.00 0.00 0.00 0.00 61.98 60.84 3naf s VAL 376 Cb -0.15 -3.92 0.02 0.00 0.00 0.00 0.00 36.38 32.33 3naf s VAL 376 CO 0.17 -0.58 1.09 -0.36 0.00 0.00 0.00 175.10 175.42 3naf s PHE 377 N 1.55 3.23 -0.29 5.22 0.40 -0.28 -0.76 117.98 127.05 3naf s PHE 377 Ca 0.04 1.13 0.04 0.00 -0.60 0.00 0.00 56.93 57.53 3naf s PHE 377 Cb -0.24 -3.03 0.18 0.00 0.51 0.00 0.00 43.02 40.45 3naf s PHE 377 CO 0.04 -1.26 0.53 -1.17 0.70 0.00 0.00 175.22 174.06 3naf s LEU 378 N -5.45 -1.30 0.06 -0.37 2.96 -1.14 -2.97 118.68 110.48 3naf s LEU 378 Ca 0.58 0.10 0.04 0.00 -0.22 0.00 0.00 54.13 54.63 3naf s LEU 378 Cb -0.12 1.72 -0.03 0.00 0.50 0.00 0.00 46.19 48.26 3naf s LEU 378 CO 0.53 -0.31 -0.11 -2.28 -1.32 0.00 0.00 176.35 172.86 3naf s HIS 379 N 2.73 0.94 0.05 5.38 2.46 -1.17 -4.56 115.29 121.13 3naf s HIS 379 Ca 0.11 -0.51 -0.30 0.00 0.47 0.00 0.00 55.06 54.84 3naf s HIS 379 Cb -0.12 -0.54 -0.18 0.00 -0.13 0.00 0.00 32.58 31.62 3naf s HIS 379 CO -0.26 -0.02 1.48 -0.97 -2.47 0.00 0.00 174.74 172.50 3naf h ASN 380 N 4.28 -0.64 -3.30 9.88 -1.24 -1.63 -2.32 115.58 120.61 3naf h ASN 380 Ca -0.38 -0.02 -0.57 0.00 0.71 0.00 0.00 56.30 56.04 3naf h ASN 380 Cb 1.20 0.17 -0.05 0.00 0.73 0.00 0.00 38.32 40.36 3naf h ASN 380 CO 0.42 -0.38 -0.02 -0.63 -1.29 0.00 0.00 177.43 175.54 3naf s ILE 381 N -5.58 4.89 0.54 2.57 1.01 -1.26 -4.61 121.20 118.76 3naf s ILE 381 Ca -0.16 1.24 -0.21 0.00 0.00 0.00 0.00 60.65 61.52 3naf s ILE 381 Cb 0.03 -3.93 -0.06 0.00 0.01 0.00 0.00 42.46 38.52 3naf s ILE 381 CO 0.58 0.43 1.22 -0.24 0.00 0.00 0.00 174.94 176.93 3naf n SER 382 N 2.62 2.03 -4.70 3.58 2.88 -1.26 -4.91 113.62 113.85 3naf n SER 382 Ca -0.07 0.94 -0.42 0.00 -1.33 0.00 0.00 58.87 57.99 3naf n SER 382 Cb 0.51 -1.50 -0.03 0.00 -0.75 0.00 0.00 64.21 62.44 3naf n SER 382 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 3naf s PRO 383 N -2.74 4.26 0.98 -1.46 0.04 -1.26 -4.99 135.00 129.82 3naf s PRO 383 Ca 0.72 2.15 -0.11 0.00 0.04 0.00 0.00 61.00 63.80 3naf s PRO 383 Cb -0.44 -3.43 0.16 0.00 0.04 0.00 0.00 34.50 30.83 3naf s PRO 383 CO 0.50 -0.58 0.98 0.27 0.04 0.00 0.00 177.00 178.21 3naf n ASN 384 N 4.85 -0.46 -0.32 6.66 0.23 -1.26 -4.64 115.26 120.32 3naf n ASN 384 Ca 0.13 0.29 0.17 0.00 -0.53 0.00 0.00 54.58 54.64 3naf n ASN 384 Cb 0.42 -1.39 0.41 0.00 -2.08 0.00 0.00 39.78 37.14 3naf n ASN 384 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 3naf h LEU 385 N -2.01 0.63 0.65 -4.53 3.38 -2.01 -2.23 115.31 109.19 3naf h LEU 385 Ca -0.47 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.55 3naf h LEU 385 Cb 1.29 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 42.02 3naf h LEU 385 CO 0.41 0.20 -0.31 -0.33 0.09 0.00 0.00 178.44 178.51 3naf h GLU 386 N 0.60 -0.84 -0.53 1.13 4.39 -2.03 -3.18 114.58 114.12 3naf h GLU 386 Ca 0.56 0.06 -0.02 0.00 0.34 0.00 0.00 59.36 60.30 3naf h GLU 386 Cb 1.10 0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 29.92 3naf h GLU 386 CO -0.32 -0.54 0.25 1.25 -1.16 0.00 0.00 179.01 178.48 3naf h LEU 387 N -0.93 0.67 -1.74 1.33 5.85 -1.76 -2.24 115.31 116.49 3naf h LEU 387 Ca -0.09 -0.06 0.21 0.00 0.84 0.00 0.00 57.88 58.78 3naf h LEU 387 Cb 0.69 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.50 3naf h LEU 387 CO 0.15 0.57 0.58 -0.33 -0.34 0.00 0.00 178.44 179.07 3naf h GLU 388 N 0.74 0.21 -0.11 1.25 5.08 -1.41 0.56 114.58 120.91 3naf h GLU 388 Ca 0.19 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3naf h GLU 388 Cb 0.09 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 3naf h GLU 388 CO -0.02 0.14 0.05 0.00 -1.00 0.00 0.00 179.01 178.18 3naf h ALA 389 N 1.61 0.14 0.40 3.43 0.00 -1.46 -1.36 119.26 122.01 3naf h ALA 389 Ca 0.42 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 3naf h ALA 389 Cb 1.31 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 3naf h ALA 389 CO -0.09 -0.31 -0.46 1.25 0.00 0.00 0.00 179.25 179.63 3naf h LEU 390 N 0.06 -1.28 -0.37 0.00 6.46 -1.01 -0.82 115.31 118.35 3naf h LEU 390 Ca 0.04 0.11 0.07 0.00 -0.12 0.00 0.00 57.88 57.98 3naf h LEU 390 Cb 0.11 0.43 -0.09 0.00 -0.73 0.00 0.00 40.66 40.38 3naf h LEU 390 CO -0.01 -0.60 -0.35 -0.26 -0.62 0.00 0.00 178.44 176.61 3naf h PHE 391 N -0.89 -0.97 -0.72 1.25 0.04 -1.38 0.19 116.94 114.47 3naf h PHE 391 Ca -0.04 0.06 0.15 0.00 2.80 0.00 0.00 57.97 60.93 3naf h PHE 391 Cb 0.80 0.48 -0.05 0.00 2.20 0.00 0.00 35.95 39.38 3naf h PHE 391 CO -0.27 -0.40 0.48 -0.22 -0.60 0.00 0.00 178.31 177.31 3naf h LYS 392 N -0.29 0.35 0.00 1.51 3.64 -1.09 -0.86 116.57 119.84 3naf h LYS 392 Ca 0.16 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.44 3naf h LYS 392 Cb 0.55 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 3naf h LYS 392 CO -0.52 0.23 -0.38 -0.09 -2.27 0.00 0.00 179.45 176.42 3naf h ARG 393 N 0.36 0.00 -0.80 1.90 2.43 0.87 -3.13 114.38 116.01 3naf h ARG 393 Ca 0.35 0.00 -0.55 0.00 -0.81 0.00 0.00 59.98 58.97 3naf h ARG 393 Cb 0.85 0.00 -0.33 0.00 -0.42 0.00 0.00 29.97 30.07 3naf h ARG 393 CO -0.10 0.38 0.00 0.72 -1.51 0.00 0.00 179.97 179.46 3naf n HIS 394 N -3.61 2.73 -0.20 2.20 8.25 -0.34 -4.90 115.22 119.36 3naf n HIS 394 Ca -0.01 -2.45 -0.10 0.00 -0.26 0.00 0.00 57.72 54.90 3naf n HIS 394 Cb 0.50 -0.83 -0.08 0.00 1.12 0.00 0.00 29.99 30.70 3naf n HIS 394 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 3naf h PHE 395 N 1.91 -1.44 0.00 4.41 3.04 -1.48 0.83 116.94 124.21 3naf h PHE 395 Ca 0.45 0.08 0.00 0.00 3.98 0.00 0.00 57.97 62.49 3naf h PHE 395 Cb 1.31 0.69 0.00 0.00 2.56 0.00 0.00 35.95 40.51 3naf h PHE 395 CO 1.14 -0.36 0.16 1.79 -2.02 0.00 0.00 178.31 179.01 3naf h THR 396 N -0.20 0.00 0.00 4.41 1.35 -1.91 -3.02 112.91 113.54 3naf h THR 396 Ca 0.08 0.00 -0.44 0.00 -0.55 0.00 0.00 66.41 65.51 3naf h THR 396 Cb 0.42 0.73 -0.07 0.00 -1.73 0.00 0.00 68.15 67.50 3naf h THR 396 CO -0.58 0.00 -2.52 0.00 -0.25 0.00 0.00 175.52 172.16 3naf n GLN 397 N -2.79 0.61 -4.26 4.72 1.13 0.18 -4.98 117.38 111.99 3naf n GLN 397 Ca -0.02 0.22 -0.28 0.00 -1.94 0.00 0.00 57.00 54.98 3naf n GLN 397 Cb 0.21 -1.50 -0.09 0.00 0.11 0.00 0.00 30.24 28.97 3naf n GLN 397 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 3naf s VAL 398 N -2.51 3.31 -0.08 5.09 -7.23 -0.55 -1.07 120.40 117.35 3naf s VAL 398 Ca -0.37 -1.51 -0.04 0.00 -1.81 0.00 0.00 61.98 58.25 3naf s VAL 398 Cb 0.13 -2.61 0.04 0.00 0.56 0.00 0.00 36.38 34.49 3naf s VAL 398 CO 0.53 -0.04 0.19 -1.61 -0.31 0.00 0.00 175.10 173.86 3naf s GLU 399 N -2.64 0.15 -0.20 4.82 2.02 -0.71 -4.68 118.70 117.47 3naf s GLU 399 Ca 0.24 0.40 -0.05 0.00 0.02 0.00 0.00 54.97 55.58 3naf s GLU 399 Cb -0.10 -0.11 -0.02 0.00 0.10 0.00 0.00 34.13 34.00 3naf s GLU 399 CO 0.15 -0.14 -0.00 0.12 0.02 0.00 0.00 175.26 175.41 3naf s PHE 400 N 0.99 3.04 -0.15 1.61 2.19 -1.26 -1.13 117.98 123.27 3naf s PHE 400 Ca -0.07 -0.46 0.00 0.00 0.33 0.00 0.00 56.93 56.72 3naf s PHE 400 Cb -0.09 -2.08 -0.01 0.00 -1.31 0.00 0.00 43.02 39.54 3naf s PHE 400 CO -0.06 -0.24 -0.14 0.71 1.83 0.00 0.00 175.22 177.32 3naf s TYR 401 N 0.98 2.79 -0.67 10.12 4.12 -1.16 -4.76 117.35 128.78 3naf s TYR 401 Ca 0.01 -0.93 -0.26 0.00 0.02 0.00 0.00 57.07 55.92 3naf s TYR 401 Cb -0.14 -1.88 0.04 0.00 -1.52 0.00 0.00 41.96 38.46 3naf s TYR 401 CO 0.02 -0.41 1.13 -1.14 0.02 0.00 0.00 175.55 175.17 3naf s GLN 402 N 0.71 3.23 0.00 -0.62 0.74 -1.10 -3.03 119.66 119.59 3naf s GLN 402 Ca -0.07 -0.34 0.00 0.00 0.05 0.00 0.00 55.36 55.00 3naf s GLN 402 Cb -0.15 -4.15 0.00 0.00 1.10 0.00 0.00 33.01 29.80 3naf s GLN 402 CO 0.02 -1.90 0.00 0.41 -0.55 0.00 0.00 175.29 173.27 3naf n GLY 403 N 5.28 3.50 3.22 2.59 0.00 -0.87 -4.84 105.19 114.07 3naf n GLY 403 Ca 0.02 -0.47 -0.10 0.00 0.00 0.00 0.00 46.02 45.46 3naf n GLY 403 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3naf s SER 404 N 1.95 0.19 0.00 1.61 1.04 -1.26 -1.55 113.70 115.68 3naf s SER 404 Ca 0.00 -1.20 0.22 0.00 0.48 0.00 0.00 55.95 55.46 3naf s SER 404 Cb 0.00 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.49 3naf s SER 404 CO 0.00 -0.82 1.04 0.52 0.98 0.00 0.00 173.24 174.97 3naf n VAL 405 N -0.19 0.02 1.06 5.02 0.31 -1.26 -4.16 118.33 119.13 3naf n VAL 405 Ca -0.03 -0.05 0.11 0.00 -0.01 0.00 0.00 64.34 64.37 3naf n VAL 405 Cb 0.64 0.66 0.09 0.00 -0.91 0.00 0.00 33.84 34.32 3naf n VAL 405 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3naf n LEU 406 N -1.58 1.40 -4.34 7.52 4.77 -1.26 -4.47 117.00 119.04 3naf n LEU 406 Ca 0.04 -0.50 -0.38 0.00 -0.03 0.00 0.00 56.01 55.14 3naf n LEU 406 Cb 0.35 -0.06 -0.12 0.00 -2.33 0.00 0.00 43.42 41.26 3naf n LEU 406 CO 0.41 0.28 -0.26 0.21 -1.33 0.00 0.00 177.39 176.70 3naf s ASN 407 N -2.66 5.24 0.24 -1.43 3.84 -1.26 -5.01 114.94 113.90 3naf s ASN 407 Ca 0.17 -0.82 -0.05 0.00 0.21 0.00 0.00 52.86 52.36 3naf s ASN 407 Cb 0.18 -1.90 0.44 0.00 -0.55 0.00 0.00 41.25 39.43 3naf s ASN 407 CO 0.64 -0.24 1.70 -0.65 -2.79 0.00 0.00 177.10 175.76 3naf h PRO 408 N 8.25 0.29 -1.01 0.43 0.11 -1.90 -0.91 132.00 137.26 3naf h PRO 408 Ca -0.29 -0.02 0.24 0.00 0.11 0.00 0.00 66.00 66.05 3naf h PRO 408 Cb 1.12 -0.07 -0.09 0.00 0.11 0.00 0.00 31.00 32.07 3naf h PRO 408 CO 0.61 0.19 0.65 1.25 -0.21 0.00 0.00 178.00 180.49 3naf h HIS 409 N 0.30 0.69 0.14 0.65 -0.00 -1.95 -0.12 115.15 114.87 3naf h HIS 409 Ca 0.40 0.02 -0.29 0.00 -0.00 0.00 0.00 60.37 60.51 3naf h HIS 409 Cb 0.67 -0.20 0.02 0.00 -0.00 0.00 0.00 27.41 27.89 3naf h HIS 409 CO -0.24 0.10 -1.26 -0.44 -0.00 0.00 0.00 177.93 176.09 3naf h ASP 410 N 0.45 0.61 0.14 3.26 3.32 -1.44 -2.69 116.42 120.07 3naf h ASP 410 Ca 0.57 -0.62 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 3naf h ASP 410 Cb 1.37 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 3naf h ASP 410 CO -0.29 1.46 -0.09 -0.07 -1.72 0.00 0.00 179.24 178.54 3naf h LEU 411 N 0.14 -0.22 -1.38 1.55 3.38 -0.87 -1.54 115.31 116.37 3naf h LEU 411 Ca -0.17 0.01 0.07 0.00 0.09 0.00 0.00 57.88 57.89 3naf h LEU 411 Cb 1.96 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 42.73 3naf h LEU 411 CO 0.22 -0.15 0.48 0.00 0.09 0.00 0.00 178.44 179.09 3naf h ALA 412 N 0.63 1.72 0.00 1.53 0.00 -1.20 -1.20 119.26 120.74 3naf h ALA 412 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3naf h ALA 412 Cb 0.19 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3naf h ALA 412 CO 0.01 0.15 0.00 0.07 0.00 0.00 0.00 179.25 179.48 3naf h ARG 413 N 0.74 0.00 -0.27 0.00 0.11 -1.10 -1.70 114.38 112.16 3naf h ARG 413 Ca 0.32 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.40 3naf h ARG 413 Cb 0.31 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.39 3naf h ARG 413 CO -0.11 0.00 0.00 0.28 0.10 0.00 0.00 179.97 180.24 3naf n VAL 414 N -2.55 0.35 -3.41 0.08 0.31 -0.53 -3.97 118.33 108.61 3naf n VAL 414 Ca 0.05 -0.55 -0.17 0.00 -0.01 0.00 0.00 64.34 63.66 3naf n VAL 414 Cb 0.45 0.73 0.03 0.00 -0.91 0.00 0.00 33.84 34.13 3naf n VAL 414 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3naf n LYS 415 N 0.96 -1.48 0.08 5.55 4.76 -0.64 -4.93 118.16 122.47 3naf n LYS 415 Ca 0.18 0.94 -0.14 0.00 -2.87 0.00 0.00 58.31 56.41 3naf n LYS 415 Cb 0.48 -4.67 -0.08 0.00 -1.84 0.00 0.00 35.03 28.93 3naf n LYS 415 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 3naf h ILE 416 N -0.66 1.44 0.00 -0.18 2.04 -1.76 -3.11 117.51 115.29 3naf h ILE 416 Ca -0.42 -2.68 0.00 0.00 1.00 0.00 0.00 64.86 62.77 3naf h ILE 416 Cb 1.23 2.62 0.00 0.00 -0.74 0.00 0.00 36.82 39.94 3naf h ILE 416 CO 0.39 0.79 0.01 -0.62 0.00 0.00 0.00 178.15 178.72 3naf n GLU 417 N -3.67 0.00 0.00 2.37 4.71 -1.26 -1.53 120.64 121.26 3naf n GLU 417 Ca -0.07 0.22 0.00 0.00 -0.01 0.00 0.00 57.16 57.29 3naf n GLU 417 Cb 0.91 -1.51 0.00 0.00 -1.01 0.00 0.00 31.44 29.83 3naf n GLU 417 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 3naf n SER 418 N -1.21 0.51 -4.82 1.62 7.64 -1.18 -5.07 113.62 111.12 3naf n SER 418 Ca 0.00 -0.78 -0.33 0.00 1.01 0.00 0.00 58.87 58.78 3naf n SER 418 Cb 0.01 0.31 -0.03 0.00 -1.01 0.00 0.00 64.21 63.49 3naf n SER 418 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3naf s ALA 419 N -0.31 2.94 -0.14 -0.43 0.00 -0.58 -4.68 121.76 118.56 3naf s ALA 419 Ca 0.00 0.34 0.18 0.00 0.00 0.00 0.00 51.96 52.48 3naf s ALA 419 Cb 0.00 -3.18 0.31 0.00 0.00 0.00 0.00 23.12 20.26 3naf s ALA 419 CO 0.00 -0.36 1.56 0.22 0.00 0.00 0.00 175.76 177.18 3naf h ASP 420 N 1.02 0.00 -4.99 0.00 -0.00 -0.52 -3.46 116.42 108.47 3naf h ASP 420 Ca -0.48 0.00 0.26 0.00 -0.00 0.00 0.00 57.03 56.82 3naf h ASP 420 Cb 1.20 0.00 -0.15 0.00 -0.00 0.00 0.00 39.33 40.38 3naf h ASP 420 CO 0.60 0.35 0.76 0.00 -0.00 0.00 0.00 179.24 180.95 3naf s ALA 421 N -3.17 -2.08 -0.14 -0.78 0.00 -1.26 -4.49 121.76 109.85 3naf s ALA 421 Ca 0.04 1.05 -0.00 0.00 0.00 0.00 0.00 51.96 53.05 3naf s ALA 421 Cb 0.08 0.19 0.03 0.00 0.00 0.00 0.00 23.12 23.41 3naf s ALA 421 CO 0.71 -0.83 -0.10 0.00 0.00 0.00 0.00 175.76 175.54 3naf s LEU 423 N 1.60 3.97 -0.59 0.00 1.43 -0.76 -1.81 118.68 122.52 3naf s LEU 423 Ca 0.04 -0.02 -0.12 0.00 -1.03 0.00 0.00 54.13 53.00 3naf s LEU 423 Cb -0.13 -2.10 0.15 0.00 0.03 0.00 0.00 46.19 44.14 3naf s LEU 423 CO -0.09 -0.04 0.50 -0.63 0.23 0.00 0.00 176.35 176.32 3naf s ILE 424 N 1.70 4.77 0.70 -0.59 1.01 -0.62 -1.15 121.20 127.02 3naf s ILE 424 Ca 0.07 -1.98 -0.13 0.00 0.00 0.00 0.00 60.65 58.61 3naf s ILE 424 Cb -0.16 -4.06 0.02 0.00 0.01 0.00 0.00 42.46 38.27 3naf s ILE 424 CO 0.10 -0.87 1.09 -0.76 0.00 0.00 0.00 174.94 174.50 3naf s LEU 425 N 1.01 3.23 0.18 2.97 1.43 -1.07 -1.82 118.68 124.61 3naf s LEU 425 Ca 0.09 1.86 0.02 0.00 -1.03 0.00 0.00 54.13 55.07 3naf s LEU 425 Cb -0.23 -4.53 -0.05 0.00 0.03 0.00 0.00 46.19 41.41 3naf s LEU 425 CO -0.02 -1.71 -0.00 0.00 0.23 0.00 0.00 176.35 174.85 3naf s ALA 426 N -2.66 1.43 -0.81 4.21 0.00 -1.26 -2.36 121.76 120.30 3naf s ALA 426 Ca 0.63 -1.62 -0.25 0.00 0.00 0.00 0.00 51.96 50.72 3naf s ALA 426 Cb -0.18 0.53 -0.00 0.00 0.00 0.00 0.00 23.12 23.47 3naf s ALA 426 CO 0.48 -0.30 1.66 1.21 0.00 0.00 0.00 175.76 178.81 3naf s ASN 427 N -3.19 5.70 0.27 0.00 3.84 -1.26 -4.73 114.94 115.57 3naf s ASN 427 Ca 0.25 -0.50 -0.00 0.00 0.21 0.00 0.00 52.86 52.81 3naf s ASN 427 Cb 0.06 -2.55 0.62 0.00 -0.55 0.00 0.00 41.25 38.83 3naf s ASN 427 CO 0.05 -2.17 1.67 0.11 -2.79 0.00 0.00 177.10 173.97 3naf h LYS 428 N 11.74 0.26 -3.05 0.43 6.56 -1.99 -3.24 116.57 127.28 3naf h LYS 428 Ca -0.07 -0.02 -0.62 0.00 -1.06 0.00 0.00 60.65 58.89 3naf h LYS 428 Cb 1.06 -0.06 -0.41 0.00 -0.57 0.00 0.00 32.23 32.25 3naf h LYS 428 CO 1.28 0.17 -0.66 1.52 -2.06 0.00 0.00 179.45 179.70 3naf s TYR 429 N -5.97 2.92 0.47 -1.35 -0.85 -1.26 -5.08 117.35 106.24 3naf s TYR 429 Ca -0.12 -3.03 0.03 0.00 -0.52 0.00 0.00 57.07 53.43 3naf s TYR 429 Cb 0.24 -2.38 -0.04 0.00 0.38 0.00 0.00 41.96 40.16 3naf s TYR 429 CO 0.77 -0.66 0.01 0.00 -1.52 0.00 0.00 175.55 174.15 3naf h ALA 431 N 1.53 -0.40 -3.00 0.00 0.00 -1.95 -3.41 119.26 112.02 3naf h ALA 431 Ca -0.44 -0.18 -0.69 0.00 0.00 0.00 0.00 54.91 53.60 3naf h ALA 431 Cb 1.29 0.16 -0.36 0.00 0.00 0.00 0.00 17.79 18.87 3naf h ALA 431 CO 0.76 -0.45 -0.25 0.34 0.00 0.00 0.00 179.25 179.64 3naf s ASP 432 N -5.16 5.56 0.19 0.00 -1.08 -1.26 -4.48 116.67 110.44 3naf s ASP 432 Ca -0.12 -3.41 -0.13 0.00 -0.52 0.00 0.00 52.55 48.38 3naf s ASP 432 Cb 0.01 -1.86 0.22 0.00 -1.46 0.00 0.00 42.92 39.83 3naf s ASP 432 CO 0.41 -0.24 1.69 -0.65 0.52 0.00 0.00 175.17 176.90 3naf h PRO 433 N 6.33 0.16 0.00 4.34 0.11 -1.97 0.91 132.00 141.87 3naf h PRO 433 Ca 0.09 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.19 3naf h PRO 433 Cb 0.86 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.93 3naf h PRO 433 CO 0.78 0.10 0.06 -0.44 -0.21 0.00 0.00 178.00 178.29 3naf h ASP 434 N 0.16 0.00 0.06 -2.05 3.32 -1.99 -0.05 116.42 115.88 3naf h ASP 434 Ca 0.27 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.94 3naf h ASP 434 Cb 0.40 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.89 3naf h ASP 434 CO -0.40 0.00 -2.30 0.00 -1.72 0.00 0.00 179.24 174.81 3naf n ALA 435 N -1.90 1.31 0.25 3.45 0.00 0.17 -3.45 120.51 120.35 3naf n ALA 435 Ca -0.02 -0.99 0.10 0.00 0.00 0.00 0.00 53.44 52.53 3naf n ALA 435 Cb 0.10 -0.30 0.67 0.00 0.00 0.00 0.00 19.45 19.93 3naf n ALA 435 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3naf h GLU 436 N 0.02 0.00 0.04 0.00 4.22 -0.15 -1.08 114.58 117.63 3naf h GLU 436 Ca -0.52 0.00 -0.23 0.00 0.08 0.00 0.00 59.36 58.69 3naf h GLU 436 Cb 1.99 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.22 3naf h GLU 436 CO -0.02 0.12 -1.05 -0.44 -2.18 0.00 0.00 179.01 175.44 3naf h ASP 437 N 0.00 0.15 -0.45 1.04 3.45 -1.21 -2.92 116.42 116.48 3naf h ASP 437 Ca -0.00 -0.16 -0.03 0.00 0.43 0.00 0.00 57.03 57.28 3naf h ASP 437 Cb 0.26 -0.05 -0.02 0.00 -0.56 0.00 0.00 39.33 38.96 3naf h ASP 437 CO 0.02 1.10 0.21 0.00 -1.57 0.00 0.00 179.24 178.99 3naf h ALA 438 N 0.88 1.42 0.70 3.45 0.00 -1.27 -2.21 119.26 122.24 3naf h ALA 438 Ca -0.05 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 3naf h ALA 438 Cb 1.79 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 19.38 3naf h ALA 438 CO 0.15 0.44 -0.34 0.77 0.00 0.00 0.00 179.25 180.28 3naf h SER 439 N 0.71 -0.80 -0.66 0.00 0.02 -1.20 0.88 113.55 112.50 3naf h SER 439 Ca 0.17 0.03 0.13 0.00 -0.84 0.00 0.00 61.79 61.28 3naf h SER 439 Cb 0.13 0.21 -0.10 0.00 0.14 0.00 0.00 62.40 62.78 3naf h SER 439 CO -0.02 -0.42 0.12 0.78 -1.14 0.00 0.00 176.83 176.15 3naf h ASN 440 N -1.24 -0.05 -0.58 3.07 2.35 -1.54 0.13 115.58 117.72 3naf h ASN 440 Ca -0.10 0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 3naf h ASN 440 Cb 0.72 0.20 -0.03 0.00 0.05 0.00 0.00 38.32 39.26 3naf h ASN 440 CO 0.16 -0.03 0.33 0.40 -1.65 0.00 0.00 177.43 176.63 3naf h ILE 441 N 0.23 1.18 -0.51 2.81 2.04 -1.40 0.97 117.51 122.83 3naf h ILE 441 Ca 0.35 -0.44 0.07 0.00 1.00 0.00 0.00 64.86 65.85 3naf h ILE 441 Cb 0.57 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 3naf h ILE 441 CO -0.47 0.19 0.34 -0.03 0.00 0.00 0.00 178.15 178.18 3naf h MET 442 N 0.78 0.38 0.06 2.37 4.05 0.82 -1.62 114.93 121.77 3naf h MET 442 Ca 0.21 -0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.60 3naf h MET 442 Cb 0.02 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 30.73 3naf h MET 442 CO -0.04 0.25 -0.03 0.00 0.23 0.00 0.00 176.91 177.33 3naf h ARG 443 N 0.39 -0.08 -1.06 0.39 3.08 0.60 -2.92 114.38 114.78 3naf h ARG 443 Ca 0.23 0.01 0.28 0.00 0.07 0.00 0.00 59.98 60.57 3naf h ARG 443 Cb 0.39 0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.38 3naf h ARG 443 CO -0.06 0.38 0.71 0.28 -1.07 0.00 0.00 179.97 180.21 3naf h VAL 444 N -0.58 0.50 -0.12 2.04 2.07 -0.12 -1.72 116.25 118.33 3naf h VAL 444 Ca -0.01 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.34 3naf h VAL 444 Cb 0.50 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 3naf h VAL 444 CO 0.01 0.05 -0.20 0.40 0.02 0.00 0.00 177.57 177.85 3naf h ILE 445 N 0.28 1.38 -0.42 4.57 2.04 -1.20 -1.90 117.51 122.25 3naf h ILE 445 Ca 0.58 -1.46 0.04 0.00 1.00 0.00 0.00 64.86 65.01 3naf h ILE 445 Cb 1.68 2.05 -0.04 0.00 -0.74 0.00 0.00 36.82 39.78 3naf h ILE 445 CO -0.22 0.43 0.20 -1.28 0.00 0.00 0.00 178.15 177.28 3naf h SER 446 N -0.08 0.27 0.55 1.72 0.87 -1.14 -1.52 113.55 114.22 3naf h SER 446 Ca 0.01 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 3naf h SER 446 Cb 0.78 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.71 3naf h SER 446 CO 0.05 0.20 -0.45 0.40 -0.53 0.00 0.00 176.83 176.49 3naf h ILE 447 N 0.40 0.10 -0.62 2.23 2.04 -1.39 -2.03 117.51 118.23 3naf h ILE 447 Ca 0.19 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.15 3naf h ILE 447 Cb 0.12 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.25 3naf h ILE 447 CO -0.15 0.00 0.42 0.11 0.00 0.00 0.00 178.15 178.53 3naf h LYS 448 N -0.99 0.38 0.00 2.37 1.79 -1.15 0.38 116.57 119.35 3naf h LYS 448 Ca -0.06 -0.02 -0.12 0.00 -2.18 0.00 0.00 60.65 58.26 3naf h LYS 448 Cb 0.84 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 31.39 3naf h LYS 448 CO -0.01 0.25 -0.59 -0.97 -1.08 0.00 0.00 179.45 177.05 3naf h ASN 449 N 0.39 0.00 0.20 0.86 -0.73 -0.98 -1.76 115.58 113.56 3naf h ASN 449 Ca 0.29 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.45 3naf h ASN 449 Cb 0.61 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.20 3naf h ASN 449 CO -0.08 0.59 -0.10 0.22 -0.37 0.00 0.00 177.43 177.70 3naf h TYR 450 N 0.00 -0.25 -2.67 0.67 3.20 -0.25 -3.43 116.97 114.24 3naf h TYR 450 Ca -0.01 -0.01 -0.54 0.00 3.14 0.00 0.00 58.73 61.32 3naf h TYR 450 Cb 1.09 0.08 -0.39 0.00 1.54 0.00 0.00 36.73 39.05 3naf h TYR 450 CO 0.00 0.06 -0.80 -1.58 -1.64 0.00 0.00 178.16 174.20 3naf s HIS 451 N -2.94 0.43 0.27 -3.82 2.46 -0.44 -5.04 115.29 106.21 3naf s HIS 451 Ca -0.09 -1.14 0.00 0.00 0.47 0.00 0.00 55.06 54.30 3naf s HIS 451 Cb 0.00 -0.87 0.54 0.00 -0.13 0.00 0.00 32.58 32.12 3naf s HIS 451 CO 0.32 -0.84 1.81 -1.35 -2.47 0.00 0.00 174.74 172.22 3naf h PRO 452 N 7.83 0.86 -0.07 2.88 0.11 -1.53 -3.05 132.00 139.02 3naf h PRO 452 Ca -0.09 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.97 3naf h PRO 452 Cb 1.00 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.91 3naf h PRO 452 CO 0.36 0.57 0.00 1.63 -0.21 0.00 0.00 178.00 180.35 3naf n LYS 453 N -4.69 1.31 -1.09 1.05 5.02 -1.26 -4.87 118.16 113.64 3naf n LYS 453 Ca 0.18 -0.47 -0.32 0.00 -2.02 0.00 0.00 58.31 55.68 3naf n LYS 453 Cb 0.37 -1.33 0.12 0.00 -0.02 0.00 0.00 35.03 34.18 3naf n LYS 453 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 3naf s ILE 454 N -1.91 2.61 -0.22 -0.18 2.07 -1.15 -5.00 121.20 117.41 3naf s ILE 454 Ca 0.29 0.22 -0.09 0.00 -1.41 0.00 0.00 60.65 59.66 3naf s ILE 454 Cb 0.14 -2.52 -0.04 0.00 0.13 0.00 0.00 42.46 40.17 3naf s ILE 454 CO 0.23 -0.24 0.12 -0.60 -1.91 0.00 0.00 174.94 172.54 3naf s ARG 455 N -4.56 3.98 -0.04 3.50 3.52 -1.26 -4.94 118.95 119.14 3naf s ARG 455 Ca 0.66 -0.32 0.05 0.00 -0.13 0.00 0.00 55.73 55.99 3naf s ARG 455 Cb -0.22 -3.41 -0.03 0.00 -1.56 0.00 0.00 34.95 29.73 3naf s ARG 455 CO 0.54 0.08 -0.17 0.42 -0.81 0.00 0.00 175.30 175.36 3naf s ILE 456 N 0.95 2.83 -0.27 4.11 1.01 -1.26 -0.55 121.20 128.01 3naf s ILE 456 Ca 0.06 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 59.88 3naf s ILE 456 Cb -0.13 -2.09 0.08 0.00 0.01 0.00 0.00 42.46 40.32 3naf s ILE 456 CO 0.03 0.57 -0.00 -0.63 0.00 0.00 0.00 174.94 174.91 3naf s ILE 457 N -0.72 1.61 0.33 2.92 1.01 -0.75 -1.92 121.20 123.67 3naf s ILE 457 Ca 0.11 -1.53 0.01 0.00 0.00 0.00 0.00 60.65 59.24 3naf s ILE 457 Cb -0.10 -2.00 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 3naf s ILE 457 CO 0.01 -0.32 0.52 -0.89 0.00 0.00 0.00 174.94 174.25 3naf s THR 458 N 1.31 5.13 -0.34 2.92 2.01 -0.93 -1.58 115.64 124.16 3naf s THR 458 Ca 0.01 -0.53 -0.09 0.00 0.31 0.00 0.00 61.69 61.39 3naf s THR 458 Cb -0.19 -3.86 0.02 0.00 0.01 0.00 0.00 72.50 68.49 3naf s THR 458 CO -0.10 -0.51 0.15 -1.10 -0.69 0.00 0.00 174.62 172.37 3naf s GLN 459 N -4.22 2.91 0.18 4.92 -0.21 -0.76 -0.53 119.66 121.96 3naf s GLN 459 Ca 0.39 -1.00 -0.07 0.00 0.02 0.00 0.00 55.36 54.69 3naf s GLN 459 Cb -0.10 -3.59 -0.06 0.00 1.00 0.00 0.00 33.01 30.27 3naf s GLN 459 CO 0.35 -0.60 0.46 -1.64 -2.12 0.00 0.00 175.29 171.74 3naf s MET 460 N 1.52 3.71 -0.11 2.91 -1.94 0.60 -4.63 119.30 121.36 3naf s MET 460 Ca 0.02 0.10 0.18 0.00 -1.71 0.00 0.00 55.69 54.28 3naf s MET 460 Cb -0.19 -2.76 -0.27 0.00 2.01 0.00 0.00 34.83 33.63 3naf s MET 460 CO 0.05 0.40 0.24 1.28 -0.01 0.00 0.00 175.02 176.98 3naf n LEU 461 N 0.01 0.00 -3.87 -0.03 4.77 -1.26 0.62 117.00 117.25 3naf n LEU 461 Ca -0.01 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.79 3naf n LEU 461 Cb 0.52 0.25 -0.16 0.00 -2.33 0.00 0.00 43.42 41.70 3naf n LEU 461 CO 0.47 0.25 -0.39 -1.58 -1.33 0.00 0.00 177.39 174.80 3naf s GLN 462 N -2.90 0.55 0.61 3.23 2.00 -1.26 -3.56 119.66 118.34 3naf s GLN 462 Ca -0.08 -0.03 0.32 0.00 -2.00 0.00 0.00 55.36 53.57 3naf s GLN 462 Cb 0.09 -0.63 1.86 0.00 0.80 0.00 0.00 33.01 35.13 3naf s GLN 462 CO 0.80 -0.08 2.18 -0.92 -0.50 0.00 0.00 175.29 176.77 3naf h TYR 463 N 7.08 0.00 0.00 1.67 5.03 -1.96 -1.45 116.97 127.34 3naf h TYR 463 Ca -0.40 0.00 -0.13 0.00 2.58 0.00 0.00 58.73 60.78 3naf h TYR 463 Cb 1.15 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 39.41 3naf h TYR 463 CO 0.49 0.00 -1.00 1.12 -1.32 0.00 0.00 178.16 177.46 3naf h HIS 464 N 0.00 0.00 0.00 -3.82 2.07 -1.97 -3.15 115.15 108.27 3naf h HIS 464 Ca 0.04 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.56 3naf h HIS 464 Cb 0.29 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.27 3naf h HIS 464 CO 0.00 0.51 0.00 -0.91 -3.07 0.00 0.00 177.93 174.46 3naf h ASN 465 N 0.00 0.00 0.51 3.10 2.35 -1.70 -3.08 115.58 116.76 3naf h ASN 465 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 3naf h ASN 465 Cb 1.47 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.84 3naf h ASN 465 CO 0.05 0.00 0.00 0.50 -1.65 0.00 0.00 177.43 176.33 3naf h LYS 466 N 0.00 0.00 -0.00 0.81 3.64 -1.45 -1.73 116.57 117.84 3naf h LYS 466 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3naf h LYS 466 Cb 0.80 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 3naf h LYS 466 CO 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 179.45 177.17 3naf n ALA 467 N -1.98 2.55 0.02 5.00 0.00 -1.16 -3.57 120.51 121.37 3naf n ALA 467 Ca -0.00 -0.16 -0.18 0.00 0.00 0.00 0.00 53.44 53.09 3naf n ALA 467 Cb 0.18 -1.49 -0.12 0.00 0.00 0.00 0.00 19.45 18.02 3naf n ALA 467 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3naf h HIS 468 N 0.04 0.60 0.00 0.00 3.86 -1.53 -3.25 115.15 114.88 3naf h HIS 468 Ca 0.00 -0.36 0.00 0.00 -1.16 0.00 0.00 60.37 58.85 3naf h HIS 468 Cb 0.23 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.64 3naf h HIS 468 CO 0.00 1.21 0.36 -0.07 0.86 0.00 0.00 177.93 180.29 3naf h LEU 469 N -0.17 0.00 -0.57 2.43 3.38 -1.74 0.35 115.31 118.99 3naf h LEU 469 Ca -0.10 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3naf h LEU 469 Cb 1.43 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.18 3naf h LEU 469 CO 0.13 0.00 -0.04 -0.07 0.09 0.00 0.00 178.44 178.55 3naf h LEU 470 N 0.00 0.00 0.00 1.67 3.38 -1.77 -2.93 115.31 115.66 3naf h LEU 470 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3naf h LEU 470 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 3naf h LEU 470 CO 0.00 0.04 0.00 0.59 0.09 0.00 0.00 178.44 179.16 3naf n ASN 471 N -3.12 0.00 -4.45 -0.43 3.02 0.12 -4.62 115.26 105.78 3naf n ASN 471 Ca 0.02 -0.10 -0.39 0.00 -0.03 0.00 0.00 54.58 54.08 3naf n ASN 471 Cb 0.46 -0.26 -0.11 0.00 -0.61 0.00 0.00 39.78 39.26 3naf n ASN 471 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3naf s ILE 472 N -2.51 4.78 0.30 2.41 1.01 -1.11 -4.98 121.20 121.11 3naf s ILE 472 Ca 0.23 -0.44 0.16 0.00 0.00 0.00 0.00 60.65 60.59 3naf s ILE 472 Cb 0.15 -3.48 0.10 0.00 0.01 0.00 0.00 42.46 39.25 3naf s ILE 472 CO 0.33 -0.00 1.79 -0.65 0.00 0.00 0.00 174.94 176.41 3naf h PRO 473 N 8.40 0.00 0.00 2.79 0.11 -1.87 -1.88 132.00 139.55 3naf h PRO 473 Ca -0.31 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.75 3naf h PRO 473 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3naf h PRO 473 CO 0.63 0.39 -0.26 0.77 -0.21 0.00 0.00 178.00 179.32 3naf h SER 474 N 0.00 0.00 -2.20 -2.05 0.02 -1.93 -3.40 113.55 103.99 3naf h SER 474 Ca -0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.37 3naf h SER 474 Cb 0.77 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.21 3naf h SER 474 CO 0.05 0.26 1.03 0.86 -1.14 0.00 0.00 176.83 177.89 3naf s TRP 475 N -3.90 2.43 -0.04 3.45 -0.11 -0.71 -4.91 118.94 115.16 3naf s TRP 475 Ca -0.01 -0.33 0.05 0.00 1.22 0.00 0.00 56.10 57.03 3naf s TRP 475 Cb 0.12 -4.57 -0.01 0.00 -1.50 0.00 0.00 33.47 27.52 3naf s TRP 475 CO 0.65 -1.95 -0.21 0.54 -4.62 0.00 0.00 176.95 171.36 3naf s ASN 476 N 3.94 2.57 0.22 5.86 4.22 -1.26 -4.88 114.94 125.61 3naf s ASN 476 Ca 0.34 -0.42 0.06 0.00 -2.14 0.00 0.00 52.86 50.70 3naf s ASN 476 Cb -0.08 -0.64 0.19 0.00 1.28 0.00 0.00 41.25 42.00 3naf s ASN 476 CO 0.09 0.21 1.52 -0.50 -2.04 0.00 0.00 177.10 176.37 3naf h TRP 477 N 6.07 0.20 -0.96 1.54 6.55 -1.95 -3.15 115.95 124.25 3naf h TRP 477 Ca -0.33 -0.09 0.16 0.00 0.95 0.00 0.00 58.89 59.57 3naf h TRP 477 Cb 1.17 -0.03 -0.09 0.00 -0.86 0.00 0.00 29.16 29.35 3naf h TRP 477 CO 0.43 0.79 0.61 -0.22 -1.05 0.00 0.00 178.44 179.00 3naf h LYS 478 N 0.10 0.76 -1.46 0.49 3.64 -1.91 -1.70 116.57 116.49 3naf h LYS 478 Ca -0.02 -0.05 -0.70 0.00 -1.27 0.00 0.00 60.65 58.62 3naf h LYS 478 Cb 1.23 -0.17 -0.27 0.00 -0.41 0.00 0.00 32.23 32.61 3naf h LYS 478 CO 0.10 0.50 0.92 -1.91 -2.27 0.00 0.00 179.45 176.80 3naf n GLU 479 N -4.64 2.67 0.00 1.90 2.13 -1.21 -4.87 120.64 116.62 3naf n GLU 479 Ca 0.20 -3.29 0.00 0.00 0.66 0.00 0.00 57.16 54.73 3naf n GLU 479 Cb 0.49 -2.25 0.00 0.00 0.27 0.00 0.00 31.44 29.95 3naf n GLU 479 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3naf n GLY 480 N -0.66 3.12 3.64 8.31 0.00 -0.64 -4.80 105.19 114.16 3naf n GLY 480 Ca 0.58 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 46.15 3naf n GLY 480 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3naf n ASP 481 N 0.11 2.00 -3.50 1.61 10.43 -1.19 -4.77 116.55 121.24 3naf n ASP 481 Ca 0.00 1.18 -0.13 0.00 2.57 0.00 0.00 54.79 58.41 3naf n ASP 481 Cb 0.00 -1.37 -0.04 0.00 1.84 0.00 0.00 41.12 41.56 3naf n ASP 481 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 3naf s ASP 482 N -0.29 -0.51 -0.21 -2.24 1.01 -0.81 -4.38 116.67 109.24 3naf s ASP 482 Ca 0.60 0.09 -0.03 0.00 0.71 0.00 0.00 52.55 53.93 3naf s ASP 482 Cb -0.66 0.55 0.07 0.00 1.01 0.00 0.00 42.92 43.88 3naf s ASP 482 CO 0.58 -0.85 0.05 0.00 0.21 0.00 0.00 175.17 175.17 3naf s ALA 483 N -3.12 0.97 -0.46 5.23 0.00 -1.26 -2.19 121.76 120.93 3naf s ALA 483 Ca -0.02 -0.77 -0.28 0.00 0.00 0.00 0.00 51.96 50.89 3naf s ALA 483 Cb -0.00 -1.22 -0.02 0.00 0.00 0.00 0.00 23.12 21.88 3naf s ALA 483 CO -0.07 -1.25 1.82 0.42 0.00 0.00 0.00 175.76 176.67 3naf s ILE 484 N 1.88 3.44 -0.26 0.00 -1.09 0.31 -4.83 121.20 120.66 3naf s ILE 484 Ca 0.01 0.38 -0.28 0.00 -2.23 0.00 0.00 60.65 58.53 3naf s ILE 484 Cb -0.17 -3.78 0.01 0.00 -1.58 0.00 0.00 42.46 36.94 3naf s ILE 484 CO -0.12 -0.62 1.01 0.00 -1.23 0.00 0.00 174.94 173.98 3naf h LEU 486 N 9.57 0.24 0.23 0.00 4.07 -0.06 -2.99 115.31 126.37 3naf h LEU 486 Ca -0.20 -0.21 -0.31 0.00 0.08 0.00 0.00 57.88 57.24 3naf h LEU 486 Cb 1.07 -0.07 0.04 0.00 1.08 0.00 0.00 40.66 42.77 3naf h LEU 486 CO 0.98 1.06 -1.35 0.00 -1.08 0.00 0.00 178.44 178.05 3naf h ALA 487 N 0.91 -0.14 -1.01 1.53 0.00 -1.75 -2.30 119.26 116.50 3naf h ALA 487 Ca -0.05 -0.82 0.06 0.00 0.00 0.00 0.00 54.91 54.09 3naf h ALA 487 Cb 1.63 0.16 -0.07 0.00 0.00 0.00 0.00 17.79 19.51 3naf h ALA 487 CO 0.14 0.64 0.65 1.49 0.00 0.00 0.00 179.25 182.17 3naf h GLU 488 N 0.07 1.16 0.08 0.00 4.81 -1.87 -2.83 114.58 116.00 3naf h GLU 488 Ca -0.23 -0.07 -0.25 0.00 -0.13 0.00 0.00 59.36 58.68 3naf h GLU 488 Cb 2.06 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 31.17 3naf h GLU 488 CO 0.25 0.77 -1.31 -0.07 -0.73 0.00 0.00 179.01 177.92 3naf h LEU 489 N 1.20 0.25 -0.24 1.64 3.38 -1.63 -2.82 115.31 117.08 3naf h LEU 489 Ca 0.43 -0.78 0.04 0.00 0.09 0.00 0.00 57.88 57.66 3naf h LEU 489 Cb 0.14 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 40.74 3naf h LEU 489 CO -0.17 1.56 -0.51 0.50 0.09 0.00 0.00 178.44 179.91 3naf h LYS 490 N -0.51 -0.47 -0.21 1.13 3.64 -1.37 0.35 116.57 119.13 3naf h LYS 490 Ca -0.30 0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.02 3naf h LYS 490 Cb 1.60 0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 33.53 3naf h LYS 490 CO -0.01 -0.31 -0.20 -0.07 -2.27 0.00 0.00 179.45 176.58 3naf h LEU 491 N -0.49 0.54 -0.94 5.20 3.38 -1.69 -2.80 115.31 118.51 3naf h LEU 491 Ca 0.07 -0.47 0.26 0.00 0.09 0.00 0.00 57.88 57.82 3naf h LEU 491 Cb 0.64 -0.15 -0.14 0.00 0.09 0.00 0.00 40.66 41.10 3naf h LEU 491 CO -0.49 0.90 0.44 1.23 0.09 0.00 0.00 178.44 180.61 3naf h GLY 492 N 0.19 1.71 0.91 0.83 0.00 -1.17 0.74 103.07 106.27 3naf h GLY 492 Ca 0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.17 3naf h GLY 492 CO 0.05 -0.35 -0.14 0.74 0.00 0.00 0.00 176.54 176.84 3naf h PHE 493 N 0.37 -0.37 -0.89 5.60 -1.00 -0.10 -2.45 116.94 118.09 3naf h PHE 493 Ca 0.62 -0.01 0.04 0.00 2.81 0.00 0.00 57.97 61.43 3naf h PHE 493 Cb 1.27 0.12 -0.05 0.00 3.61 0.00 0.00 35.95 40.90 3naf h PHE 493 CO -0.11 -0.17 0.58 0.82 -1.61 0.00 0.00 178.31 177.83 3naf h ILE 494 N -0.51 1.15 0.30 -0.55 2.04 -0.84 -2.06 117.51 117.04 3naf h ILE 494 Ca -0.04 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.43 3naf h ILE 494 Cb 0.38 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.38 3naf h ILE 494 CO 0.07 0.20 -0.41 0.00 0.00 0.00 0.00 178.15 178.01 3naf h ALA 495 N 1.48 -1.02 -0.30 1.87 0.00 0.62 -0.83 119.26 121.08 3naf h ALA 495 Ca 0.35 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.22 3naf h ALA 495 Cb 0.02 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3naf h ALA 495 CO -0.11 -1.07 0.22 1.96 0.00 0.00 0.00 179.25 180.25 3naf h GLN 496 N -0.74 0.00 0.00 0.00 1.08 -1.28 0.53 115.11 114.70 3naf h GLN 496 Ca -0.04 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 3naf h GLN 496 Cb 0.67 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.10 3naf h GLN 496 CO -0.11 0.00 0.00 0.43 -0.95 0.00 0.00 178.83 178.20 3naf n SER 497 N -4.36 0.66 0.14 1.46 7.64 -0.62 -1.23 113.62 117.30 3naf n SER 497 Ca 0.04 0.62 0.01 0.00 1.01 0.00 0.00 58.87 60.55 3naf n SER 497 Cb 0.38 -0.78 0.11 0.00 -1.01 0.00 0.00 64.21 62.92 3naf n SER 497 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3naf n LEU 499 N -3.42 0.77 -4.08 0.00 4.32 -0.37 -4.69 117.00 109.54 3naf n LEU 499 Ca 0.00 0.45 -0.36 0.00 -0.02 0.00 0.00 56.01 56.09 3naf n LEU 499 Cb 0.69 -0.33 -0.09 0.00 -1.62 0.00 0.00 43.42 42.07 3naf n LEU 499 CO 0.41 -0.33 0.08 0.00 -1.22 0.00 0.00 177.39 176.33 3naf s ALA 500 N -3.18 3.71 0.11 -1.18 0.00 -0.64 -4.76 121.76 115.81 3naf s ALA 500 Ca 0.00 -3.42 -0.35 0.00 0.00 0.00 0.00 51.96 48.19 3naf s ALA 500 Cb 0.00 -2.65 -0.17 0.00 0.00 0.00 0.00 23.12 20.30 3naf s ALA 500 CO 0.00 -2.12 1.09 0.94 0.00 0.00 0.00 175.76 175.67 3naf n GLN 501 N 3.15 0.66 0.00 0.00 7.27 -1.10 -1.21 117.38 126.16 3naf n GLN 501 Ca 0.11 0.24 0.00 0.00 0.07 0.00 0.00 57.00 57.42 3naf n GLN 501 Cb 0.37 -1.70 0.00 0.00 2.41 0.00 0.00 30.24 31.32 3naf n GLN 501 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3naf n GLY 502 N 1.96 3.04 0.31 1.69 0.00 -1.24 -4.93 105.19 106.01 3naf n GLY 502 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.30 3naf n GLY 502 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3naf h LEU 503 N 0.00 0.34 -0.14 0.99 7.12 -1.48 -0.75 115.31 121.38 3naf h LEU 503 Ca 0.00 0.14 0.03 0.00 0.13 0.00 0.00 57.88 58.17 3naf h LEU 503 Cb 0.00 0.11 -0.05 0.00 -0.53 0.00 0.00 40.66 40.19 3naf h LEU 503 CO 0.00 0.05 -0.43 0.77 -0.13 0.00 0.00 178.44 178.69 3naf h SER 504 N 0.44 -1.39 0.37 1.25 4.64 -1.83 -1.28 113.55 115.74 3naf h SER 504 Ca 0.52 0.17 -0.11 0.00 -0.47 0.00 0.00 61.79 61.89 3naf h SER 504 Cb 0.91 0.55 -0.01 0.00 -0.31 0.00 0.00 62.40 63.54 3naf h SER 504 CO -0.48 -0.38 -0.48 0.71 -0.87 0.00 0.00 176.83 175.33 3naf h THR 505 N -0.44 1.34 -0.23 2.95 1.35 -1.70 -1.53 112.91 114.66 3naf h THR 505 Ca 0.03 -1.68 0.01 0.00 -0.55 0.00 0.00 66.41 64.22 3naf h THR 505 Cb 0.53 1.84 -0.02 0.00 -1.73 0.00 0.00 68.15 68.78 3naf h THR 505 CO -0.37 0.49 0.14 -0.03 -0.25 0.00 0.00 175.52 175.50 3naf h MET 506 N 0.11 0.28 -0.25 4.72 1.85 -0.75 -1.49 114.93 119.39 3naf h MET 506 Ca 0.00 -0.02 -0.12 0.00 -0.61 0.00 0.00 59.70 58.96 3naf h MET 506 Cb 0.90 -0.06 -0.01 0.00 0.43 0.00 0.00 31.60 32.85 3naf h MET 506 CO 0.07 0.18 -0.33 -0.07 -0.40 0.00 0.00 176.91 176.36 3naf h LEU 507 N 0.28 0.56 0.11 3.39 4.07 -1.09 -3.18 115.31 119.46 3naf h LEU 507 Ca 0.09 -0.23 0.01 0.00 0.08 0.00 0.00 57.88 57.84 3naf h LEU 507 Cb -0.01 -0.16 -0.05 0.00 1.08 0.00 0.00 40.66 41.53 3naf h LEU 507 CO -0.04 0.86 -0.52 0.00 -1.08 0.00 0.00 178.44 177.66 3naf h ALA 508 N 1.17 -0.99 -0.15 1.53 0.00 -0.70 -2.31 119.26 117.81 3naf h ALA 508 Ca 0.05 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.90 3naf h ALA 508 Cb 0.80 0.90 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 3naf h ALA 508 CO 0.07 -1.12 0.25 -0.91 0.00 0.00 0.00 179.25 177.53 3naf h ASN 509 N -0.74 0.00 0.88 0.00 2.35 -1.28 -0.85 115.58 115.95 3naf h ASN 509 Ca -0.01 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.66 3naf h ASN 509 Cb 0.75 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.10 3naf h ASN 509 CO -0.29 0.00 -0.40 -0.07 -1.65 0.00 0.00 177.43 175.02 3naf h LEU 510 N 0.00 0.00 0.00 1.61 3.38 -1.41 -3.33 115.31 115.55 3naf h LEU 510 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3naf h LEU 510 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3naf h LEU 510 CO -0.00 0.40 -0.13 2.22 0.09 0.00 0.00 178.44 181.02 3naf n PHE 511 N -3.52 0.00 -3.28 1.13 1.16 -0.82 -1.62 117.46 110.51 3naf n PHE 511 Ca -0.00 0.00 -0.39 0.00 -1.87 0.00 0.00 57.45 55.19 3naf n PHE 511 Cb 0.53 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.34 3naf n PHE 511 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 3naf s SER 512 N -0.90 6.61 0.19 5.98 1.04 -0.39 -4.68 113.70 121.55 3naf s SER 512 Ca 0.00 0.73 -0.32 0.00 0.48 0.00 0.00 55.95 56.84 3naf s SER 512 Cb 0.00 -2.29 -0.12 0.00 0.10 0.00 0.00 66.02 63.71 3naf s SER 512 CO 0.00 -0.10 1.74 0.80 0.98 0.00 0.00 173.24 176.66 3naf n MET 513 N 4.28 2.73 -4.43 4.02 1.56 -1.26 -4.76 117.12 119.26 3naf n MET 513 Ca -0.06 0.99 -0.30 0.00 -0.27 0.00 0.00 57.70 58.06 3naf n MET 513 Cb 0.51 -2.84 -0.17 0.00 2.15 0.00 0.00 33.22 32.88 3naf n MET 513 CO 0.00 0.00 0.00 1.03 -0.73 0.00 0.00 175.97 176.27 3naf s ARG 514 N 1.48 2.43 -0.81 2.12 3.00 -1.26 -5.04 118.95 120.86 3naf s ARG 514 Ca 0.77 -0.63 -0.26 0.00 0.00 0.00 0.00 55.73 55.61 3naf s ARG 514 Cb -0.52 -2.06 0.02 0.00 0.00 0.00 0.00 34.95 32.40 3naf s ARG 514 CO 0.34 -0.08 1.49 -1.54 0.00 0.00 0.00 175.30 175.51 3naf s SER 515 N 1.03 6.01 0.27 0.23 1.04 -1.26 -4.96 113.70 116.05 3naf s SER 515 Ca -0.05 -0.62 -0.29 0.00 0.48 0.00 0.00 55.95 55.48 3naf s SER 515 Cb -0.15 -2.56 -0.14 0.00 0.10 0.00 0.00 66.02 63.27 3naf s SER 515 CO -0.03 -1.93 0.98 0.49 0.98 0.00 0.00 173.24 173.73 3naf n PHE 516 N 10.26 1.11 -4.04 5.02 0.99 -1.26 -5.00 117.46 124.54 3naf n PHE 516 Ca 0.18 0.73 -0.12 0.00 -0.00 0.00 0.00 57.45 58.24 3naf n PHE 516 Cb 0.50 -2.23 -0.11 0.00 -1.00 0.00 0.00 39.48 36.64 3naf n PHE 516 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 3naf s ILE 517 N -0.94 0.42 -0.29 4.37 1.01 -1.26 -5.14 121.20 119.36 3naf s ILE 517 Ca 0.61 -1.03 -0.12 0.00 0.00 0.00 0.00 60.65 60.11 3naf s ILE 517 Cb -0.74 -0.51 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 3naf s ILE 517 CO 0.59 -0.41 0.22 -0.75 0.00 0.00 0.00 174.94 174.58 3naf s LYS 518 N -1.54 3.84 -0.14 2.79 2.20 -1.26 -5.02 119.74 120.61 3naf s LYS 518 Ca -0.12 -0.37 -0.01 0.00 -0.36 0.00 0.00 55.97 55.11 3naf s LYS 518 Cb -0.10 -3.70 0.04 0.00 -1.51 0.00 0.00 37.83 32.56 3naf s LYS 518 CO 0.00 -0.26 -0.02 0.42 -0.36 0.00 0.00 175.35 175.13 3naf s ILE 519 N 1.78 0.78 -0.35 5.43 1.01 -1.26 -4.98 121.20 123.61 3naf s ILE 519 Ca 0.08 -0.39 0.03 0.00 0.00 0.00 0.00 60.65 60.37 3naf s ILE 519 Cb -0.16 -1.01 0.05 0.00 0.01 0.00 0.00 42.46 41.35 3naf s ILE 519 CO 0.11 0.10 0.81 -1.84 0.00 0.00 0.00 174.94 174.12 3naf n GLU 520 N 4.99 0.97 0.00 2.79 0.28 -1.26 -4.65 120.64 123.76 3naf n GLU 520 Ca -0.10 -1.11 0.04 0.00 -0.16 0.00 0.00 57.16 55.82 3naf n GLU 520 Cb 0.48 -1.07 0.19 0.00 1.43 0.00 0.00 31.44 32.47 3naf n GLU 520 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3naf n GLU 521 N 0.02 0.10 -3.54 3.44 1.02 -1.26 -4.86 120.64 115.56 3naf n GLU 521 Ca 0.03 0.22 -0.19 0.00 -0.02 0.00 0.00 57.16 57.20 3naf n GLU 521 Cb 0.18 -1.50 0.06 0.00 -0.02 0.00 0.00 31.44 30.16 3naf n GLU 521 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3naf n ASP 522 N -1.30 -2.03 -3.35 1.62 8.00 -1.26 -5.03 116.55 113.20 3naf n ASP 522 Ca 0.03 -0.72 -0.13 0.00 0.71 0.00 0.00 54.79 54.68 3naf n ASP 522 Cb 0.06 -4.63 -0.01 0.00 -0.02 0.00 0.00 41.12 36.52 3naf n ASP 522 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3naf n THR 523 N -4.13 0.00 0.24 -3.53 -2.24 -1.26 -4.94 114.28 98.42 3naf n THR 523 Ca -0.28 -1.07 0.09 0.00 -2.27 0.00 0.00 64.05 60.53 3naf n THR 523 Cb 0.67 -0.17 0.60 0.00 -2.10 0.00 0.00 70.33 69.33 3naf n THR 523 CO 0.00 0.00 0.00 4.11 -0.57 0.00 0.00 175.07 178.61 3naf h TRP 524 N 0.69 0.00 0.00 4.78 5.08 -1.96 -1.45 115.95 123.08 3naf h TRP 524 Ca -0.17 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.80 3naf h TRP 524 Cb 0.61 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.77 3naf h TRP 524 CO 0.00 0.18 0.00 0.00 -1.28 0.00 0.00 178.44 177.34 3naf n GLN 525 N -3.82 0.02 -0.00 0.12 0.00 -1.26 -2.63 117.38 109.81 3naf n GLN 525 Ca -0.02 0.19 -0.00 0.00 0.00 0.00 0.00 57.00 57.17 3naf n GLN 525 Cb 0.28 -1.50 -0.00 0.00 0.00 0.00 0.00 30.24 29.02 3naf n GLN 525 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 3naf h LYS 526 N 0.00 0.00 -0.95 2.61 3.64 -1.56 -3.07 116.57 117.24 3naf h LYS 526 Ca 0.00 0.00 0.22 0.00 -1.27 0.00 0.00 60.65 59.60 3naf h LYS 526 Cb 0.29 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.04 3naf h LYS 526 CO 0.00 0.00 0.62 1.88 -2.27 0.00 0.00 179.45 179.68 3naf h TYR 527 N -0.00 0.58 -0.56 1.91 -1.99 -1.64 0.21 116.97 115.48 3naf h TYR 527 Ca 0.00 0.02 -0.07 0.00 2.00 0.00 0.00 58.73 60.68 3naf h TYR 527 Cb 0.00 -0.17 -0.02 0.00 2.00 0.00 0.00 36.73 38.53 3naf h TYR 527 CO -0.00 0.13 0.08 -0.92 -0.00 0.00 0.00 178.16 177.44 3naf h TYR 528 N 0.41 0.99 -0.03 4.88 3.20 -1.67 -3.02 116.97 121.74 3naf h TYR 528 Ca 0.51 -0.14 -0.08 0.00 3.14 0.00 0.00 58.73 62.15 3naf h TYR 528 Cb 1.27 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 39.26 3naf h TYR 528 CO -0.00 0.88 -0.37 1.25 -1.64 0.00 0.00 178.16 178.28 3naf h LEU 529 N 0.82 0.06 -1.34 2.82 5.85 -0.51 -2.64 115.31 120.37 3naf h LEU 529 Ca 0.17 -0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.95 3naf h LEU 529 Cb 0.43 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 3naf h LEU 529 CO 0.01 0.42 0.51 -0.33 -0.34 0.00 0.00 178.44 178.72 3naf h GLU 530 N 0.05 0.74 0.00 1.25 4.39 -1.26 -1.16 114.58 118.58 3naf h GLU 530 Ca 0.00 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.66 3naf h GLU 530 Cb 0.68 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 3naf h GLU 530 CO 0.05 0.49 -0.25 0.78 -1.16 0.00 0.00 179.01 178.92 3naf h GLY 531 N 0.76 0.00 2.00 -3.84 0.00 -1.54 -3.25 103.07 97.20 3naf h GLY 531 Ca 0.35 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.63 3naf h GLY 531 CO -0.13 0.00 -0.24 -2.08 0.00 0.00 0.00 176.54 174.09 3naf h VAL 532 N 0.00 0.62 0.00 4.60 2.07 -1.10 -3.00 116.25 119.45 3naf h VAL 532 Ca 0.00 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.38 3naf h VAL 532 Cb 0.96 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 3naf h VAL 532 CO 0.00 0.24 0.00 -1.54 0.02 0.00 0.00 177.57 176.29 3naf n SER 533 N -3.44 0.00 -4.69 0.57 3.41 -1.16 -4.66 113.62 103.65 3naf n SER 533 Ca -0.00 0.29 -0.39 0.00 -0.26 0.00 0.00 58.87 58.51 3naf n SER 533 Cb 0.43 -0.33 -0.06 0.00 -0.26 0.00 0.00 64.21 63.99 3naf n SER 533 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3naf s ASN 534 N -2.66 6.72 0.09 4.04 0.01 -1.13 -4.43 114.94 117.58 3naf s ASN 534 Ca 0.03 0.86 0.01 0.00 -0.71 0.00 0.00 52.86 53.06 3naf s ASN 534 Cb 0.03 -2.33 0.01 0.00 0.41 0.00 0.00 41.25 39.37 3naf s ASN 534 CO 0.06 -0.13 0.12 -0.62 -1.51 0.00 0.00 177.10 175.02 3naf n GLU 535 N 4.27 1.04 -3.96 -0.60 4.71 -0.88 -4.26 120.64 120.95 3naf n GLU 535 Ca -0.04 -0.53 -0.29 0.00 -0.01 0.00 0.00 57.16 56.29 3naf n GLU 535 Cb 0.51 -0.02 -0.16 0.00 -1.01 0.00 0.00 31.44 30.76 3naf n GLU 535 CO 0.00 0.00 0.00 1.41 0.09 0.00 0.00 177.13 178.63 3naf s MET 536 N -2.42 1.84 0.28 3.49 1.75 -0.64 -3.58 119.30 120.02 3naf s MET 536 Ca 0.09 -0.63 0.11 0.00 -1.25 0.00 0.00 55.69 54.01 3naf s MET 536 Cb -0.01 -2.16 -0.05 0.00 2.84 0.00 0.00 34.83 35.46 3naf s MET 536 CO 0.06 -0.38 -0.16 0.71 -0.65 0.00 0.00 175.02 174.60 3naf s TYR 537 N 1.52 2.37 -0.20 4.11 2.02 -0.08 -4.98 117.35 122.11 3naf s TYR 537 Ca 0.01 -0.32 -0.03 0.00 -0.37 0.00 0.00 57.07 56.36 3naf s TYR 537 Cb -0.15 -1.05 0.06 0.00 -0.40 0.00 0.00 41.96 40.42 3naf s TYR 537 CO -0.08 0.69 0.05 0.95 -1.57 0.00 0.00 175.55 175.59 3naf s THR 538 N -2.48 0.43 0.07 -0.71 -4.23 -1.26 0.07 115.64 107.53 3naf s THR 538 Ca 0.30 -0.53 0.08 0.00 -1.18 0.00 0.00 61.69 60.36 3naf s THR 538 Cb -0.05 -0.98 -0.03 0.00 1.34 0.00 0.00 72.50 72.78 3naf s THR 538 CO 0.16 -0.24 -0.21 -0.70 -0.54 0.00 0.00 174.62 173.08 3naf s GLU 539 N 1.90 1.28 0.48 3.99 2.56 -0.98 -4.89 118.70 123.04 3naf s GLU 539 Ca -0.00 -1.06 -0.23 0.00 0.00 0.00 0.00 54.97 53.68 3naf s GLU 539 Cb -0.17 -1.48 -0.07 0.00 2.00 0.00 0.00 34.13 34.41 3naf s GLU 539 CO -0.09 0.36 1.22 0.71 -0.56 0.00 0.00 175.26 176.90 3naf s TYR 540 N -0.97 2.73 -0.06 5.30 1.51 -1.26 -1.63 117.35 122.96 3naf s TYR 540 Ca 0.07 1.49 -0.22 0.00 -1.01 0.00 0.00 57.07 57.41 3naf s TYR 540 Cb -0.09 -3.50 -0.04 0.00 -0.11 0.00 0.00 41.96 38.22 3naf s TYR 540 CO 0.03 -1.88 0.64 -0.51 -1.11 0.00 0.00 175.55 172.72 3naf s LEU 541 N -3.12 4.33 1.14 -1.29 1.43 -1.07 -3.50 118.68 116.60 3naf s LEU 541 Ca 0.65 1.11 -0.13 0.00 -1.03 0.00 0.00 54.13 54.73 3naf s LEU 541 Cb -0.32 -2.98 0.27 0.00 0.03 0.00 0.00 46.19 43.19 3naf s LEU 541 CO 0.39 -0.05 1.04 -0.55 0.23 0.00 0.00 176.35 177.41 3naf s SER 542 N 0.56 1.25 0.39 2.29 0.15 -0.69 -4.57 113.70 113.08 3naf s SER 542 Ca 0.34 1.33 0.20 0.00 0.70 0.00 0.00 55.95 58.53 3naf s SER 542 Cb -0.17 -2.07 0.71 0.00 -1.71 0.00 0.00 66.02 62.78 3naf s SER 542 CO 0.16 -4.01 1.74 0.28 1.20 0.00 0.00 173.24 172.62 3naf h SER 543 N -2.49 0.00 0.00 5.45 0.02 -1.92 -3.11 113.55 111.50 3naf h SER 543 Ca -0.60 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.35 3naf h SER 543 Cb 1.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.88 3naf h SER 543 CO 0.52 0.33 0.01 0.00 -1.14 0.00 0.00 176.83 176.55 3naf n ALA 544 N -2.26 1.00 0.00 3.77 0.00 -1.26 -0.96 120.51 120.79 3naf n ALA 544 Ca 0.00 0.11 0.04 0.00 0.00 0.00 0.00 53.44 53.58 3naf n ALA 544 Cb 0.50 -1.14 0.08 0.00 0.00 0.00 0.00 19.45 18.88 3naf n ALA 544 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3naf n PHE 545 N -1.89 0.21 -2.53 0.00 3.72 -1.17 -5.03 117.46 110.77 3naf n PHE 545 Ca -0.01 -0.36 -0.42 0.00 -0.05 0.00 0.00 57.45 56.62 3naf n PHE 545 Cb 0.03 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 38.51 3naf n PHE 545 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3naf s VAL 546 N -0.88 4.17 0.00 -4.37 1.01 -0.14 -2.74 120.40 117.45 3naf s VAL 546 Ca 0.13 1.66 0.00 0.00 0.00 0.00 0.00 61.98 63.77 3naf s VAL 546 Cb 0.07 -4.06 0.00 0.00 0.00 0.00 0.00 36.38 32.39 3naf s VAL 546 CO 0.10 0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.99 3naf n GLY 547 N 2.73 0.67 3.20 4.51 0.00 -0.14 -4.97 105.19 111.18 3naf n GLY 547 Ca 0.06 -0.64 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 3naf n GLY 547 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3naf s LEU 548 N 0.00 2.00 0.49 0.99 1.43 -1.11 -4.76 118.68 117.72 3naf s LEU 548 Ca 0.00 -0.45 -0.22 0.00 -1.03 0.00 0.00 54.13 52.42 3naf s LEU 548 Cb 0.00 -1.21 -0.08 0.00 0.03 0.00 0.00 46.19 44.93 3naf s LEU 548 CO 0.00 0.19 1.12 -1.54 0.23 0.00 0.00 176.35 176.35 3naf n SER 549 N 3.14 1.68 -0.21 2.29 3.41 -1.25 0.30 113.62 122.98 3naf n SER 549 Ca -0.18 0.98 0.02 0.00 -0.26 0.00 0.00 58.87 59.42 3naf n SER 549 Cb 0.52 -1.44 0.11 0.00 -0.26 0.00 0.00 64.21 63.15 3naf n SER 549 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 3naf h PHE 550 N 1.36 0.05 0.01 7.33 3.57 -1.52 -2.41 116.94 125.33 3naf h PHE 550 Ca -0.48 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.10 3naf h PHE 550 Cb 1.33 0.07 -0.05 0.00 2.79 0.00 0.00 35.95 40.10 3naf h PHE 550 CO 0.43 -0.13 -0.29 -1.00 -2.23 0.00 0.00 178.31 175.09 3naf h PRO 551 N 0.17 -0.43 -0.75 6.41 0.13 -1.79 0.50 132.00 136.23 3naf h PRO 551 Ca 0.34 0.03 0.10 0.00 -0.87 0.00 0.00 66.00 65.60 3naf h PRO 551 Cb 0.54 0.10 -0.05 0.00 0.13 0.00 0.00 31.00 31.72 3naf h PRO 551 CO -0.50 -0.29 0.49 1.79 -0.23 0.00 0.00 178.00 179.26 3naf h THR 552 N -0.45 0.92 0.00 1.56 1.35 -1.80 -0.97 112.91 113.52 3naf h THR 552 Ca 0.06 -0.21 -0.22 0.00 -0.55 0.00 0.00 66.41 65.48 3naf h THR 552 Cb 0.53 0.24 -0.03 0.00 -1.73 0.00 0.00 68.15 67.16 3naf h THR 552 CO -0.24 0.11 -1.20 0.58 -0.25 0.00 0.00 175.52 174.52 3naf h VAL 553 N 0.62 1.32 -0.47 6.82 2.07 -1.14 -2.79 116.25 122.69 3naf h VAL 553 Ca 0.35 -3.04 -0.10 0.00 0.82 0.00 0.00 66.70 64.73 3naf h VAL 553 Cb 0.51 2.64 -0.02 0.00 -1.52 0.00 0.00 31.29 32.91 3naf h VAL 553 CO -0.12 0.75 -0.12 0.00 0.02 0.00 0.00 177.57 178.09 3naf h GLU 555 N 0.78 0.35 -0.78 0.00 5.08 -1.32 -2.35 114.58 116.33 3naf h GLU 555 Ca 0.12 -0.17 0.17 0.00 -1.00 0.00 0.00 59.36 58.49 3naf h GLU 555 Cb 0.64 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.84 3naf h GLU 555 CO 0.04 0.71 0.53 1.25 -1.00 0.00 0.00 179.01 180.54 3naf h LEU 556 N -0.01 0.32 0.18 1.33 7.12 -1.21 0.47 115.31 123.51 3naf h LEU 556 Ca 0.03 0.02 -0.32 0.00 0.13 0.00 0.00 57.88 57.74 3naf h LEU 556 Cb 0.63 -0.04 0.01 0.00 -0.53 0.00 0.00 40.66 40.73 3naf h LEU 556 CO 0.03 0.15 -1.53 0.00 -0.13 0.00 0.00 178.44 176.96 3naf n PHE 558 N -3.59 0.00 -0.03 0.00 -0.00 -0.58 -1.13 117.46 112.13 3naf n PHE 558 Ca -0.17 0.00 -0.03 0.00 -0.00 0.00 0.00 57.45 57.25 3naf n PHE 558 Cb 1.07 -0.43 -0.04 0.00 -0.00 0.00 0.00 39.48 40.08 3naf n PHE 558 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 3naf n VAL 559 N -1.43 0.37 0.00 -2.13 0.31 0.05 -4.45 118.33 111.05 3naf n VAL 559 Ca 0.09 -0.23 0.04 0.00 -0.01 0.00 0.00 64.34 64.24 3naf n VAL 559 Cb 0.30 -0.85 -0.07 0.00 -0.91 0.00 0.00 33.84 32.32 3naf n VAL 559 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3naf n LYS 560 N -2.22 0.32 0.00 5.55 5.02 -0.90 -4.75 118.16 121.18 3naf n LYS 560 Ca -0.09 -0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.12 3naf n LYS 560 Cb 0.67 -1.20 0.00 0.00 -0.02 0.00 0.00 35.03 34.48 3naf n LYS 560 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3naf n LEU 561 N -1.79 0.00 -3.32 -0.35 4.77 -1.00 -4.80 117.00 110.52 3naf n LEU 561 Ca -0.02 -0.40 -0.17 0.00 -0.03 0.00 0.00 56.01 55.39 3naf n LEU 561 Cb 0.22 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.38 3naf n LEU 561 CO 0.18 0.00 0.02 1.17 -1.33 0.00 0.00 177.39 177.43 3naf n LYS 562 N -1.09 -2.36 -3.53 3.23 3.00 -0.30 -4.95 118.16 112.15 3naf n LYS 562 Ca 0.00 0.82 -0.22 0.00 -0.00 0.00 0.00 58.31 58.90 3naf n LYS 562 Cb 0.00 -5.62 -0.14 0.00 0.00 0.00 0.00 35.03 29.27 3naf n LYS 562 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 3naf s LEU 563 N -5.58 0.11 -0.71 3.14 1.43 -0.28 -4.86 118.68 111.92 3naf s LEU 563 Ca 0.44 -0.54 -0.27 0.00 -1.03 0.00 0.00 54.13 52.73 3naf s LEU 563 Cb -0.07 0.09 0.01 0.00 0.03 0.00 0.00 46.19 46.25 3naf s LEU 563 CO 0.76 -0.35 1.46 -0.22 0.23 0.00 0.00 176.35 178.22 3naf s LEU 564 N 2.24 3.20 -0.50 1.79 0.20 -1.26 -3.22 118.68 121.13 3naf s LEU 564 Ca 0.06 -0.24 -0.28 0.00 0.69 0.00 0.00 54.13 54.35 3naf s LEU 564 Cb -0.16 -2.55 0.03 0.00 -0.43 0.00 0.00 46.19 43.08 3naf s LEU 564 CO -0.16 -2.00 1.12 -0.32 -0.29 0.00 0.00 176.35 174.70 3naf s MET 565 N 6.12 3.65 0.13 1.98 -2.45 -1.26 -1.37 119.30 126.10 3naf s MET 565 Ca 0.45 0.44 0.18 0.00 -1.25 0.00 0.00 55.69 55.50 3naf s MET 565 Cb -0.09 -3.93 -0.07 0.00 1.25 0.00 0.00 34.83 31.98 3naf s MET 565 CO 0.16 -1.42 0.98 0.97 1.05 0.00 0.00 175.02 176.76 3naf h ILE 566 N 6.20 0.46 -1.83 10.11 6.09 -1.26 -3.48 117.51 133.81 3naf h ILE 566 Ca -0.24 -1.84 0.28 0.00 -1.37 0.00 0.00 64.86 61.70 3naf h ILE 566 Cb 1.06 2.00 -0.10 0.00 0.47 0.00 0.00 36.82 40.26 3naf h ILE 566 CO 1.13 0.26 0.75 0.00 -3.07 0.00 0.00 178.15 177.22 3naf s ALA 567 N -3.01 -2.10 0.04 0.18 0.00 -1.21 -2.70 121.76 112.96 3naf s ALA 567 Ca -0.01 0.37 -0.01 0.00 0.00 0.00 0.00 51.96 52.32 3naf s ALA 567 Cb 0.09 0.54 -0.03 0.00 0.00 0.00 0.00 23.12 23.71 3naf s ALA 567 CO 0.79 -1.07 -0.03 0.96 0.00 0.00 0.00 175.76 176.41 3naf s ILE 568 N -2.49 0.22 -0.03 0.00 -4.36 -0.56 -0.38 121.20 113.60 3naf s ILE 568 Ca 0.17 -1.56 -0.01 0.00 -0.26 0.00 0.00 60.65 58.99 3naf s ILE 568 Cb 0.02 -1.17 0.03 0.00 1.25 0.00 0.00 42.46 42.59 3naf s ILE 568 CO -0.01 -0.85 0.04 -0.70 0.24 0.00 0.00 174.94 173.66 3naf s GLU 569 N -3.20 -0.02 0.00 0.37 2.12 -0.30 -0.35 118.70 117.31 3naf s GLU 569 Ca 0.01 0.29 0.00 0.00 0.36 0.00 0.00 54.97 55.62 3naf s GLU 569 Cb 0.03 -0.43 0.00 0.00 0.26 0.00 0.00 34.13 33.99 3naf s GLU 569 CO -0.07 -0.26 0.00 2.48 -0.54 0.00 0.00 175.26 176.87 3naf n TYR 570 N 4.83 0.00 -3.73 5.30 0.18 -1.01 -1.35 117.16 121.39 3naf n TYR 570 Ca -0.14 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.27 3naf n TYR 570 Cb 0.50 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 39.34 3naf n TYR 570 CO 0.00 0.00 0.00 0.15 -2.08 0.00 0.00 176.86 174.93 3naf s LYS 571 N -1.37 2.91 -0.09 -3.48 3.01 -1.26 -0.73 119.74 118.72 3naf s LYS 571 Ca 0.00 -0.99 -0.00 0.00 -1.01 0.00 0.00 55.97 53.97 3naf s LYS 571 Cb 0.00 -3.47 -0.03 0.00 -1.01 0.00 0.00 37.83 33.32 3naf s LYS 571 CO 0.00 -0.55 -0.05 0.45 0.51 0.00 0.00 175.35 175.70 3naf s SER 572 N 1.48 4.74 1.90 2.83 0.15 0.10 -4.89 113.70 120.02 3naf s SER 572 Ca 0.01 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.64 3naf s SER 572 Cb -0.18 -1.34 0.00 0.00 -1.71 0.00 0.00 66.02 62.79 3naf s SER 572 CO 0.03 0.33 0.00 0.00 1.20 0.00 0.00 173.24 174.80 3naf n ALA 573 N 2.48 0.00 -3.04 5.45 0.00 -1.26 -3.83 120.51 120.31 3naf n ALA 573 Ca -0.18 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 52.90 3naf n ALA 573 Cb 0.53 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.86 3naf n ALA 573 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3naf s ASN 574 N -4.00 5.11 -1.63 0.00 4.22 -1.26 -4.74 114.94 112.64 3naf s ASN 574 Ca 0.00 -0.17 -0.20 0.00 -2.14 0.00 0.00 52.86 50.35 3naf s ASN 574 Cb 0.00 -1.90 0.20 0.00 1.28 0.00 0.00 41.25 40.82 3naf s ASN 574 CO 0.00 0.02 0.49 -2.11 -2.04 0.00 0.00 177.10 173.46 3naf n ARG 575 N 4.59 -0.76 -3.91 3.55 -4.01 -1.26 -4.90 116.66 109.95 3naf n ARG 575 Ca -0.16 0.12 -0.27 0.00 -1.04 0.00 0.00 57.85 56.49 3naf n ARG 575 Cb 0.52 -4.05 -0.17 0.00 -3.04 0.00 0.00 32.46 25.72 3naf n ARG 575 CO 0.00 0.00 0.00 -1.21 -3.04 0.00 0.00 177.63 173.38 3naf s GLU 576 N -6.46 1.55 0.53 2.89 2.02 -1.25 -5.03 118.70 112.95 3naf s GLU 576 Ca 0.69 -0.36 -0.19 0.00 0.02 0.00 0.00 54.97 55.13 3naf s GLU 576 Cb -0.40 -1.76 -0.07 0.00 0.10 0.00 0.00 34.13 32.01 3naf s GLU 576 CO 0.89 -0.32 1.06 -1.12 0.02 0.00 0.00 175.26 175.80 3naf s SER 577 N 1.67 6.06 -0.12 -0.19 0.01 -1.26 0.02 113.70 119.88 3naf s SER 577 Ca 0.04 1.95 -0.04 0.00 1.31 0.00 0.00 55.95 59.21 3naf s SER 577 Cb -0.13 -2.56 0.06 0.00 0.21 0.00 0.00 66.02 63.60 3naf s SER 577 CO -0.08 -0.98 0.23 -0.60 0.41 0.00 0.00 173.24 172.22 3naf s ARG 578 N -3.46 0.11 0.03 12.44 3.52 0.09 -0.47 118.95 131.21 3naf s ARG 578 Ca 0.67 0.69 -0.17 0.00 -0.13 0.00 0.00 55.73 56.80 3naf s ARG 578 Cb -0.18 -0.11 -0.06 0.00 -1.56 0.00 0.00 34.95 33.04 3naf s ARG 578 CO 0.26 -0.29 0.48 -1.50 -0.81 0.00 0.00 175.30 173.43 3naf s ILE 579 N 2.37 4.91 -0.08 4.11 2.07 -1.24 -2.40 121.20 130.94 3naf s ILE 579 Ca 0.02 0.99 -0.02 0.00 -1.41 0.00 0.00 60.65 60.23 3naf s ILE 579 Cb -0.12 -3.79 0.03 0.00 0.13 0.00 0.00 42.46 38.71 3naf s ILE 579 CO -0.08 0.56 0.02 -0.76 -1.91 0.00 0.00 174.94 172.77 3naf s LEU 580 N -1.12 0.54 -0.55 8.50 1.43 0.52 -4.91 118.68 123.10 3naf s LEU 580 Ca 0.26 -0.11 -0.22 0.00 -1.03 0.00 0.00 54.13 53.03 3naf s LEU 580 Cb -0.18 -0.40 0.06 0.00 0.03 0.00 0.00 46.19 45.70 3naf s LEU 580 CO 0.16 -0.21 0.81 -0.63 0.23 0.00 0.00 176.35 176.70 3naf s ILE 581 N 2.00 4.60 -0.84 -0.59 1.01 -1.26 -1.49 121.20 124.63 3naf s ILE 581 Ca 0.05 -0.19 -0.03 0.00 0.00 0.00 0.00 60.65 60.47 3naf s ILE 581 Cb -0.13 -4.46 -0.01 0.00 0.01 0.00 0.00 42.46 37.87 3naf s ILE 581 CO -0.05 -1.04 0.74 -3.20 0.00 0.00 0.00 174.94 171.38 3naf n ASN 582 N 6.92 -7.03 -4.38 3.58 4.05 -1.10 -4.45 115.26 112.85 3naf n ASN 582 Ca -0.03 -0.38 -0.29 0.00 0.45 0.00 0.00 54.58 54.33 3naf n ASN 582 Cb 0.46 -4.69 0.26 0.00 1.23 0.00 0.00 39.78 37.04 3naf n ASN 582 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 3naf n PRO 583 N -2.35 -2.66 -1.23 1.20 -0.02 -1.26 -4.82 135.00 123.86 3naf n PRO 583 Ca -0.06 -0.75 -0.01 0.00 -2.02 0.00 0.00 63.50 60.66 3naf n PRO 583 Cb 0.55 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 3naf n PRO 583 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3naf n GLY 584 N 1.25 2.28 0.35 -1.23 0.00 -1.26 -4.53 105.19 102.06 3naf n GLY 584 Ca 0.02 -2.15 0.16 0.00 0.00 0.00 0.00 46.02 44.06 3naf n GLY 584 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3naf h ASN 585 N 0.01 0.05 -0.29 1.61 4.21 -1.96 -2.81 115.58 116.41 3naf h ASN 585 Ca -0.01 0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.52 3naf h ASN 585 Cb 0.04 -0.01 -0.02 0.00 -1.12 0.00 0.00 38.32 37.21 3naf h ASN 585 CO 0.01 0.03 0.15 1.12 -1.29 0.00 0.00 177.43 177.46 3naf h HIS 586 N 0.06 0.28 -3.10 1.19 2.07 -1.99 -3.42 115.15 110.23 3naf h HIS 586 Ca 0.20 0.01 -0.57 0.00 -2.85 0.00 0.00 60.37 57.16 3naf h HIS 586 Cb 0.73 -0.09 -0.05 0.00 2.57 0.00 0.00 27.41 30.57 3naf h HIS 586 CO -0.00 0.16 0.89 -1.17 -3.07 0.00 0.00 177.93 174.74 3naf s LEU 587 N -10.22 4.02 0.21 6.12 2.96 -1.06 -4.96 118.68 115.76 3naf s LEU 587 Ca -0.13 1.35 -0.09 0.00 -0.22 0.00 0.00 54.13 55.03 3naf s LEU 587 Cb 0.10 -3.54 -0.07 0.00 0.50 0.00 0.00 46.19 43.18 3naf s LEU 587 CO 0.70 -0.86 0.52 -0.54 -1.32 0.00 0.00 176.35 174.86 3naf s LYS 588 N 3.66 3.79 0.39 1.98 -0.14 -1.26 -1.85 119.74 126.30 3naf s LYS 588 Ca 0.51 0.23 -0.24 0.00 -1.36 0.00 0.00 55.97 55.11 3naf s LYS 588 Cb -0.17 -2.69 -0.09 0.00 -1.68 0.00 0.00 37.83 33.20 3naf s LYS 588 CO 0.15 0.35 1.04 0.42 -0.76 0.00 0.00 175.35 176.55 3naf s ILE 589 N -1.77 3.80 0.28 2.17 1.01 0.15 -4.82 121.20 122.01 3naf s ILE 589 Ca 0.46 1.38 0.03 0.00 0.00 0.00 0.00 60.65 62.52 3naf s ILE 589 Cb -0.12 -3.72 0.03 0.00 0.01 0.00 0.00 42.46 38.67 3naf s ILE 589 CO 0.21 0.01 0.23 0.00 0.00 0.00 0.00 174.94 175.40 3naf n GLN 590 N -0.01 1.04 -3.05 2.79 6.02 -1.26 -0.97 117.38 121.95 3naf n GLN 590 Ca 0.05 -1.68 -0.35 0.00 -0.01 0.00 0.00 57.00 55.01 3naf n GLN 590 Cb 0.50 0.14 -0.06 0.00 1.02 0.00 0.00 30.24 31.83 3naf n GLN 590 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 3naf s GLU 591 N -3.15 4.21 -1.64 -1.09 -1.05 -1.26 -3.93 118.70 110.79 3naf s GLU 591 Ca 0.18 0.88 -0.00 0.00 -0.15 0.00 0.00 54.97 55.88 3naf s GLU 591 Cb -0.01 -2.65 0.00 0.00 -0.44 0.00 0.00 34.13 31.03 3naf s GLU 591 CO 0.11 0.26 0.02 0.41 0.95 0.00 0.00 175.26 177.02 3naf n GLY 592 N 0.20 -0.43 3.55 -3.83 0.00 -1.26 -4.90 105.19 98.52 3naf n GLY 592 Ca 0.01 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 3naf n GLY 592 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3naf s THR 593 N -2.97 4.90 0.49 2.61 -4.23 -1.25 -4.88 115.64 110.31 3naf s THR 593 Ca 0.01 0.38 -0.23 0.00 -1.18 0.00 0.00 61.69 60.67 3naf s THR 593 Cb -0.01 -4.09 -0.07 0.00 1.34 0.00 0.00 72.50 69.68 3naf s THR 593 CO 0.02 -0.38 1.27 -0.22 -0.54 0.00 0.00 174.62 174.76 3naf s LEU 594 N 2.67 3.98 0.07 4.79 0.20 -0.45 -2.59 118.68 127.35 3naf s LEU 594 Ca 0.22 2.56 0.09 0.00 0.69 0.00 0.00 54.13 57.69 3naf s LEU 594 Cb -0.15 -4.20 -0.03 0.00 -0.43 0.00 0.00 46.19 41.38 3naf s LEU 594 CO 0.16 -1.17 -0.22 -0.83 -0.29 0.00 0.00 176.35 174.00 3naf s GLY 595 N -1.08 1.56 -0.24 7.98 0.00 -0.65 -1.15 107.32 113.73 3naf s GLY 595 Ca 0.66 -1.29 -0.08 0.00 0.00 0.00 0.00 44.72 44.00 3naf s GLY 595 CO 0.42 -1.21 0.10 -1.36 0.00 0.00 0.00 173.10 171.05 3naf s PHE 596 N -0.96 3.15 0.02 1.90 0.40 0.49 -2.33 117.98 120.66 3naf s PHE 596 Ca 0.14 -0.18 0.07 0.00 -0.60 0.00 0.00 56.93 56.36 3naf s PHE 596 Cb -0.10 -2.24 -0.02 0.00 0.51 0.00 0.00 43.02 41.16 3naf s PHE 596 CO 0.06 -0.20 -0.20 -0.06 0.70 0.00 0.00 175.22 175.51 3naf s PHE 597 N 1.40 1.78 -0.88 0.36 0.08 0.11 -0.66 117.98 120.17 3naf s PHE 597 Ca 0.06 -0.36 0.00 0.00 0.12 0.00 0.00 56.93 56.75 3naf s PHE 597 Cb -0.15 -1.09 0.28 0.00 -0.57 0.00 0.00 43.02 41.50 3naf s PHE 597 CO 0.05 0.05 1.17 -0.89 -0.10 0.00 0.00 175.22 175.49 3naf n ILE 598 N 2.11 4.05 -2.75 0.64 5.41 -0.47 -0.90 119.36 127.45 3naf n ILE 598 Ca -0.16 -5.63 -0.10 0.00 1.00 0.00 0.00 62.75 57.85 3naf n ILE 598 Cb 0.53 -2.07 0.04 0.00 -0.71 0.00 0.00 39.64 37.44 3naf n ILE 598 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3naf n ALA 599 N 1.07 0.37 -2.47 -1.39 0.00 -1.23 -4.35 120.51 112.51 3naf n ALA 599 Ca 0.28 -0.99 -0.17 0.00 0.00 0.00 0.00 53.44 52.56 3naf n ALA 599 Cb 0.36 0.22 -0.11 0.00 0.00 0.00 0.00 19.45 19.93 3naf n ALA 599 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3naf s SER 600 N -2.86 1.83 0.00 0.00 1.04 -1.26 -2.08 113.70 110.37 3naf s SER 600 Ca 0.31 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.91 3naf s SER 600 Cb -0.02 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.06 3naf s SER 600 CO 0.20 -0.19 0.00 -0.67 0.98 0.00 0.00 173.24 173.56 3naf n ASP 601 N 0.48 0.00 0.00 7.02 -0.08 -1.26 -4.15 116.55 118.56 3naf n ASP 601 Ca -0.15 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.13 3naf n ASP 601 Cb 0.57 -0.72 0.00 0.00 2.34 0.00 0.00 41.12 43.31 3naf n ASP 601 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3naf n ALA 602 N 0.64 0.00 0.04 -1.67 0.00 -1.26 -4.74 120.51 113.52 3naf n ALA 602 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 3naf n ALA 602 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 3naf n ALA 602 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3naf h LYS 603 N 0.24 -0.03 -1.03 0.00 1.57 -2.01 -3.14 116.57 112.17 3naf h LYS 603 Ca 0.00 0.00 0.27 0.00 -1.87 0.00 0.00 60.65 59.06 3naf h LYS 603 Cb 0.00 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.25 3naf h LYS 603 CO 0.00 0.11 0.69 0.93 -0.57 0.00 0.00 179.45 180.61 3naf h GLU 604 N -0.17 0.25 -0.04 3.15 4.39 -1.85 -1.21 114.58 119.10 3naf h GLU 604 Ca -0.00 -0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.63 3naf h GLU 604 Cb 0.16 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 3naf h GLU 604 CO 0.01 0.16 -0.20 -0.24 -1.16 0.00 0.00 179.01 177.58 3naf h VAL 605 N 0.26 1.17 0.00 3.13 3.04 -1.86 -1.91 116.25 120.07 3naf h VAL 605 Ca 0.55 -0.78 -0.01 0.00 -1.01 0.00 0.00 66.70 65.45 3naf h VAL 605 Cb 1.65 1.37 -0.00 0.00 -2.01 0.00 0.00 31.29 32.30 3naf h VAL 605 CO -0.18 0.23 -0.06 0.11 -1.01 0.00 0.00 177.57 176.66 3naf h LYS 606 N 0.05 0.00 -0.68 4.17 1.79 -1.38 -2.78 116.57 117.74 3naf h LYS 606 Ca 0.01 0.00 0.13 0.00 -2.18 0.00 0.00 60.65 58.61 3naf h LYS 606 Cb 0.39 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 30.95 3naf h LYS 606 CO 0.03 0.06 0.21 0.00 -1.08 0.00 0.00 179.45 178.67 3naf h ARG 607 N 0.00 0.34 0.00 3.15 3.08 -1.49 0.99 114.38 120.45 3naf h ARG 607 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3naf h ARG 607 Cb 0.14 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3naf h ARG 607 CO 0.01 0.22 0.00 0.00 -1.07 0.00 0.00 179.97 179.13 3naf n ALA 608 N -2.56 1.37 0.05 0.04 0.00 -1.05 -2.14 120.51 116.22 3naf n ALA 608 Ca 0.12 -0.03 -0.20 0.00 0.00 0.00 0.00 53.44 53.33 3naf n ALA 608 Cb 0.37 -1.11 -0.14 0.00 0.00 0.00 0.00 19.45 18.57 3naf n ALA 608 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3naf h PHE 609 N 0.00 0.55 -3.55 0.00 3.57 -0.83 -1.84 116.94 114.84 3naf h PHE 609 Ca 0.00 -0.40 -0.62 0.00 3.53 0.00 0.00 57.97 60.48 3naf h PHE 609 Cb 0.10 -0.02 -0.39 0.00 2.79 0.00 0.00 35.95 38.43 3naf h PHE 609 CO 0.00 1.55 -0.76 -0.59 -2.23 0.00 0.00 178.31 176.28 3naf s PHE 610 N -2.59 2.67 0.50 0.41 -0.12 -0.91 -3.93 117.98 114.01 3naf s PHE 610 Ca -0.14 -2.13 0.04 0.00 -0.05 0.00 0.00 56.93 54.65 3naf s PHE 610 Cb 0.06 -2.01 -0.00 0.00 -0.63 0.00 0.00 43.02 40.44 3naf s PHE 610 CO 0.84 -0.85 0.18 -0.47 -0.05 0.00 0.00 175.22 174.86 3naf s TYR 611 N 1.29 1.94 0.23 3.49 5.04 -1.26 -4.86 117.35 123.23 3naf s TYR 611 Ca 0.02 -0.84 0.00 0.00 -2.44 0.00 0.00 57.07 53.82 3naf s TYR 611 Cb -0.19 -1.79 0.00 0.00 0.35 0.00 0.00 41.96 40.34 3naf s TYR 611 CO -0.11 -0.02 0.00 0.00 -1.34 0.00 0.00 175.55 174.08 3naf n LYS 613 N -3.34 1.58 -1.99 0.00 4.76 -1.26 -4.69 118.16 113.22 3naf n LYS 613 Ca -0.02 -1.08 -0.41 0.00 -2.87 0.00 0.00 58.31 53.94 3naf n LYS 613 Cb 0.33 -1.47 -0.02 0.00 -1.84 0.00 0.00 35.03 32.03 3naf n LYS 613 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3naf s ALA 614 N -1.24 3.59 0.63 7.82 0.00 -1.26 -4.76 121.76 126.54 3naf s ALA 614 Ca 0.20 1.37 -0.00 0.00 0.00 0.00 0.00 51.96 53.53 3naf s ALA 614 Cb 0.17 -3.55 0.10 0.00 0.00 0.00 0.00 23.12 19.84 3naf s ALA 614 CO 0.04 -0.79 0.69 0.00 0.00 0.00 0.00 175.76 175.70 3naf n HIS 616 N -2.40 -0.20 0.00 0.00 1.44 -1.26 -5.12 115.22 107.68 3naf n HIS 616 Ca 0.11 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.82 3naf n HIS 616 Cb 0.41 -2.06 0.00 0.00 0.12 0.00 0.00 29.99 28.46 3naf n HIS 616 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3naf n SER 659 N 1.83 -3.05 -4.63 0.00 7.64 -1.26 -5.24 113.62 108.92 3naf n SER 659 Ca 0.22 0.38 -0.41 0.00 1.01 0.00 0.00 58.87 60.07 3naf n SER 659 Cb 0.36 -0.61 0.02 0.00 -1.01 0.00 0.00 64.21 62.97 3naf n SER 659 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3naf n PRO 660 N 1.60 1.42 -3.81 1.43 -0.02 -1.26 -5.00 135.00 129.36 3naf n PRO 660 Ca 0.00 0.51 -0.30 0.00 -2.02 0.00 0.00 63.50 61.70 3naf n PRO 660 Cb 0.00 -2.13 -0.13 0.00 -0.02 0.00 0.00 33.50 31.22 3naf n PRO 660 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3naf s LYS 661 N -2.15 1.58 0.15 -0.52 1.02 -1.26 -5.00 119.74 113.56 3naf s LYS 661 Ca 0.64 -2.26 -0.24 0.00 0.02 0.00 0.00 55.97 54.13 3naf s LYS 661 Cb -0.53 -2.75 0.07 0.00 -0.52 0.00 0.00 37.83 34.10 3naf s LYS 661 CO 0.56 -1.14 0.65 -1.17 -0.92 0.00 0.00 175.35 173.33 3naf s LEU 662 N 0.09 -0.52 -0.06 3.17 0.20 -1.26 -4.81 118.68 115.48 3naf s LEU 662 Ca 0.17 -0.05 0.04 0.00 0.69 0.00 0.00 54.13 54.99 3naf s LEU 662 Cb -0.25 2.53 0.00 0.00 -0.43 0.00 0.00 46.19 48.04 3naf s LEU 662 CO 0.00 -0.95 -0.19 -0.32 -0.29 0.00 0.00 176.35 174.60 3naf s MET 663 N -3.68 2.17 -0.05 1.98 -2.45 0.38 -4.88 119.30 112.77 3naf s MET 663 Ca 0.02 -0.67 -0.02 0.00 -1.25 0.00 0.00 55.69 53.77 3naf s MET 663 Cb -0.01 -1.78 0.03 0.00 1.25 0.00 0.00 34.83 34.32 3naf s MET 663 CO -0.11 0.20 0.05 0.50 1.05 0.00 0.00 175.02 176.71 3naf s ARG 664 N 0.23 0.08 0.09 4.11 3.00 -1.26 -3.61 118.95 121.58 3naf s ARG 664 Ca -0.10 0.30 -0.31 0.00 -1.00 0.00 0.00 55.73 54.63 3naf s ARG 664 Cb -0.14 -0.66 -0.06 0.00 0.00 0.00 0.00 34.95 34.09 3naf s ARG 664 CO 0.04 -0.34 1.21 -3.38 0.00 0.00 0.00 175.30 172.84 3naf s HIS 665 N 2.12 3.42 0.00 5.12 -3.43 -1.26 -4.91 115.29 116.36 3naf s HIS 665 Ca 0.05 1.30 0.00 0.00 -0.80 0.00 0.00 55.06 55.61 3naf s HIS 665 Cb -0.12 -3.44 0.00 0.00 -1.43 0.00 0.00 32.58 27.59 3naf s HIS 665 CO -0.04 -1.35 0.00 -0.40 -2.00 0.00 0.00 174.74 170.96 3naf n ASP 666 N 3.66 0.00 0.00 7.38 5.68 -1.26 -4.90 116.55 127.11 3naf n ASP 666 Ca 0.08 -0.40 0.00 0.00 -0.50 0.00 0.00 54.79 53.97 3naf n ASP 666 Cb 0.46 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.44 3naf n ASP 666 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3naf n LYS 684 N 0.00 0.00 -0.01 0.11 4.76 0.34 -5.10 118.16 118.27 3naf n LYS 684 Ca 0.00 0.00 0.11 0.00 -2.87 0.00 0.00 58.31 55.55 3naf n LYS 684 Cb 0.00 0.00 -0.17 0.00 -1.84 0.00 0.00 35.03 33.02 3naf n LYS 684 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3naf n LYS 685 N 0.00 0.66 -3.45 1.97 5.02 -1.26 -4.53 118.16 116.56 3naf n LYS 685 Ca 0.00 -0.19 -0.17 0.00 -2.02 0.00 0.00 58.31 55.93 3naf n LYS 685 Cb 0.00 -1.53 -0.04 0.00 -0.02 0.00 0.00 35.03 33.44 3naf n LYS 685 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3naf n TYR 686 N -2.27 0.52 -3.22 2.13 4.01 -1.26 -2.07 117.16 115.00 3naf n TYR 686 Ca -0.04 -1.41 -0.21 0.00 -0.16 0.00 0.00 57.90 56.08 3naf n TYR 686 Cb 0.57 -0.14 0.05 0.00 -0.31 0.00 0.00 39.34 39.51 3naf n TYR 686 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3naf n ASP 687 N -1.31 2.27 -0.06 7.72 5.68 -1.00 -1.55 116.55 128.30 3naf n ASP 687 Ca -0.10 -2.63 -0.13 0.00 -0.50 0.00 0.00 54.79 51.44 3naf n ASP 687 Cb 0.35 -0.35 -0.07 0.00 -1.14 0.00 0.00 41.12 39.91 3naf n ASP 687 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 3naf h SER 688 N 0.22 -1.53 0.75 -1.12 4.64 -1.61 -0.11 113.55 114.78 3naf h SER 688 Ca -0.29 0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 3naf h SER 688 Cb 1.27 0.63 0.00 0.00 -0.31 0.00 0.00 62.40 63.99 3naf h SER 688 CO 0.43 -0.42 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 3naf h THR 689 N -0.46 0.00 -2.79 2.95 1.03 -1.96 -3.45 112.91 108.23 3naf h THR 689 Ca 0.08 -0.30 -0.18 0.00 -0.01 0.00 0.00 66.41 66.00 3naf h THR 689 Cb 0.63 1.13 0.05 0.00 -1.07 0.00 0.00 68.15 68.88 3naf h THR 689 CO -0.49 0.00 -0.29 0.61 -0.01 0.00 0.00 175.52 175.34 3naf n GLY 690 N -0.13 0.23 0.00 2.99 0.00 -0.05 -4.79 105.19 103.45 3naf n GLY 690 Ca 0.01 -0.31 0.02 0.00 0.00 0.00 0.00 46.02 45.74 3naf n GLY 690 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3naf n MET 691 N -2.38 5.70 -3.94 1.61 2.81 -1.26 -4.31 117.12 115.35 3naf n MET 691 Ca -0.02 -0.02 -0.09 0.00 -1.81 0.00 0.00 57.70 55.77 3naf n MET 691 Cb 0.54 -0.67 -0.09 0.00 -0.71 0.00 0.00 33.22 32.28 3naf n MET 691 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 3naf s PHE 692 N -1.31 0.25 -0.21 2.03 0.40 -1.24 -3.03 117.98 114.88 3naf s PHE 692 Ca 0.01 -0.65 -0.29 0.00 -0.60 0.00 0.00 56.93 55.41 3naf s PHE 692 Cb 0.03 -0.17 -0.01 0.00 0.51 0.00 0.00 43.02 43.38 3naf s PHE 692 CO 0.14 -0.42 1.23 -1.01 0.70 0.00 0.00 175.22 175.86 3naf s HIS 693 N -3.28 2.90 0.25 0.36 3.76 0.17 -2.36 115.29 117.09 3naf s HIS 693 Ca 0.01 1.06 0.10 0.00 -0.15 0.00 0.00 55.06 56.07 3naf s HIS 693 Cb 0.03 -3.56 -0.04 0.00 1.11 0.00 0.00 32.58 30.11 3naf s HIS 693 CO -0.08 -1.48 -0.10 -0.46 -0.85 0.00 0.00 174.74 171.77 3naf s TRP 694 N 3.65 2.54 0.01 1.40 -0.00 -0.88 -4.46 118.94 121.20 3naf s TRP 694 Ca 0.53 -0.26 -0.28 0.00 -0.00 0.00 0.00 56.10 56.09 3naf s TRP 694 Cb -0.19 -1.15 0.10 0.00 -0.00 0.00 0.00 33.47 32.22 3naf s TRP 694 CO 0.15 0.62 0.82 0.00 -0.00 0.00 0.00 176.95 178.54 3naf n ALA 696 N -0.06 -1.25 -1.67 0.00 0.00 -1.26 -4.57 120.51 111.69 3naf n ALA 696 Ca -0.11 0.45 -0.45 0.00 0.00 0.00 0.00 53.44 53.32 3naf n ALA 696 Cb 0.62 -1.92 -0.04 0.00 0.00 0.00 0.00 19.45 18.11 3naf n ALA 696 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3naf n PRO 697 N 1.27 2.50 -3.53 0.00 -0.02 -1.26 -4.78 135.00 129.19 3naf n PRO 697 Ca 0.14 0.92 -0.35 0.00 -2.02 0.00 0.00 63.50 62.19 3naf n PRO 697 Cb 0.26 -2.80 -0.06 0.00 -0.02 0.00 0.00 33.50 30.88 3naf n PRO 697 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3naf s LYS 698 N 3.80 3.81 0.37 -0.52 1.02 -1.00 -5.02 119.74 122.20 3naf s LYS 698 Ca 0.89 0.25 -0.27 0.00 0.02 0.00 0.00 55.97 56.87 3naf s LYS 698 Cb -0.57 -3.00 -0.09 0.00 -0.52 0.00 0.00 37.83 33.65 3naf s LYS 698 CO 0.45 0.55 1.23 -2.00 -0.92 0.00 0.00 175.35 174.66 3naf s GLU 699 N -1.87 4.20 0.49 1.68 2.56 -1.26 -4.88 118.70 119.63 3naf s GLU 699 Ca 0.33 2.01 0.19 0.00 0.00 0.00 0.00 54.97 57.50 3naf s GLU 699 Cb -0.14 -2.87 1.23 0.00 2.00 0.00 0.00 34.13 34.34 3naf s GLU 699 CO 0.18 -0.25 2.04 0.97 -0.56 0.00 0.00 175.26 177.64 3naf h ILE 700 N 2.66 0.87 0.00 -3.70 6.09 -1.99 0.19 117.51 121.64 3naf h ILE 700 Ca -0.49 -0.05 -0.02 0.00 -1.37 0.00 0.00 64.86 62.93 3naf h ILE 700 Cb 1.23 0.72 -0.00 0.00 0.47 0.00 0.00 36.82 39.23 3naf h ILE 700 CO 0.64 0.03 -0.10 -0.33 -3.07 0.00 0.00 178.15 175.31 3naf h GLU 701 N 0.14 0.00 0.00 2.19 3.07 -1.97 -2.59 114.58 115.42 3naf h GLU 701 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 3naf h GLU 701 Cb 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 3naf h GLU 701 CO -0.02 0.10 0.00 1.63 -1.40 0.00 0.00 179.01 179.32 3naf n LYS 702 N -3.29 0.87 0.00 2.33 5.02 0.68 -3.79 118.16 119.98 3naf n LYS 702 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3naf n LYS 702 Cb 0.32 -1.06 0.00 0.00 -0.02 0.00 0.00 35.03 34.27 3naf n LYS 702 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3naf n VAL 703 N -0.56 0.00 -1.65 -0.18 0.31 -0.99 -4.98 118.33 110.29 3naf n VAL 703 Ca 0.02 0.00 -0.47 0.00 -0.01 0.00 0.00 64.34 63.89 3naf n VAL 703 Cb 0.01 -0.34 -0.04 0.00 -0.91 0.00 0.00 33.84 32.56 3naf n VAL 703 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3naf n ILE 704 N -1.51 0.56 -2.68 2.52 5.41 -1.15 -3.77 119.36 118.73 3naf n ILE 704 Ca 0.00 -0.17 -0.24 0.00 1.00 0.00 0.00 62.75 63.34 3naf n ILE 704 Cb 0.22 -2.04 0.03 0.00 -0.71 0.00 0.00 39.64 37.13 3naf n ILE 704 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3naf s LEU 705 N 5.03 3.40 0.36 1.39 2.01 -0.96 -4.99 118.68 124.91 3naf s LEU 705 Ca 0.95 0.39 0.08 0.00 0.01 0.00 0.00 54.13 55.56 3naf s LEU 705 Cb -0.61 -3.24 -0.05 0.00 0.01 0.00 0.00 46.19 42.31 3naf s LEU 705 CO 0.47 -0.95 0.13 0.42 1.01 0.00 0.00 176.35 177.44 3naf s THR 706 N -2.78 2.81 0.33 5.49 -4.23 -1.26 -4.33 115.64 111.67 3naf s THR 706 Ca 0.52 -1.74 0.05 0.00 -1.18 0.00 0.00 61.69 59.35 3naf s THR 706 Cb -0.10 -2.95 0.30 0.00 1.34 0.00 0.00 72.50 71.09 3naf s THR 706 CO 0.41 -0.15 1.89 -0.09 -0.54 0.00 0.00 174.62 176.14 3naf h ARG 707 N 1.56 0.81 -0.16 3.99 2.43 -1.98 0.21 114.38 121.25 3naf h ARG 707 Ca -0.43 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 58.64 3naf h ARG 707 Cb 1.25 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.62 3naf h ARG 707 CO 0.65 0.54 -0.08 0.77 -1.51 0.00 0.00 179.97 180.34 3naf h SER 708 N 0.84 0.36 -0.42 -3.80 0.02 -1.98 0.09 113.55 108.65 3naf h SER 708 Ca 0.42 -0.41 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 3naf h SER 708 Cb 0.47 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.89 3naf h SER 708 CO -0.18 0.69 0.05 -0.33 -1.14 0.00 0.00 176.83 175.92 3naf h GLU 709 N 0.02 0.78 -0.02 3.45 5.08 -1.80 -1.94 114.58 120.15 3naf h GLU 709 Ca 0.04 -0.19 -0.14 0.00 -1.00 0.00 0.00 59.36 58.06 3naf h GLU 709 Cb 0.56 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 3naf h GLU 709 CO 0.02 0.76 -0.65 0.00 -1.00 0.00 0.00 179.01 178.14 3naf h ALA 710 N 1.31 0.87 -0.02 3.43 0.00 -0.47 -2.09 119.26 122.29 3naf h ALA 710 Ca 0.15 -0.58 -0.13 0.00 0.00 0.00 0.00 54.91 54.35 3naf h ALA 710 Cb 0.38 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3naf h ALA 710 CO 0.01 0.79 -0.60 0.00 0.00 0.00 0.00 179.25 179.44 3naf h ALA 711 N 1.26 0.96 -0.18 0.00 0.00 -0.71 -3.20 119.26 117.39 3naf h ALA 711 Ca -0.01 -0.55 -0.16 0.00 0.00 0.00 0.00 54.91 54.19 3naf h ALA 711 Cb 1.16 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3naf h ALA 711 CO 0.09 0.75 -0.52 0.52 0.00 0.00 0.00 179.25 180.09 3naf h MET 712 N 0.05 0.67 -5.53 0.00 2.07 -1.04 -3.43 114.93 107.71 3naf h MET 712 Ca -0.01 -0.48 -0.60 0.00 -2.07 0.00 0.00 59.70 56.55 3naf h MET 712 Cb 1.08 0.08 -0.11 0.00 -1.87 0.00 0.00 31.60 30.78 3naf h MET 712 CO 0.08 1.10 -0.03 0.99 1.07 0.00 0.00 176.91 180.12 3naf s THR 713 N -3.90 5.10 -0.26 2.22 2.01 -0.81 -5.06 115.64 114.94 3naf s THR 713 Ca -0.12 0.95 -0.11 0.00 0.31 0.00 0.00 61.69 62.72 3naf s THR 713 Cb 0.07 -3.84 -0.05 0.00 0.01 0.00 0.00 72.50 68.69 3naf s THR 713 CO 0.85 0.17 0.21 0.54 -0.69 0.00 0.00 174.62 175.70 3naf s VAL 714 N 1.69 5.31 0.12 3.82 0.11 -1.26 -4.81 120.40 125.38 3naf s VAL 714 Ca 0.24 0.25 0.11 0.00 -2.93 0.00 0.00 61.98 59.64 3naf s VAL 714 Cb -0.15 -3.55 -0.04 0.00 -1.53 0.00 0.00 36.38 31.11 3naf s VAL 714 CO 0.10 0.28 -0.27 -1.48 -3.33 0.00 0.00 175.10 170.39 3naf s LEU 715 N 1.49 2.31 0.05 2.54 0.05 -1.26 -5.15 118.68 118.71 3naf s LEU 715 Ca 0.09 -0.73 -0.03 0.00 0.05 0.00 0.00 54.13 53.50 3naf s LEU 715 Cb -0.15 -1.22 -0.03 0.00 -2.05 0.00 0.00 46.19 42.74 3naf s LEU 715 CO 0.08 0.19 0.03 -0.94 -0.55 0.00 0.00 176.35 175.16 3naf s SER 716 N -1.98 0.34 -1.24 1.48 1.04 -1.26 -4.79 113.70 107.30 3naf s SER 716 Ca 0.14 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.76 3naf s SER 716 Cb -0.10 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.24 3naf s SER 716 CO 0.06 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.31 3naf n GLY 717 N 0.36 1.03 4.00 7.32 0.00 -1.05 -4.96 105.19 111.89 3naf n GLY 717 Ca -0.16 -0.45 -0.19 0.00 0.00 0.00 0.00 46.02 45.22 3naf n GLY 717 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3naf s HIS 718 N -2.48 2.48 -0.35 1.61 -0.00 -1.26 -4.50 115.29 110.78 3naf s HIS 718 Ca 0.00 -0.33 -0.08 0.00 -0.00 0.00 0.00 55.06 54.66 3naf s HIS 718 Cb 0.00 -2.52 0.04 0.00 -0.00 0.00 0.00 32.58 30.10 3naf s HIS 718 CO 0.00 -0.80 0.14 0.08 -0.00 0.00 0.00 174.74 174.16 3naf s VAL 719 N -2.60 4.00 -0.47 -5.38 1.01 -1.17 -1.59 120.40 114.20 3naf s VAL 719 Ca 0.58 -1.08 -0.19 0.00 0.00 0.00 0.00 61.98 61.29 3naf s VAL 719 Cb -0.09 -3.27 0.04 0.00 0.00 0.00 0.00 36.38 33.06 3naf s VAL 719 CO 0.37 -0.21 0.60 -0.69 0.00 0.00 0.00 175.10 175.16 3naf s VAL 720 N 1.44 4.90 -0.75 2.92 1.01 -1.06 -1.05 120.40 127.82 3naf s VAL 720 Ca -0.01 -0.24 -0.19 0.00 0.00 0.00 0.00 61.98 61.54 3naf s VAL 720 Cb -0.20 -4.22 0.12 0.00 0.00 0.00 0.00 36.38 32.09 3naf s VAL 720 CO 0.04 -0.66 0.91 -0.69 0.00 0.00 0.00 175.10 174.70 3naf s VAL 721 N 2.61 4.78 -0.60 2.92 1.01 -0.97 0.01 120.40 130.16 3naf s VAL 721 Ca 0.17 -1.23 -0.26 0.00 0.00 0.00 0.00 61.98 60.66 3naf s VAL 721 Cb -0.17 -4.63 0.04 0.00 0.00 0.00 0.00 36.38 31.62 3naf s VAL 721 CO 0.15 -1.31 1.10 0.00 0.00 0.00 0.00 175.10 175.04 3naf s ILE 723 N 4.66 4.32 -0.89 0.00 1.01 -0.28 -1.88 121.20 128.15 3naf s ILE 723 Ca 0.36 -0.24 -0.12 0.00 0.00 0.00 0.00 60.65 60.64 3naf s ILE 723 Cb -0.10 -2.82 0.23 0.00 0.01 0.00 0.00 42.46 39.78 3naf s ILE 723 CO 0.21 0.60 0.84 -0.36 0.00 0.00 0.00 174.94 176.22 3naf s PHE 724 N -0.82 3.87 0.48 3.97 0.40 -1.04 -4.26 117.98 120.58 3naf s PHE 724 Ca 0.13 -2.19 0.00 0.00 -0.60 0.00 0.00 56.93 54.27 3naf s PHE 724 Cb -0.11 -3.80 0.09 0.00 0.51 0.00 0.00 43.02 39.71 3naf s PHE 724 CO 0.02 -0.97 0.65 0.41 0.70 0.00 0.00 175.22 176.03 3naf n GLY 725 N 3.65 0.74 3.63 4.36 0.00 -1.26 -3.46 105.19 112.85 3naf n GLY 725 Ca 0.16 -2.01 -0.10 0.00 0.00 0.00 0.00 46.02 44.07 3naf n GLY 725 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3naf s ASP 726 N -3.67 -0.46 0.28 1.61 2.15 -1.26 -4.85 116.67 110.48 3naf s ASP 726 Ca 0.43 0.87 0.02 0.00 0.43 0.00 0.00 52.55 54.31 3naf s ASP 726 Cb -0.02 0.88 0.69 0.00 -0.30 0.00 0.00 42.92 44.16 3naf s ASP 726 CO 0.29 -0.17 1.69 1.62 -0.17 0.00 0.00 175.17 178.43 3naf h VAL 727 N 3.56 0.46 -3.41 1.11 3.04 -1.97 -3.16 116.25 115.89 3naf h VAL 727 Ca -0.28 -0.12 -0.64 0.00 -1.01 0.00 0.00 66.70 64.65 3naf h VAL 727 Cb 1.17 0.07 -0.41 0.00 -2.01 0.00 0.00 31.29 30.11 3naf h VAL 727 CO 0.12 0.07 -0.65 -0.94 -1.01 0.00 0.00 177.57 175.15 3naf s SER 728 N -5.18 4.35 -0.10 3.17 1.04 -1.26 -4.74 113.70 110.99 3naf s SER 728 Ca -0.12 -2.83 -0.22 0.00 0.48 0.00 0.00 55.95 53.26 3naf s SER 728 Cb 0.25 -1.60 0.05 0.00 0.10 0.00 0.00 66.02 64.82 3naf s SER 728 CO 0.78 -0.26 0.53 -0.55 0.98 0.00 0.00 173.24 174.71 3naf s SER 729 N -0.03 -0.49 -0.20 7.02 0.15 -1.19 -5.11 113.70 113.85 3naf s SER 729 Ca 0.16 0.68 -0.38 0.00 0.70 0.00 0.00 55.95 57.11 3naf s SER 729 Cb -0.25 0.69 -0.14 0.00 -1.71 0.00 0.00 66.02 64.61 3naf s SER 729 CO -0.02 -0.41 1.78 0.00 1.20 0.00 0.00 173.24 175.79 3naf n ALA 730 N 1.72 0.15 -1.96 5.45 0.00 -1.24 -4.86 120.51 119.77 3naf n ALA 730 Ca -0.18 0.36 -0.43 0.00 0.00 0.00 0.00 53.44 53.20 3naf n ALA 730 Cb 0.56 -2.31 -0.03 0.00 0.00 0.00 0.00 19.45 17.68 3naf n ALA 730 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3naf s LEU 731 N 3.59 4.06 0.19 0.00 1.43 -1.26 -4.76 118.68 121.93 3naf s LEU 731 Ca 0.96 2.00 -0.13 0.00 -1.03 0.00 0.00 54.13 55.93 3naf s LEU 731 Cb -0.94 -3.53 0.19 0.00 0.03 0.00 0.00 46.19 41.94 3naf s LEU 731 CO 0.60 -1.20 1.71 0.40 0.23 0.00 0.00 176.35 178.10 3naf h ILE 732 N 6.00 0.71 -0.24 -0.59 2.04 -1.93 -3.47 117.51 120.03 3naf h ILE 732 Ca -0.39 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.40 3naf h ILE 732 Cb 1.18 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 3naf h ILE 732 CO 0.97 0.04 0.00 0.61 0.00 0.00 0.00 178.15 179.77 3naf n GLY 733 N -1.29 0.75 0.30 5.37 0.00 -1.26 -4.90 105.19 104.16 3naf n GLY 733 Ca 0.06 -0.49 0.19 0.00 0.00 0.00 0.00 46.02 45.78 3naf n GLY 733 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3naf h LEU 734 N 0.00 0.00 -1.07 0.99 3.38 -1.92 -1.99 115.31 114.70 3naf h LEU 734 Ca 0.00 0.00 0.40 0.00 0.09 0.00 0.00 57.88 58.37 3naf h LEU 734 Cb 0.09 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.68 3naf h LEU 734 CO 0.00 0.02 0.60 -0.09 0.09 0.00 0.00 178.44 179.06 3naf h ARG 735 N 0.00 0.09 0.00 1.13 2.43 -1.91 0.54 114.38 116.66 3naf h ARG 735 Ca -0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3naf h ARG 735 Cb 0.25 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 3naf h ARG 735 CO 0.00 0.06 0.00 0.09 -1.51 0.00 0.00 179.97 178.61 3naf n ASN 736 N -5.11 0.42 -0.04 -3.80 3.02 -0.75 -1.41 115.26 107.58 3naf n ASN 736 Ca 0.36 0.55 -0.22 0.00 -0.03 0.00 0.00 54.58 55.25 3naf n ASN 736 Cb 1.24 -0.66 -0.13 0.00 -0.61 0.00 0.00 39.78 39.62 3naf n ASN 736 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3naf h LEU 737 N 0.00 0.22 0.04 3.41 5.85 -0.13 -3.23 115.31 121.48 3naf h LEU 737 Ca 0.00 -0.74 -0.07 0.00 0.84 0.00 0.00 57.88 57.90 3naf h LEU 737 Cb 0.56 -0.07 0.01 0.00 0.37 0.00 0.00 40.66 41.52 3naf h LEU 737 CO 0.00 1.65 -0.32 0.58 -0.34 0.00 0.00 178.44 180.01 3naf h VAL 738 N -0.48 1.64 -0.91 1.05 2.07 -1.39 -3.28 116.25 114.95 3naf h VAL 738 Ca -0.36 -2.28 0.25 0.00 0.82 0.00 0.00 66.70 65.13 3naf h VAL 738 Cb 1.65 3.14 -0.15 0.00 -1.52 0.00 0.00 31.29 34.41 3naf h VAL 738 CO -0.05 0.62 0.20 -0.03 0.02 0.00 0.00 177.57 178.32 3naf h MET 739 N -0.66 0.14 0.54 1.57 1.85 -1.48 0.55 114.93 117.44 3naf h MET 739 Ca -0.05 -0.01 -0.03 0.00 -0.61 0.00 0.00 59.70 59.00 3naf h MET 739 Cb 1.19 -0.03 0.01 0.00 0.43 0.00 0.00 31.60 33.20 3naf h MET 739 CO 0.06 0.09 -0.26 -1.35 -0.40 0.00 0.00 176.91 175.05 3naf h PRO 740 N 0.14 -0.70 -1.16 0.39 0.11 -1.79 -1.99 132.00 126.99 3naf h PRO 740 Ca 0.58 0.05 0.33 0.00 0.11 0.00 0.00 66.00 67.07 3naf h PRO 740 Cb 1.20 0.16 -0.06 0.00 0.11 0.00 0.00 31.00 32.42 3naf h PRO 740 CO -0.73 -0.43 0.82 -0.07 -0.21 0.00 0.00 178.00 177.38 3naf h LEU 741 N -0.82 0.07 0.04 2.35 -0.00 -0.09 -0.09 115.31 116.76 3naf h LEU 741 Ca -0.07 0.01 -0.07 0.00 -0.00 0.00 0.00 57.88 57.75 3naf h LEU 741 Cb 0.60 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.27 3naf h LEU 741 CO 0.12 0.01 -0.30 0.03 -0.00 0.00 0.00 178.44 178.31 3naf h ARG 742 N 0.06 0.13 0.00 1.13 2.47 -0.71 -3.43 114.38 114.02 3naf h ARG 742 Ca 0.57 -0.19 0.00 0.00 -1.26 0.00 0.00 59.98 59.10 3naf h ARG 742 Cb 2.15 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 30.54 3naf h ARG 742 CO -0.05 1.05 0.00 0.00 0.56 0.00 0.00 179.97 181.52 3naf n ALA 743 N -2.61 0.00 0.00 0.04 0.00 -0.05 -4.35 120.51 113.54 3naf n ALA 743 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 3naf n ALA 743 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 3naf n ALA 743 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3naf n SER 744 N -3.67 0.00 0.01 0.00 2.88 -1.17 -0.65 113.62 111.01 3naf n SER 744 Ca 0.00 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.60 3naf n SER 744 Cb 0.00 0.00 0.27 0.00 -0.75 0.00 0.00 64.21 63.73 3naf n SER 744 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3naf n ASN 745 N -0.49 0.04 -4.84 -3.46 3.02 -1.26 -4.56 115.26 103.72 3naf n ASN 745 Ca 0.00 0.51 -0.36 0.00 -0.03 0.00 0.00 54.58 54.71 3naf n ASN 745 Cb 0.00 -0.52 -0.06 0.00 -0.61 0.00 0.00 39.78 38.59 3naf n ASN 745 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3naf s PHE 746 N -3.02 3.62 0.82 3.10 0.08 -1.26 -4.80 117.98 116.52 3naf s PHE 746 Ca 0.06 1.10 -0.12 0.00 0.12 0.00 0.00 56.93 58.09 3naf s PHE 746 Cb 0.08 -2.40 0.08 0.00 -0.57 0.00 0.00 43.02 40.21 3naf s PHE 746 CO 0.22 0.43 1.10 -1.01 -0.10 0.00 0.00 175.22 175.87 3naf s HIS 747 N -1.44 2.77 0.16 0.36 3.76 -1.26 -4.97 115.29 114.67 3naf s HIS 747 Ca 0.37 1.11 -0.14 0.00 -0.15 0.00 0.00 55.06 56.26 3naf s HIS 747 Cb -0.15 -3.16 0.04 0.00 1.11 0.00 0.00 32.58 30.42 3naf s HIS 747 CO 0.19 -1.87 1.72 -0.92 -0.85 0.00 0.00 174.74 173.01 3naf h TYR 748 N -1.16 0.78 -4.26 1.40 3.20 -1.97 -3.34 116.97 111.62 3naf h TYR 748 Ca -0.48 -0.06 -0.50 0.00 3.14 0.00 0.00 58.73 60.84 3naf h TYR 748 Cb 1.28 -0.24 0.12 0.00 1.54 0.00 0.00 36.73 39.43 3naf h TYR 748 CO 0.44 0.64 0.32 -3.38 -1.64 0.00 0.00 178.16 174.54 3naf s HIS 749 N -5.58 2.72 0.00 -3.82 -3.43 -1.26 -3.22 115.29 100.71 3naf s HIS 749 Ca -0.13 1.36 0.00 0.00 -0.80 0.00 0.00 55.06 55.49 3naf s HIS 749 Cb 0.12 -3.04 0.00 0.00 -1.43 0.00 0.00 32.58 28.22 3naf s HIS 749 CO 0.78 -1.77 0.00 -0.85 -2.00 0.00 0.00 174.74 170.90 3naf n GLU 750 N -3.47 0.00 -2.15 -0.38 0.28 -1.26 -4.97 120.64 108.69 3naf n GLU 750 Ca 0.08 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.66 3naf n GLU 750 Cb 0.54 -2.57 -0.03 0.00 1.43 0.00 0.00 31.44 30.82 3naf n GLU 750 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 3naf s LEU 751 N 0.00 4.35 0.51 -1.84 1.43 -1.20 -4.98 118.68 116.95 3naf s LEU 751 Ca 0.00 2.26 -0.22 0.00 -1.03 0.00 0.00 54.13 55.14 3naf s LEU 751 Cb 0.00 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.59 3naf s LEU 751 CO 0.00 -0.72 1.26 -0.54 0.23 0.00 0.00 176.35 176.57 3naf s LYS 752 N 1.93 3.39 -0.53 1.70 -0.14 -1.26 -4.98 119.74 119.85 3naf s LYS 752 Ca 0.66 1.99 -0.11 0.00 -1.36 0.00 0.00 55.97 57.15 3naf s LYS 752 Cb -0.35 -2.28 0.13 0.00 -1.68 0.00 0.00 37.83 33.65 3naf s LYS 752 CO 0.29 -0.92 0.42 -1.58 -0.76 0.00 0.00 175.35 172.81 3naf s HIS 753 N -1.44 3.41 0.45 3.18 5.65 -1.26 -4.87 115.29 120.41 3naf s HIS 753 Ca 0.69 -1.79 -0.23 0.00 0.25 0.00 0.00 55.06 53.98 3naf s HIS 753 Cb -0.34 -3.59 -0.08 0.00 -1.18 0.00 0.00 32.58 27.40 3naf s HIS 753 CO 0.40 -0.99 1.13 0.96 -0.65 0.00 0.00 174.74 175.60 3naf s ILE 754 N 1.24 3.27 -0.22 0.89 -4.36 -1.14 -3.06 121.20 117.81 3naf s ILE 754 Ca 0.07 0.93 -0.04 0.00 -0.26 0.00 0.00 60.65 61.35 3naf s ILE 754 Cb -0.25 -3.47 0.07 0.00 1.25 0.00 0.00 42.46 40.06 3naf s ILE 754 CO -0.01 -0.03 0.09 -0.69 0.24 0.00 0.00 174.94 174.54 3naf s VAL 755 N -1.60 0.14 -0.92 8.37 1.01 -0.21 -1.25 120.40 125.93 3naf s VAL 755 Ca 0.63 -0.51 -0.22 0.00 0.00 0.00 0.00 61.98 61.88 3naf s VAL 755 Cb -0.26 -0.88 0.08 0.00 0.00 0.00 0.00 36.38 35.32 3naf s VAL 755 CO 0.32 -0.42 1.26 -0.36 0.00 0.00 0.00 175.10 175.91 3naf s PHE 756 N 2.02 2.73 0.17 5.22 0.40 0.18 -2.29 117.98 126.42 3naf s PHE 756 Ca 0.04 -0.93 -0.30 0.00 -0.60 0.00 0.00 56.93 55.14 3naf s PHE 756 Cb -0.16 -4.50 -0.08 0.00 0.51 0.00 0.00 43.02 38.79 3naf s PHE 756 CO -0.18 -1.76 1.17 0.08 0.70 0.00 0.00 175.22 175.23 3naf s VAL 757 N 4.13 3.69 -5.00 -0.44 1.01 -0.99 -2.74 120.40 120.06 3naf s VAL 757 Ca 0.38 1.42 0.00 0.00 0.00 0.00 0.00 61.98 63.77 3naf s VAL 757 Cb -0.04 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.43 3naf s VAL 757 CO -0.05 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.88 3naf n GLY 758 N 2.23 -0.04 3.75 4.51 0.00 -1.14 -1.12 105.19 113.38 3naf n GLY 758 Ca 0.04 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 3naf n GLY 758 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3naf s SER 759 N -0.83 6.48 0.33 1.61 0.15 -0.98 -1.35 113.70 119.10 3naf s SER 759 Ca 0.00 2.86 0.17 0.00 0.70 0.00 0.00 55.95 59.68 3naf s SER 759 Cb 0.00 -2.64 0.34 0.00 -1.71 0.00 0.00 66.02 62.01 3naf s SER 759 CO 0.00 -0.82 1.57 -0.29 1.20 0.00 0.00 173.24 174.89 3naf h ILE 760 N 3.38 0.80 -0.18 6.45 6.09 -1.94 -2.10 117.51 130.00 3naf h ILE 760 Ca -0.47 -1.87 -0.11 0.00 -1.37 0.00 0.00 64.86 61.03 3naf h ILE 760 Cb 1.22 2.21 -0.01 0.00 0.47 0.00 0.00 36.82 40.71 3naf h ILE 760 CO 0.77 0.41 -0.38 -0.33 -3.07 0.00 0.00 178.15 175.55 3naf h GLU 761 N 0.00 0.40 0.07 2.19 4.39 -1.95 -1.65 114.58 118.04 3naf h GLU 761 Ca -0.00 -0.19 -0.16 0.00 0.34 0.00 0.00 59.36 59.35 3naf h GLU 761 Cb 1.17 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.82 3naf h GLU 761 CO 0.05 0.73 -0.77 -0.92 -1.16 0.00 0.00 179.01 176.94 3naf h TYR 762 N 0.34 0.26 -0.45 4.33 5.03 -1.75 -3.37 116.97 121.36 3naf h TYR 762 Ca 0.03 -0.19 0.13 0.00 2.58 0.00 0.00 58.73 61.29 3naf h TYR 762 Cb 0.83 -0.01 -0.02 0.00 1.55 0.00 0.00 36.73 39.08 3naf h TYR 762 CO 0.02 1.30 0.37 -0.07 -1.32 0.00 0.00 178.16 178.47 3naf h LEU 763 N -0.66 0.00 0.02 2.82 3.38 -1.34 -1.72 115.31 117.82 3naf h LEU 763 Ca -0.17 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 3naf h LEU 763 Cb 1.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.16 3naf h LEU 763 CO 0.02 0.00 -0.01 0.11 0.09 0.00 0.00 178.44 178.65 3naf h LYS 764 N 0.00 -0.02 -0.32 1.13 1.57 -1.45 -1.85 116.57 115.63 3naf h LYS 764 Ca 0.22 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 59.09 3naf h LYS 764 Cb 0.96 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.26 3naf h LYS 764 CO -0.00 0.22 0.37 0.00 -0.57 0.00 0.00 179.45 179.47 3naf h ARG 765 N -0.26 0.00 0.00 3.15 3.08 -1.48 0.35 114.38 119.22 3naf h ARG 765 Ca -0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 3naf h ARG 765 Cb 0.25 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 3naf h ARG 765 CO 0.00 0.00 -1.25 -1.91 -1.07 0.00 0.00 179.97 175.74 3naf n GLU 766 N -3.68 0.61 0.18 0.04 4.07 -1.05 -4.43 120.64 116.39 3naf n GLU 766 Ca 0.05 0.18 0.03 0.00 -0.06 0.00 0.00 57.16 57.37 3naf n GLU 766 Cb 0.53 -1.82 0.41 0.00 -0.06 0.00 0.00 31.44 30.51 3naf n GLU 766 CO 0.00 0.00 0.00 2.35 -0.06 0.00 0.00 177.13 179.42 3naf h TRP 767 N 0.00 0.08 -0.17 4.31 2.91 0.56 -2.21 115.95 121.44 3naf h TRP 767 Ca -0.10 -0.01 0.05 0.00 1.13 0.00 0.00 58.89 59.96 3naf h TRP 767 Cb 1.35 -0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 29.97 3naf h TRP 767 CO 0.00 0.31 0.37 0.93 -1.03 0.00 0.00 178.44 179.02 3naf h GLU 768 N 0.07 0.00 0.00 2.65 3.07 -1.77 -0.16 114.58 118.44 3naf h GLU 768 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 3naf h GLU 768 Cb 0.46 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.37 3naf h GLU 768 CO 0.03 0.00 -1.21 0.25 -1.40 0.00 0.00 179.01 176.68 3naf n THR 769 N -3.26 0.00 -0.01 1.13 -2.24 -0.83 -4.45 114.28 104.62 3naf n THR 769 Ca 0.02 -0.13 0.06 0.00 -2.27 0.00 0.00 64.05 61.73 3naf n THR 769 Cb 0.47 0.76 -0.12 0.00 -2.10 0.00 0.00 70.33 69.34 3naf n THR 769 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3naf n LEU 770 N -1.67 0.00 0.00 3.22 4.77 -0.14 -4.64 117.00 118.55 3naf n LEU 770 Ca 0.02 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.02 3naf n LEU 770 Cb 0.37 0.04 0.11 0.00 -2.33 0.00 0.00 43.42 41.61 3naf n LEU 770 CO 0.42 0.04 0.56 0.00 -1.33 0.00 0.00 177.39 177.08 3naf n HIS 771 N -2.11 0.00 0.09 -1.77 1.44 -0.80 -0.81 115.22 111.26 3naf n HIS 771 Ca -0.05 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.69 3naf n HIS 771 Cb 0.48 -0.45 -0.02 0.00 0.12 0.00 0.00 29.99 30.12 3naf n HIS 771 CO 0.00 0.00 0.00 -0.91 -2.81 0.00 0.00 176.34 172.62 3naf h ASN 772 N 0.00 0.00 -3.85 4.39 2.35 -1.82 -2.64 115.58 114.01 3naf h ASN 772 Ca 0.00 0.00 -0.48 0.00 -0.55 0.00 0.00 56.30 55.27 3naf h ASN 772 Cb 0.08 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 3naf h ASN 772 CO 0.00 0.46 0.38 -0.36 -1.65 0.00 0.00 177.43 176.26 3naf s PHE 773 N -3.00 3.69 0.94 1.19 0.08 0.01 -1.72 117.98 119.16 3naf s PHE 773 Ca 0.01 1.79 -0.15 0.00 0.12 0.00 0.00 56.93 58.70 3naf s PHE 773 Cb 0.08 -3.03 0.17 0.00 -0.57 0.00 0.00 43.02 39.67 3naf s PHE 773 CO 0.78 0.02 1.22 -1.25 -0.10 0.00 0.00 175.22 175.89 3naf s PRO 774 N -1.79 0.86 -0.84 0.24 0.04 -1.26 -4.58 135.00 127.68 3naf s PRO 774 Ca 0.48 -0.08 -0.11 0.00 0.04 0.00 0.00 61.00 61.33 3naf s PRO 774 Cb -0.23 -1.84 0.02 0.00 0.04 0.00 0.00 34.50 32.48 3naf s PRO 774 CO 0.29 -2.32 0.54 1.63 0.04 0.00 0.00 177.00 177.19 3naf n LYS 775 N -3.77 -0.96 -4.22 4.56 5.02 -1.26 -4.91 118.16 112.61 3naf n LYS 775 Ca 0.11 0.40 -0.20 0.00 -2.02 0.00 0.00 58.31 56.59 3naf n LYS 775 Cb 0.60 -1.93 -0.16 0.00 -0.02 0.00 0.00 35.03 33.52 3naf n LYS 775 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3naf s VAL 776 N -3.17 0.61 0.28 -0.18 1.01 -1.26 -2.90 120.40 114.79 3naf s VAL 776 Ca 0.16 -0.17 0.07 0.00 0.00 0.00 0.00 61.98 62.04 3naf s VAL 776 Cb -0.09 -0.62 -0.06 0.00 0.00 0.00 0.00 36.38 35.62 3naf s VAL 776 CO 0.80 0.24 -0.08 -0.44 0.00 0.00 0.00 175.10 175.62 3naf s SER 777 N 0.86 2.90 -0.24 3.32 0.01 -0.38 -4.89 113.70 115.28 3naf s SER 777 Ca -0.12 -1.16 -0.03 0.00 1.31 0.00 0.00 55.95 55.95 3naf s SER 777 Cb -0.15 -0.19 0.11 0.00 0.21 0.00 0.00 66.02 66.00 3naf s SER 777 CO 0.01 -0.28 0.24 -0.63 0.41 0.00 0.00 173.24 172.99 3naf s ILE 778 N -2.93 -0.33 -0.57 1.44 1.01 -1.25 -0.64 121.20 117.93 3naf s ILE 778 Ca 0.29 -0.27 -0.17 0.00 0.00 0.00 0.00 60.65 60.50 3naf s ILE 778 Cb 0.02 -0.79 0.13 0.00 0.01 0.00 0.00 42.46 41.83 3naf s ILE 778 CO 0.12 -0.32 0.57 -0.22 0.00 0.00 0.00 174.94 175.09 3naf s LEU 779 N 2.32 6.02 0.14 2.97 2.96 -1.11 -2.27 118.68 129.71 3naf s LEU 779 Ca 0.08 -1.76 -0.35 0.00 -0.22 0.00 0.00 54.13 51.88 3naf s LEU 779 Cb -0.15 -2.23 -0.15 0.00 0.50 0.00 0.00 46.19 44.15 3naf s LEU 779 CO -0.20 -0.91 1.46 -2.65 -1.32 0.00 0.00 176.35 172.74 3naf n PRO 780 N 5.45 1.72 0.00 0.98 -0.02 -1.26 -2.88 135.00 138.99 3naf n PRO 780 Ca -0.11 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3naf n PRO 780 Cb 0.41 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 3naf n PRO 780 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3naf n GLY 781 N 2.97 -0.51 3.05 -1.23 0.00 -0.46 -4.80 105.19 104.21 3naf n GLY 781 Ca 0.17 -0.69 -0.12 0.00 0.00 0.00 0.00 46.02 45.39 3naf n GLY 781 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3naf s THR 782 N -4.00 0.04 -2.00 2.61 -4.23 -1.26 -2.33 115.64 104.48 3naf s THR 782 Ca 0.00 -0.36 0.13 0.00 -1.18 0.00 0.00 61.69 60.28 3naf s THR 782 Cb 0.00 -0.30 0.37 0.00 1.34 0.00 0.00 72.50 73.91 3naf s THR 782 CO 0.00 -0.20 1.20 -2.65 -0.54 0.00 0.00 174.62 172.43 3naf n PRO 783 N 2.25 0.47 0.06 3.99 -0.02 -1.26 -2.53 135.00 137.96 3naf n PRO 783 Ca -0.18 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.35 3naf n PRO 783 Cb 0.57 -1.43 -0.05 0.00 -0.02 0.00 0.00 33.50 32.58 3naf n PRO 783 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3naf h LEU 784 N 0.00 0.00 -8.75 2.45 4.07 -1.95 -3.45 115.31 107.68 3naf h LEU 784 Ca 0.00 0.00 -0.66 0.00 0.08 0.00 0.00 57.88 57.30 3naf h LEU 784 Cb 0.00 0.00 -0.17 0.00 1.08 0.00 0.00 40.66 41.57 3naf h LEU 784 CO 0.00 0.34 -0.32 -0.94 -1.08 0.00 0.00 178.44 176.44 3naf s SER 785 N -5.63 6.16 0.00 -0.43 1.04 -1.05 -4.94 113.70 108.85 3naf s SER 785 Ca -0.02 -0.24 0.14 0.00 0.48 0.00 0.00 55.95 56.30 3naf s SER 785 Cb 0.09 -2.19 0.78 0.00 0.10 0.00 0.00 66.02 64.81 3naf s SER 785 CO 0.80 -0.31 1.26 -2.11 0.98 0.00 0.00 173.24 173.86 3naf n ARG 786 N 5.33 0.37 0.23 4.02 1.85 -1.26 -2.61 116.66 124.59 3naf n ARG 786 Ca -0.10 0.04 -0.09 0.00 -1.00 0.00 0.00 57.85 56.70 3naf n ARG 786 Cb 0.49 -1.50 -0.04 0.00 -1.05 0.00 0.00 32.46 30.36 3naf n ARG 786 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3naf h ALA 787 N 2.80 -1.03 -0.93 2.89 0.00 -1.94 -1.48 119.26 119.58 3naf h ALA 787 Ca 0.00 -0.13 0.13 0.00 0.00 0.00 0.00 54.91 54.91 3naf h ALA 787 Cb 0.03 0.23 -0.08 0.00 0.00 0.00 0.00 17.79 17.97 3naf h ALA 787 CO 0.00 -0.99 0.59 -0.44 0.00 0.00 0.00 179.25 178.42 3naf h ASP 788 N -0.65 0.77 0.20 0.00 3.32 -1.83 -2.22 116.42 116.01 3naf h ASP 788 Ca -0.06 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 3naf h ASP 788 Cb 0.45 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3naf h ASP 788 CO 0.10 0.40 -0.10 -0.07 -1.72 0.00 0.00 179.24 177.85 3naf h LEU 789 N 0.82 -0.23 -0.78 1.55 3.38 -1.55 -2.12 115.31 116.39 3naf h LEU 789 Ca 0.46 -0.13 0.06 0.00 0.09 0.00 0.00 57.88 58.36 3naf h LEU 789 Cb 0.60 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.36 3naf h LEU 789 CO -0.23 -0.01 0.47 0.03 0.09 0.00 0.00 178.44 178.79 3naf h ARG 790 N -0.45 0.84 -0.13 1.13 3.08 -0.99 -2.58 114.38 115.28 3naf h ARG 790 Ca -0.03 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 59.99 3naf h ARG 790 Cb 0.34 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 30.16 3naf h ARG 790 CO 0.05 0.55 -0.35 0.00 -1.07 0.00 0.00 179.97 179.15 3naf h ALA 791 N 1.37 -0.70 0.00 0.04 0.00 -1.21 -0.28 119.26 118.49 3naf h ALA 791 Ca 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3naf h ALA 791 Cb 0.16 0.88 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3naf h ALA 791 CO -0.17 -0.83 0.00 0.28 0.00 0.00 0.00 179.25 178.53 3naf n VAL 792 N -4.39 0.51 -3.17 0.00 0.31 -0.81 -4.35 118.33 106.43 3naf n VAL 792 Ca -0.03 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.01 3naf n VAL 792 Cb 0.23 -0.72 0.02 0.00 -0.91 0.00 0.00 33.84 32.47 3naf n VAL 792 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3naf n ASN 793 N 0.51 -4.20 0.12 4.52 4.13 -0.12 -4.86 115.26 115.36 3naf n ASN 793 Ca 0.00 -0.33 0.12 0.00 1.68 0.00 0.00 54.58 56.05 3naf n ASN 793 Cb 0.30 -1.27 0.27 0.00 -1.54 0.00 0.00 39.78 37.55 3naf n ASN 793 CO 0.00 0.00 0.00 0.40 0.28 0.00 0.00 177.26 177.94 3naf h ILE 794 N 1.17 0.00 -0.90 2.41 2.04 -1.77 -3.16 117.51 117.29 3naf h ILE 794 Ca -0.48 -0.62 0.10 0.00 1.00 0.00 0.00 64.86 64.86 3naf h ILE 794 Cb 1.13 1.48 -0.08 0.00 -0.74 0.00 0.00 36.82 38.61 3naf h ILE 794 CO 0.22 0.00 0.54 0.78 0.00 0.00 0.00 178.15 179.68 3naf h ASN 795 N 0.00 0.78 -0.66 1.72 4.21 -1.89 -0.25 115.58 119.49 3naf h ASN 795 Ca 0.00 0.05 0.00 0.00 1.21 0.00 0.00 56.30 57.56 3naf h ASN 795 Cb 0.81 -0.11 0.00 0.00 -1.12 0.00 0.00 38.32 37.90 3naf h ASN 795 CO 0.00 0.44 0.00 0.18 -1.29 0.00 0.00 177.43 176.76 3naf n LEU 796 N -4.69 3.65 -4.61 1.61 4.32 -1.22 -4.98 117.00 111.07 3naf n LEU 796 Ca 0.16 -1.82 -0.42 0.00 -0.02 0.00 0.00 56.01 53.90 3naf n LEU 796 Cb 0.30 -0.46 0.00 0.00 -1.62 0.00 0.00 43.42 41.64 3naf n LEU 796 CO 0.27 0.87 0.62 0.00 -1.22 0.00 0.00 177.39 177.94 3naf n ASP 798 N 0.78 0.75 -3.15 0.00 -0.08 -0.62 -4.77 116.55 109.45 3naf n ASP 798 Ca 0.09 0.34 0.06 0.00 -1.51 0.00 0.00 54.79 53.77 3naf n ASP 798 Cb 0.37 0.20 -0.02 0.00 2.34 0.00 0.00 41.12 44.01 3naf n ASP 798 CO 0.00 0.00 0.00 -0.32 0.12 0.00 0.00 177.20 177.00 3naf s MET 799 N -2.75 0.07 0.43 -0.67 0.00 -1.20 -4.72 119.30 110.47 3naf s MET 799 Ca -0.05 0.11 -0.23 0.00 0.00 0.00 0.00 55.69 55.53 3naf s MET 799 Cb 0.08 0.06 -0.08 0.00 0.00 0.00 0.00 34.83 34.89 3naf s MET 799 CO 0.82 -0.08 1.09 0.00 0.00 0.00 0.00 175.02 176.85 3naf s VAL 801 N -1.67 0.80 -0.33 0.00 1.01 0.10 -2.32 120.40 117.99 3naf s VAL 801 Ca 0.61 -1.09 -0.22 0.00 0.00 0.00 0.00 61.98 61.29 3naf s VAL 801 Cb -0.23 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.69 3naf s VAL 801 CO 0.29 -0.47 0.70 -0.63 0.00 0.00 0.00 175.10 174.99 3naf s ILE 802 N 1.69 4.85 0.35 2.22 1.09 -0.99 -0.72 121.20 129.68 3naf s ILE 802 Ca 0.05 0.87 0.09 0.00 -1.10 0.00 0.00 60.65 60.56 3naf s ILE 802 Cb -0.17 -4.10 -0.07 0.00 -1.06 0.00 0.00 42.46 37.06 3naf s ILE 802 CO -0.18 -0.27 -0.08 -0.76 -0.10 0.00 0.00 174.94 173.54 3naf s LEU 803 N 2.82 2.76 -0.02 2.97 1.43 -0.79 -2.53 118.68 125.33 3naf s LEU 803 Ca 0.28 -1.20 -0.06 0.00 -1.03 0.00 0.00 54.13 52.13 3naf s LEU 803 Cb -0.14 -1.02 0.00 0.00 0.03 0.00 0.00 46.19 45.07 3naf s LEU 803 CO 0.14 -0.22 0.12 -0.55 0.23 0.00 0.00 176.35 176.07 3naf s SER 804 N -3.62 -0.02 0.00 2.29 0.15 -1.26 -2.50 113.70 108.74 3naf s SER 804 Ca 0.33 -0.05 0.00 0.00 0.70 0.00 0.00 55.95 56.92 3naf s SER 804 Cb 0.03 0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.56 3naf s SER 804 CO 0.17 -0.24 0.17 0.00 1.20 0.00 0.00 173.24 174.54 3naf n ALA 805 N 2.06 1.00 -0.78 5.45 0.00 -1.22 -4.77 120.51 122.24 3naf n ALA 805 Ca -0.19 -0.17 0.08 0.00 0.00 0.00 0.00 53.44 53.16 3naf n ALA 805 Cb 0.57 0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.38 3naf n ALA 805 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3naf n ASN 806 N -0.08 5.04 0.00 0.00 5.15 -1.26 -3.60 115.26 120.51 3naf n ASN 806 Ca 0.00 -2.72 0.11 0.00 -0.60 0.00 0.00 54.58 51.37 3naf n ASN 806 Cb 0.12 -0.61 0.05 0.00 -0.53 0.00 0.00 39.78 38.80 3naf n ASN 806 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3naf n GLN 807 N 0.68 0.05 0.00 1.20 0.00 -1.26 -4.35 117.38 113.70 3naf n GLN 807 Ca 0.26 -0.00 0.03 0.00 0.00 0.00 0.00 57.00 57.29 3naf n GLN 807 Cb 1.01 -1.51 0.21 0.00 0.00 0.00 0.00 30.24 29.95 3naf n GLN 807 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 3naf n ASN 808 N -1.58 0.00 0.11 2.61 0.23 -1.26 -3.59 115.26 111.78 3naf n ASN 808 Ca 0.04 -0.44 0.09 0.00 -0.53 0.00 0.00 54.58 53.74 3naf n ASN 808 Cb 0.35 0.00 0.42 0.00 -2.08 0.00 0.00 39.78 38.47 3naf n ASN 808 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 3naf n ASN 809 N -0.83 0.43 -1.80 0.53 3.02 -1.26 -4.08 115.26 111.27 3naf n ASN 809 Ca 0.05 0.66 -0.16 0.00 -0.03 0.00 0.00 54.58 55.10 3naf n ASN 809 Cb 0.02 -0.73 -0.01 0.00 -0.61 0.00 0.00 39.78 38.45 3naf n ASN 809 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3naf n ILE 810 N -2.03 -0.71 -3.01 2.41 2.08 -1.24 -4.97 119.36 111.89 3naf n ILE 810 Ca 0.00 0.00 -0.44 0.00 0.56 0.00 0.00 62.75 62.88 3naf n ILE 810 Cb 0.10 -2.37 -0.05 0.00 -0.75 0.00 0.00 39.64 36.58 3naf n ILE 810 CO 0.00 0.00 0.00 1.51 0.56 0.00 0.00 176.55 178.62 3naf s ASP 811 N -2.31 6.20 0.69 4.38 -4.77 -1.26 -4.93 116.67 114.68 3naf s ASP 811 Ca 0.00 -1.09 0.00 0.00 -3.30 0.00 0.00 52.55 48.16 3naf s ASP 811 Cb 0.00 -2.35 0.00 0.00 -1.09 0.00 0.00 42.92 39.48 3naf s ASP 811 CO 0.00 -1.19 0.00 -0.67 0.70 0.00 0.00 175.17 174.01 3naf n ASP 812 N 6.86 -7.14 0.00 2.11 4.64 -1.26 -4.45 116.55 117.31 3naf n ASP 812 Ca -0.06 0.70 0.00 0.00 -1.38 0.00 0.00 54.79 54.05 3naf n ASP 812 Cb 0.44 -1.98 0.00 0.00 -1.04 0.00 0.00 41.12 38.55 3naf n ASP 812 CO 0.00 0.00 0.00 0.41 -0.82 0.00 0.00 177.20 176.79 3naf n THR 813 N -3.01 0.00 -0.03 5.18 -1.04 -1.26 -4.77 114.28 109.35 3naf n THR 813 Ca 0.00 -0.30 0.00 0.00 -2.04 0.00 0.00 64.05 61.72 3naf n THR 813 Cb 0.30 1.19 0.00 0.00 -1.82 0.00 0.00 70.33 70.00 3naf n THR 813 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 3naf n SER 814 N -0.32 0.21 -0.89 8.00 7.64 -1.26 -4.62 113.62 122.38 3naf n SER 814 Ca 0.00 -0.58 0.09 0.00 1.01 0.00 0.00 58.87 59.39 3naf n SER 814 Cb 0.05 0.66 0.17 0.00 -1.01 0.00 0.00 64.21 64.07 3naf n SER 814 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3naf n LEU 815 N -0.66 3.04 0.04 -3.43 4.77 -1.26 -4.18 117.00 115.32 3naf n LEU 815 Ca 0.00 -1.54 0.13 0.00 -0.03 0.00 0.00 56.01 54.56 3naf n LEU 815 Cb 0.01 -0.20 0.50 0.00 -2.33 0.00 0.00 43.42 41.40 3naf n LEU 815 CO 0.00 0.67 0.90 0.00 -1.33 0.00 0.00 177.39 177.63 3naf n GLN 816 N 1.08 0.10 -0.22 3.23 6.02 -1.26 -3.21 117.38 123.11 3naf n GLN 816 Ca 0.15 0.14 0.08 0.00 -0.01 0.00 0.00 57.00 57.36 3naf n GLN 816 Cb 0.50 -1.63 0.20 0.00 1.02 0.00 0.00 30.24 30.33 3naf n GLN 816 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3naf n ASP 817 N -1.80 3.23 -0.16 1.08 8.00 -1.26 -4.53 116.55 121.12 3naf n ASP 817 Ca 0.06 -1.96 -0.10 0.00 0.71 0.00 0.00 54.79 53.50 3naf n ASP 817 Cb 0.34 -0.29 -0.01 0.00 -0.02 0.00 0.00 41.12 41.14 3naf n ASP 817 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 3naf h LYS 818 N 3.04 0.82 0.11 -1.24 2.10 -1.80 -0.97 116.57 118.64 3naf h LYS 818 Ca 0.00 -0.28 -0.00 0.00 -2.00 0.00 0.00 60.65 58.37 3naf h LYS 818 Cb 0.82 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 32.08 3naf h LYS 818 CO 0.00 0.90 -0.15 0.93 -2.00 0.00 0.00 179.45 179.13 3naf h GLU 819 N 0.67 -0.26 -0.22 0.07 5.08 -1.83 -0.97 114.58 117.12 3naf h GLU 819 Ca 0.12 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.56 3naf h GLU 819 Cb 0.56 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.80 3naf h GLU 819 CO 0.03 -0.18 -0.18 0.00 -1.00 0.00 0.00 179.01 177.68 3naf h ILE 821 N -0.18 1.04 0.00 0.00 2.04 -1.13 -0.25 117.51 119.03 3naf h ILE 821 Ca 0.13 -0.13 -0.12 0.00 1.00 0.00 0.00 64.86 65.74 3naf h ILE 821 Cb 0.38 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 3naf h ILE 821 CO -0.33 0.07 -0.55 -0.07 0.00 0.00 0.00 178.15 177.27 3naf h LEU 822 N 0.39 0.00 0.00 1.44 3.38 -0.54 -2.98 115.31 117.00 3naf h LEU 822 Ca 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 3naf h LEU 822 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3naf h LEU 822 CO -0.03 0.55 -0.00 0.00 0.09 0.00 0.00 178.44 179.05 3naf h ALA 823 N 1.45 -0.00 0.00 1.53 0.00 -0.58 -1.33 119.26 120.32 3naf h ALA 823 Ca -0.01 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3naf h ALA 823 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3naf h ALA 823 CO 0.07 -0.04 0.00 -1.13 0.00 0.00 0.00 179.25 178.15 3naf n SER 824 N -4.65 0.35 -0.08 0.00 3.41 -0.46 -1.30 113.62 110.88 3naf n SER 824 Ca -0.09 0.62 -0.21 0.00 -0.26 0.00 0.00 58.87 58.93 3naf n SER 824 Cb 0.43 -0.68 -0.12 0.00 -0.26 0.00 0.00 64.21 63.58 3naf n SER 824 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3naf h LEU 825 N 0.00 0.08 -0.91 1.04 6.46 -1.53 -3.32 115.31 117.13 3naf h LEU 825 Ca 0.00 -0.65 0.19 0.00 -0.12 0.00 0.00 57.88 57.29 3naf h LEU 825 Cb 0.16 -0.03 -0.11 0.00 -0.73 0.00 0.00 40.66 39.95 3naf h LEU 825 CO 0.00 1.48 0.48 -1.13 -0.62 0.00 0.00 178.44 178.65 3naf h ASN 826 N -0.82 0.55 -0.59 1.25 -1.24 -0.34 -2.23 115.58 112.17 3naf h ASN 826 Ca -0.31 0.12 -0.09 0.00 0.71 0.00 0.00 56.30 56.73 3naf h ASN 826 Cb 1.39 0.03 -0.02 0.00 0.73 0.00 0.00 38.32 40.45 3naf h ASN 826 CO -0.12 0.16 0.01 0.40 -1.29 0.00 0.00 177.43 176.59 3naf h ILE 827 N 0.59 1.26 0.00 2.57 2.04 -1.36 -2.72 117.51 119.90 3naf h ILE 827 Ca 0.54 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 65.27 3naf h ILE 827 Cb 0.88 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 3naf h ILE 827 CO -0.43 0.41 0.00 0.29 0.00 0.00 0.00 178.15 178.43 3naf n LYS 828 N -4.18 0.14 -0.03 2.37 5.02 -0.86 -3.20 118.16 117.42 3naf n LYS 828 Ca 0.03 0.22 -0.09 0.00 -2.02 0.00 0.00 58.31 56.45 3naf n LYS 828 Cb 0.34 -1.69 -0.14 0.00 -0.02 0.00 0.00 35.03 33.51 3naf n LYS 828 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3naf n SER 829 N -1.94 0.84 -4.67 4.39 7.64 -1.04 -4.89 113.62 113.94 3naf n SER 829 Ca 0.05 0.38 -0.42 0.00 1.01 0.00 0.00 58.87 59.89 3naf n SER 829 Cb 0.32 -0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.49 3naf n SER 829 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3naf s MET 830 N -2.59 4.22 -0.14 1.43 0.23 -1.10 -4.99 119.30 116.35 3naf s MET 830 Ca -0.05 2.08 -0.14 0.00 -1.03 0.00 0.00 55.69 56.55 3naf s MET 830 Cb 0.08 -3.79 -0.05 0.00 -1.53 0.00 0.00 34.83 29.54 3naf s MET 830 CO 0.82 -0.74 0.30 -0.65 -2.03 0.00 0.00 175.02 172.73 3naf s GLN 831 N 3.32 4.15 0.06 3.16 -1.52 -1.26 -4.81 119.66 122.76 3naf s GLN 831 Ca 0.68 0.13 -0.13 0.00 -1.95 0.00 0.00 55.36 54.10 3naf s GLN 831 Cb -0.32 -3.38 0.02 0.00 -0.22 0.00 0.00 33.01 29.10 3naf s GLN 831 CO 0.27 0.33 0.28 -0.59 -0.25 0.00 0.00 175.29 175.34 3naf s PHE 832 N 0.16 -0.05 -0.25 0.91 -0.12 -1.26 -5.14 117.98 112.23 3naf s PHE 832 Ca 0.18 -0.17 0.01 0.00 -0.05 0.00 0.00 56.93 56.90 3naf s PHE 832 Cb -0.13 0.07 0.05 0.00 -0.63 0.00 0.00 43.02 42.37 3naf s PHE 832 CO 0.05 -0.52 -0.10 0.16 -0.05 0.00 0.00 175.22 174.76 3naf s ASP 833 N -2.29 4.29 -0.25 1.98 3.84 -1.26 -4.84 116.67 118.14 3naf s ASP 833 Ca -0.02 -1.16 -0.19 0.00 -0.00 0.00 0.00 52.55 51.17 3naf s ASP 833 Cb 0.00 -1.59 -0.02 0.00 -1.38 0.00 0.00 42.92 39.93 3naf s ASP 833 CO -0.06 -0.16 0.59 0.42 -0.00 0.00 0.00 175.17 175.96 3naf s THR 872 N 1.20 5.02 -2.00 2.11 -4.23 -1.26 -5.24 115.64 111.24 3naf s THR 872 Ca -0.04 1.04 0.03 0.00 -1.18 0.00 0.00 61.69 61.53 3naf s THR 872 Cb -0.18 -3.90 0.07 0.00 1.34 0.00 0.00 72.50 69.83 3naf s THR 872 CO -0.05 0.06 0.83 0.61 -0.54 0.00 0.00 174.62 175.52 3naf n GLY 873 N 4.21 -0.72 0.24 3.99 0.00 -1.26 -3.96 105.19 107.69 3naf n GLY 873 Ca -0.02 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.12 3naf n GLY 873 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3naf h VAL 874 N 0.00 0.00 -2.11 1.61 2.07 -1.88 -3.41 116.25 112.53 3naf h VAL 874 Ca 0.00 0.00 -0.53 0.00 0.82 0.00 0.00 66.70 66.99 3naf h VAL 874 Cb 0.00 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 3naf h VAL 874 CO 0.00 0.00 1.42 0.21 0.02 0.00 0.00 177.57 179.22 3naf s ASN 875 N -4.16 5.29 0.04 0.57 3.84 -1.25 -4.82 114.94 114.44 3naf s ASN 875 Ca -0.03 1.09 0.05 0.00 0.21 0.00 0.00 52.86 54.18 3naf s ASN 875 Cb 0.07 -2.52 -0.02 0.00 -0.55 0.00 0.00 41.25 38.23 3naf s ASN 875 CO 0.23 -2.22 -0.14 0.27 -2.79 0.00 0.00 177.10 172.45 3naf s ILE 876 N 9.03 1.10 -0.24 -5.21 -4.36 -1.26 -5.09 121.20 115.16 3naf s ILE 876 Ca 0.84 -1.01 -0.38 0.00 -0.26 0.00 0.00 60.65 59.84 3naf s ILE 876 Cb -0.20 -1.01 -0.14 0.00 1.25 0.00 0.00 42.46 42.36 3naf s ILE 876 CO 0.29 -0.01 1.84 -2.65 0.24 0.00 0.00 174.94 174.64 3naf n PRO 877 N 1.86 1.40 -4.27 0.37 -0.02 -1.26 -4.94 135.00 128.15 3naf n PRO 877 Ca -0.18 0.50 -0.19 0.00 -2.02 0.00 0.00 63.50 61.61 3naf n PRO 877 Cb 0.55 -2.28 -0.15 0.00 -0.02 0.00 0.00 33.50 31.59 3naf n PRO 877 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3naf s ILE 878 N 4.18 0.61 -0.14 4.25 1.01 -1.26 -1.33 121.20 128.52 3naf s ILE 878 Ca 0.99 -0.26 -0.02 0.00 0.00 0.00 0.00 60.65 61.36 3naf s ILE 878 Cb -0.95 -0.56 0.04 0.00 0.01 0.00 0.00 42.46 41.00 3naf s ILE 878 CO 0.60 0.20 0.00 -0.51 0.00 0.00 0.00 174.94 175.24 3naf s ILE 879 N 0.25 0.61 -0.04 2.92 2.07 -0.98 -4.12 121.20 121.90 3naf s ILE 879 Ca -0.03 -0.31 0.02 0.00 -1.41 0.00 0.00 60.65 58.91 3naf s ILE 879 Cb -0.08 -0.90 -0.03 0.00 0.13 0.00 0.00 42.46 41.58 3naf s ILE 879 CO 0.00 0.06 -0.08 0.42 -1.91 0.00 0.00 174.94 173.42 3naf s THR 880 N 1.85 3.56 -0.27 4.00 -4.23 -1.13 -2.34 115.64 117.07 3naf s THR 880 Ca 0.02 -0.61 -0.25 0.00 -1.18 0.00 0.00 61.69 59.67 3naf s THR 880 Cb -0.15 -2.47 -0.00 0.00 1.34 0.00 0.00 72.50 71.22 3naf s THR 880 CO -0.07 0.54 0.84 -0.70 -0.54 0.00 0.00 174.62 174.69 3naf s GLU 881 N -0.96 4.10 -0.09 3.99 2.12 -1.05 -1.69 118.70 125.12 3naf s GLU 881 Ca 0.13 0.84 0.01 0.00 0.36 0.00 0.00 54.97 56.32 3naf s GLU 881 Cb -0.11 -3.68 -0.02 0.00 0.26 0.00 0.00 34.13 30.58 3naf s GLU 881 CO 0.03 -0.61 -0.12 -0.51 -0.54 0.00 0.00 175.26 173.51 3naf s LEU 882 N 2.95 2.82 -0.07 2.70 1.43 -0.25 -4.86 118.68 123.40 3naf s LEU 882 Ca 0.35 -0.22 0.02 0.00 -1.03 0.00 0.00 54.13 53.25 3naf s LEU 882 Cb -0.15 -1.61 -0.25 0.00 0.03 0.00 0.00 46.19 44.22 3naf s LEU 882 CO 0.10 0.26 0.55 1.62 0.23 0.00 0.00 176.35 179.11 3naf h VAL 883 N 4.82 0.78 -3.68 -1.59 3.04 -1.94 -1.96 116.25 115.72 3naf h VAL 883 Ca -0.37 -2.55 -0.63 0.00 -1.01 0.00 0.00 66.70 62.14 3naf h VAL 883 Cb 1.18 2.49 -0.18 0.00 -2.01 0.00 0.00 31.29 32.78 3naf h VAL 883 CO 0.54 0.71 -0.55 0.21 -1.01 0.00 0.00 177.57 177.46 3naf s ASN 884 N -6.60 5.77 0.46 3.17 2.47 -1.26 -4.46 114.94 114.48 3naf s ASN 884 Ca -0.13 -0.02 0.31 0.00 0.42 0.00 0.00 52.86 53.45 3naf s ASN 884 Cb 0.07 -2.05 1.64 0.00 -1.45 0.00 0.00 41.25 39.47 3naf s ASN 884 CO 0.80 0.01 1.96 0.44 -3.72 0.00 0.00 177.10 176.60 3naf h ASP 885 N 7.90 0.00 0.14 -4.21 3.32 -1.95 -2.89 116.42 118.72 3naf h ASP 885 Ca -0.37 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.68 3naf h ASP 885 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3naf h ASP 885 CO 0.60 0.00 -0.07 0.74 -1.72 0.00 0.00 179.24 178.80 3naf h THR 886 N 0.00 1.03 -0.52 0.35 2.02 -1.98 -3.25 112.91 110.57 3naf h THR 886 Ca 0.00 -0.96 0.15 0.00 0.77 0.00 0.00 66.41 66.37 3naf h THR 886 Cb 0.08 1.60 -0.02 0.00 -1.74 0.00 0.00 68.15 68.07 3naf h THR 886 CO 0.00 0.22 0.44 0.78 0.37 0.00 0.00 175.52 177.32 3naf h ASN 887 N -0.66 0.00 -0.69 4.18 2.35 -1.90 -2.75 115.58 116.11 3naf h ASN 887 Ca -0.02 0.00 0.20 0.00 -0.55 0.00 0.00 56.30 55.93 3naf h ASN 887 Cb 0.50 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.84 3naf h ASN 887 CO 0.03 0.00 0.83 1.62 -1.65 0.00 0.00 177.43 178.26 3naf h VAL 888 N 0.00 0.16 0.00 2.81 3.04 -1.70 1.24 116.25 121.80 3naf h VAL 888 Ca 0.25 0.00 -0.06 0.00 -1.01 0.00 0.00 66.70 65.87 3naf h VAL 888 Cb 1.12 0.32 -0.01 0.00 -2.01 0.00 0.00 31.29 30.71 3naf h VAL 888 CO -0.00 0.00 -0.30 1.56 -1.01 0.00 0.00 177.57 177.81 3naf h GLN 889 N 0.00 0.00 0.00 4.17 4.20 -1.74 -3.23 115.11 118.51 3naf h GLN 889 Ca 0.33 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.04 3naf h GLN 889 Cb 1.99 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.77 3naf h GLN 889 CO -0.00 0.30 0.00 1.19 -0.67 0.00 0.00 178.83 179.65 3naf n PHE 890 N -3.50 0.00 0.12 2.96 3.72 0.43 -3.12 117.46 118.07 3naf n PHE 890 Ca -0.00 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.50 3naf n PHE 890 Cb 0.46 0.00 0.21 0.00 -0.94 0.00 0.00 39.48 39.22 3naf n PHE 890 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3naf n LEU 891 N -0.93 3.38 -3.91 4.37 4.77 -1.22 -5.02 117.00 118.44 3naf n LEU 891 Ca 0.12 -1.62 -0.10 0.00 -0.03 0.00 0.00 56.01 54.38 3naf n LEU 891 Cb 0.06 -0.27 -0.01 0.00 -2.33 0.00 0.00 43.42 40.86 3naf n LEU 891 CO 0.09 0.76 0.38 -0.62 -1.33 0.00 0.00 177.39 176.67 3naf s ASP 892 N -1.28 0.14 1.30 -1.43 2.15 -1.18 -4.94 116.67 111.43 3naf s ASP 892 Ca 0.37 -1.09 -0.18 0.00 0.43 0.00 0.00 52.55 52.08 3naf s ASP 892 Cb 0.21 0.75 0.32 0.00 -0.30 0.00 0.00 42.92 43.89 3naf s ASP 892 CO 0.29 -1.45 0.84 0.00 -0.17 0.00 0.00 175.17 174.67 3naf n GLN 893 N -0.50 -3.49 -0.00 4.34 6.02 -1.26 -5.00 117.38 117.48 3naf n GLN 893 Ca -0.04 -1.01 0.02 0.00 -0.01 0.00 0.00 57.00 55.95 3naf n GLN 893 Cb 0.60 -1.99 -0.04 0.00 1.02 0.00 0.00 30.24 29.84 3naf n GLN 893 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 3naf n ASP 894 N -4.90 3.81 -4.68 1.08 5.68 -1.26 -4.93 116.55 111.36 3naf n ASP 894 Ca 0.07 0.00 -0.46 0.00 -0.50 0.00 0.00 54.79 53.90 3naf n ASP 894 Cb 0.56 1.19 -0.04 0.00 -1.14 0.00 0.00 41.12 41.69 3naf n ASP 894 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 3naf n ASP 895 N -1.72 3.28 -2.29 -1.12 2.03 -1.26 -1.07 116.55 114.41 3naf n ASP 895 Ca -0.01 1.05 -0.18 0.00 0.52 0.00 0.00 54.79 56.17 3naf n ASP 895 Cb 0.17 -1.43 0.01 0.00 -0.72 0.00 0.00 41.12 39.15 3naf n ASP 895 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3naf n ASP 896 N 4.28 -5.25 -3.36 1.67 10.43 -1.26 -4.99 116.55 118.07 3naf n ASP 896 Ca 0.18 -0.14 -0.12 0.00 2.57 0.00 0.00 54.79 57.28 3naf n ASP 896 Cb 0.30 -4.20 -0.08 0.00 1.84 0.00 0.00 41.12 38.97 3naf n ASP 896 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 3naf s ASP 897 N -2.51 0.76 0.66 -2.24 -0.00 -0.23 -5.08 116.67 108.02 3naf s ASP 897 Ca 0.14 -0.27 -0.17 0.00 -0.00 0.00 0.00 52.55 52.25 3naf s ASP 897 Cb -0.06 0.89 -0.02 0.00 -0.00 0.00 0.00 42.92 43.73 3naf s ASP 897 CO 0.17 -0.34 1.01 0.47 -0.00 0.00 0.00 175.17 176.48 3naf n ASP 898 N 5.34 0.80 0.00 0.27 8.00 -1.26 -4.84 116.55 124.85 3naf n ASP 898 Ca -0.02 0.74 0.05 0.00 0.71 0.00 0.00 54.79 56.27 3naf n ASP 898 Cb 0.49 -1.42 0.29 0.00 -0.02 0.00 0.00 41.12 40.46 3naf n ASP 898 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3naf n PRO 899 N -1.52 0.45 -3.00 -0.24 -0.02 -1.26 -3.86 135.00 125.55 3naf n PRO 899 Ca 0.14 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.45 3naf n PRO 899 Cb 0.48 -1.34 -0.01 0.00 -0.02 0.00 0.00 33.50 32.62 3naf n PRO 899 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3naf n ASP 900 N -0.84 -1.05 -4.60 2.55 5.68 -1.26 -5.13 116.55 111.90 3naf n ASP 900 Ca 0.07 -3.03 -0.27 0.00 -0.50 0.00 0.00 54.79 51.07 3naf n ASP 900 Cb 0.03 0.45 -0.09 0.00 -1.14 0.00 0.00 41.12 40.37 3naf n ASP 900 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 3naf s THR 901 N -0.54 3.35 0.42 2.12 -4.23 -1.25 -5.10 115.64 110.41 3naf s THR 901 Ca 0.33 -1.59 -0.25 0.00 -1.18 0.00 0.00 61.69 59.01 3naf s THR 901 Cb 0.22 -2.66 -0.10 0.00 1.34 0.00 0.00 72.50 71.30 3naf s THR 901 CO -0.15 -0.11 1.27 -0.62 -0.54 0.00 0.00 174.62 174.48 3naf n GLU 902 N 0.00 1.92 -0.32 3.99 -0.58 -1.26 -4.88 120.64 119.52 3naf n GLU 902 Ca -0.10 0.69 -0.04 0.00 -0.42 0.00 0.00 57.16 57.28 3naf n GLU 902 Cb 0.55 -2.39 0.00 0.00 -0.57 0.00 0.00 31.44 29.04 3naf n GLU 902 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 3naf h LEU 903 N 2.07 -1.47 -0.30 -4.62 5.85 -1.99 -0.09 115.31 114.75 3naf h LEU 903 Ca -0.48 0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.52 3naf h LEU 903 Cb 1.29 0.73 0.00 0.00 0.37 0.00 0.00 40.66 43.05 3naf h LEU 903 CO 0.60 -0.29 0.00 0.00 -0.34 0.00 0.00 178.44 178.40 3naf n TYR 904 N -5.43 0.00 -0.04 1.25 0.18 -1.26 -2.33 117.16 109.53 3naf n TYR 904 Ca 0.06 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.84 3naf n TYR 904 Cb 0.37 -0.01 0.00 0.00 -0.38 0.00 0.00 39.34 39.32 3naf n TYR 904 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3naf n LEU 905 N -0.25 0.14 -4.75 -3.48 4.77 -0.05 -4.79 117.00 108.59 3naf n LEU 905 Ca 0.00 -0.47 -0.40 0.00 -0.03 0.00 0.00 56.01 55.11 3naf n LEU 905 Cb 0.03 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.06 3naf n LEU 905 CO 0.00 0.04 0.61 0.42 -1.33 0.00 0.00 177.39 177.12 3naf s THR 906 N -0.65 4.33 0.28 -5.08 -4.23 -0.99 -4.92 115.64 104.38 3naf s THR 906 Ca 0.00 1.97 -0.02 0.00 -1.18 0.00 0.00 61.69 62.45 3naf s THR 906 Cb 0.00 -4.27 0.33 0.00 1.34 0.00 0.00 72.50 69.90 3naf s THR 906 CO 0.00 0.43 1.62 -0.61 -0.54 0.00 0.00 174.62 175.52 3naf h GLN 907 N 4.80 0.09 -0.68 3.99 4.15 -1.95 0.92 115.11 126.43 3naf h GLN 907 Ca -0.45 -0.01 0.15 0.00 0.77 0.00 0.00 58.65 59.11 3naf h GLN 907 Cb 1.21 -0.02 -0.11 0.00 0.21 0.00 0.00 27.48 28.76 3naf h GLN 907 CO 0.69 0.06 0.07 -1.35 -1.93 0.00 0.00 178.83 176.37 3naf h PRO 908 N 0.09 0.17 0.00 -2.39 0.11 -1.92 0.72 132.00 128.78 3naf h PRO 908 Ca 0.50 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.59 3naf h PRO 908 Cb 0.97 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 3naf h PRO 908 CO -0.75 0.11 -0.04 0.35 -0.21 0.00 0.00 178.00 177.45 3naf h PHE 909 N 0.17 0.00 0.00 0.65 3.04 -1.13 0.30 116.94 119.98 3naf h PHE 909 Ca 0.37 0.00 -0.12 0.00 3.98 0.00 0.00 57.97 62.20 3naf h PHE 909 Cb 0.62 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.11 3naf h PHE 909 CO -0.33 0.04 -0.62 0.00 -2.02 0.00 0.00 178.31 175.39 3naf h ALA 910 N 1.96 0.65 0.04 2.41 0.00 -0.25 -3.34 119.26 120.72 3naf h ALA 910 Ca -0.00 -0.52 -0.36 0.00 0.00 0.00 0.00 54.91 54.03 3naf h ALA 910 Cb 0.88 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 3naf h ALA 910 CO 0.01 0.70 -2.15 0.00 0.00 0.00 0.00 179.25 177.80 3naf n GLY 912 N 1.92 1.25 0.00 0.00 0.00 -0.22 -3.67 105.19 104.47 3naf n GLY 912 Ca -0.33 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.77 3naf n GLY 912 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3naf n THR 913 N -0.96 0.56 -3.76 2.61 -1.04 -0.07 -4.59 114.28 107.03 3naf n THR 913 Ca 0.00 0.14 -0.13 0.00 -2.04 0.00 0.00 64.05 62.03 3naf n THR 913 Cb 0.00 -0.89 -0.08 0.00 -1.82 0.00 0.00 70.33 67.54 3naf n THR 913 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3naf s ALA 914 N -2.56 -0.74 -0.13 2.41 0.00 -1.20 -2.86 121.76 116.67 3naf s ALA 914 Ca 0.14 0.19 -0.04 0.00 0.00 0.00 0.00 51.96 52.26 3naf s ALA 914 Cb 0.10 0.18 0.06 0.00 0.00 0.00 0.00 23.12 23.46 3naf s ALA 914 CO 0.23 -0.33 0.12 0.12 0.00 0.00 0.00 175.76 175.91 3naf s PHE 915 N -1.86 0.00 -0.11 0.00 5.36 -0.68 -4.72 117.98 115.97 3naf s PHE 915 Ca -0.10 0.09 -0.19 0.00 -0.96 0.00 0.00 56.93 55.77 3naf s PHE 915 Cb -0.03 -0.50 -0.04 0.00 -0.34 0.00 0.00 43.02 42.11 3naf s PHE 915 CO 0.01 -0.42 0.53 0.00 -1.46 0.00 0.00 175.22 173.88 3naf s ALA 916 N 2.21 3.45 -0.46 11.12 0.00 -1.25 -1.10 121.76 135.74 3naf s ALA 916 Ca 0.04 -0.12 0.15 0.00 0.00 0.00 0.00 51.96 52.03 3naf s ALA 916 Cb -0.14 -2.72 0.81 0.00 0.00 0.00 0.00 23.12 21.07 3naf s ALA 916 CO -0.08 -0.04 1.46 0.28 0.00 0.00 0.00 175.76 177.39 3naf n VAL 917 N 3.73 1.32 0.10 0.00 0.31 -0.74 -1.52 118.33 121.53 3naf n VAL 917 Ca -0.06 0.65 0.02 0.00 -0.01 0.00 0.00 64.34 64.94 3naf n VAL 917 Cb 0.51 -1.64 0.38 0.00 -0.91 0.00 0.00 33.84 32.19 3naf n VAL 917 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3naf h SER 918 N 0.00 0.26 -0.29 4.52 0.02 -1.83 -2.65 113.55 113.59 3naf h SER 918 Ca 0.00 -0.05 0.03 0.00 -0.84 0.00 0.00 61.79 60.93 3naf h SER 918 Cb 0.01 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 3naf h SER 918 CO 0.00 0.40 0.19 0.58 -1.14 0.00 0.00 176.83 176.86 3naf h VAL 919 N 0.27 0.99 0.00 2.27 2.07 -1.69 0.11 116.25 120.28 3naf h VAL 919 Ca 0.06 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 3naf h VAL 919 Cb 0.35 0.72 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 3naf h VAL 919 CO 0.02 0.05 -0.04 -0.07 0.02 0.00 0.00 177.57 177.54 3naf h LEU 920 N 0.25 0.00 -0.26 2.57 3.38 -1.67 -1.67 115.31 117.91 3naf h LEU 920 Ca 0.12 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.91 3naf h LEU 920 Cb 0.17 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 3naf h LEU 920 CO -0.02 0.04 -0.86 0.44 0.09 0.00 0.00 178.44 178.12 3naf h ASP 921 N 0.00 0.00 0.09 -0.43 3.32 -0.89 -2.96 116.42 115.55 3naf h ASP 921 Ca -0.00 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 3naf h ASP 921 Cb 0.45 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 3naf h ASP 921 CO 0.01 0.86 -0.32 0.28 -1.72 0.00 0.00 179.24 178.35 3naf h SER 922 N 0.00 0.35 0.64 6.45 0.02 -1.16 -2.16 113.55 117.69 3naf h SER 922 Ca -0.01 -0.13 -0.06 0.00 -0.84 0.00 0.00 61.79 60.75 3naf h SER 922 Cb 1.54 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.97 3naf h SER 922 CO 0.11 0.66 -0.29 0.25 -1.14 0.00 0.00 176.83 176.42 3naf h LEU 923 N 0.30 0.00 -0.23 5.07 5.85 -1.41 -0.77 115.31 124.12 3naf h LEU 923 Ca 0.04 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.80 3naf h LEU 923 Cb 0.72 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 3naf h LEU 923 CO 0.05 0.29 -0.01 -0.03 -0.34 0.00 0.00 178.44 178.41 3naf h MET 924 N 0.00 0.06 0.21 1.25 4.05 -1.22 0.54 114.93 119.82 3naf h MET 924 Ca -0.00 -0.00 -0.35 0.00 -0.28 0.00 0.00 59.70 59.07 3naf h MET 924 Cb 0.69 -0.01 0.02 0.00 -0.80 0.00 0.00 31.60 31.50 3naf h MET 924 CO 0.04 0.04 -1.66 0.66 0.23 0.00 0.00 176.91 176.21 3naf h SER 925 N 0.06 0.71 -0.83 1.39 4.64 -1.55 -3.14 113.55 114.83 3naf h SER 925 Ca 0.11 -0.93 0.24 0.00 -0.47 0.00 0.00 61.79 60.74 3naf h SER 925 Cb 0.15 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 61.97 3naf h SER 925 CO -0.20 1.77 0.62 0.00 -0.87 0.00 0.00 176.83 178.15 3naf h ALA 926 N 0.13 2.76 0.01 5.18 0.00 -1.06 0.60 119.26 126.88 3naf h ALA 926 Ca -0.32 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.38 3naf h ALA 926 Cb 2.13 0.06 0.02 0.00 0.00 0.00 0.00 17.79 20.00 3naf h ALA 926 CO 0.21 -1.04 -0.73 1.15 0.00 0.00 0.00 179.25 178.84 3naf h THR 927 N 0.00 1.39 -0.50 0.00 2.02 -0.91 -2.86 112.91 112.04 3naf h THR 927 Ca 0.39 -2.15 0.15 0.00 0.77 0.00 0.00 66.41 65.57 3naf h THR 927 Cb 1.62 2.57 -0.02 0.00 -1.74 0.00 0.00 68.15 70.58 3naf h THR 927 CO -0.00 0.63 0.43 0.22 0.37 0.00 0.00 175.52 177.17 3naf h TYR 928 N 0.02 0.00 0.10 3.16 3.20 -0.83 -2.42 116.97 120.20 3naf h TYR 928 Ca -0.09 0.00 -0.36 0.00 3.14 0.00 0.00 58.73 61.41 3naf h TYR 928 Cb 1.44 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.68 3naf h TYR 928 CO 0.14 0.00 -2.02 1.19 -1.64 0.00 0.00 178.16 175.83 3naf n PHE 929 N -4.04 1.09 -3.51 -3.82 3.72 -1.11 -4.82 117.46 104.98 3naf n PHE 929 Ca 0.09 0.24 -0.29 0.00 -0.05 0.00 0.00 57.45 57.44 3naf n PHE 929 Cb 0.64 -1.14 -0.14 0.00 -0.94 0.00 0.00 39.48 37.90 3naf n PHE 929 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3naf s ASN 930 N -6.98 3.30 0.57 4.37 3.84 -0.93 -5.00 114.94 114.11 3naf s ASN 930 Ca -0.24 -1.67 0.26 0.00 0.21 0.00 0.00 52.86 51.41 3naf s ASN 930 Cb 0.07 -0.37 1.59 0.00 -0.55 0.00 0.00 41.25 41.99 3naf s ASN 930 CO 0.74 -0.38 2.15 -2.24 -2.79 0.00 0.00 177.10 174.57 3naf h ASP 931 N 7.81 0.00 -0.78 -4.21 3.04 -1.79 -2.57 116.42 117.93 3naf h ASP 931 Ca -0.09 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.70 3naf h ASP 931 Cb 0.99 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 39.24 3naf h ASP 931 CO 0.36 0.00 0.49 0.78 -2.04 0.00 0.00 179.24 178.83 3naf h ASN 932 N 0.00 0.92 -1.00 4.15 2.35 -1.94 -2.62 115.58 117.44 3naf h ASN 932 Ca 0.06 -0.05 0.31 0.00 -0.55 0.00 0.00 56.30 56.07 3naf h ASN 932 Cb 0.29 -0.23 -0.15 0.00 0.05 0.00 0.00 38.32 38.29 3naf h ASN 932 CO -0.00 0.70 0.57 0.40 -1.65 0.00 0.00 177.43 177.44 3naf h ILE 933 N 1.06 0.33 -0.07 2.81 5.03 -1.81 -1.13 117.51 123.73 3naf h ILE 933 Ca 0.28 -0.12 -0.04 0.00 -0.12 0.00 0.00 64.86 64.86 3naf h ILE 933 Cb -0.07 -0.06 0.00 0.00 -3.03 0.00 0.00 36.82 33.66 3naf h ILE 933 CO -0.06 0.06 -0.12 0.25 -0.68 0.00 0.00 178.15 177.61 3naf h LEU 934 N 0.35 0.23 -2.65 1.44 5.85 -1.65 -0.59 115.31 118.29 3naf h LEU 934 Ca 0.72 -0.55 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 3naf h LEU 934 Cb 1.62 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.58 3naf h LEU 934 CO -0.59 0.73 -0.01 0.71 -0.34 0.00 0.00 178.44 178.94 3naf h THR 935 N -0.27 0.29 0.15 1.05 1.35 -1.27 0.67 112.91 114.88 3naf h THR 935 Ca 0.00 -0.04 -0.20 0.00 -0.55 0.00 0.00 66.41 65.62 3naf h THR 935 Cb 0.69 1.03 0.02 0.00 -1.73 0.00 0.00 68.15 68.16 3naf h THR 935 CO 0.03 0.01 -0.90 0.25 -0.25 0.00 0.00 175.52 174.65 3naf h LEU 936 N 0.00 0.49 -0.81 3.87 7.12 -1.15 -2.99 115.31 121.84 3naf h LEU 936 Ca -0.00 -0.95 0.00 0.00 0.13 0.00 0.00 57.88 57.07 3naf h LEU 936 Cb 0.03 -0.16 -0.04 0.00 -0.53 0.00 0.00 40.66 39.96 3naf h LEU 936 CO 0.00 1.43 0.52 0.40 -0.13 0.00 0.00 178.44 180.66 3naf h ILE 937 N -0.33 1.22 0.36 4.05 1.08 0.48 -0.58 117.51 123.78 3naf h ILE 937 Ca -0.16 -0.42 -0.02 0.00 -0.39 0.00 0.00 64.86 63.87 3naf h ILE 937 Cb 1.69 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 35.48 3naf h ILE 937 CO 0.16 0.21 -0.17 0.03 -0.69 0.00 0.00 178.15 177.69 3naf h ARG 938 N 1.11 -0.47 -1.62 2.37 3.08 -1.07 -0.23 114.38 117.54 3naf h ARG 938 Ca 0.30 0.03 0.47 0.00 0.07 0.00 0.00 59.98 60.85 3naf h ARG 938 Cb -0.10 0.11 -0.06 0.00 0.08 0.00 0.00 29.97 29.99 3naf h ARG 938 CO -0.06 -0.31 1.19 1.15 -1.07 0.00 0.00 179.97 180.87 3naf h THR 939 N -0.55 0.16 0.10 2.04 2.02 -1.48 0.44 112.91 115.64 3naf h THR 939 Ca -0.05 0.00 -0.28 0.00 0.77 0.00 0.00 66.41 66.85 3naf h THR 939 Cb 0.37 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.94 3naf h THR 939 CO 0.08 0.00 -1.46 0.25 0.37 0.00 0.00 175.52 174.76 3naf h LEU 940 N 0.00 0.33 0.00 2.58 6.46 -0.99 -3.37 115.31 120.32 3naf h LEU 940 Ca 0.77 -0.82 0.00 0.00 -0.12 0.00 0.00 57.88 57.71 3naf h LEU 940 Cb 3.15 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 42.97 3naf h LEU 940 CO -0.01 1.63 -0.89 0.55 -0.62 0.00 0.00 178.44 179.10 3naf n VAL 941 N -3.94 0.01 -0.31 1.05 3.14 -0.11 -4.47 118.33 113.70 3naf n VAL 941 Ca -0.27 -0.02 0.00 0.00 -2.96 0.00 0.00 64.34 61.10 3naf n VAL 941 Cb 0.89 0.76 0.00 0.00 -1.06 0.00 0.00 33.84 34.43 3naf n VAL 941 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 3naf n THR 942 N -1.53 0.20 0.00 1.55 5.66 -0.05 -4.41 114.28 115.71 3naf n THR 942 Ca 0.04 -0.45 0.00 0.00 -3.05 0.00 0.00 64.05 60.60 3naf n THR 942 Cb 0.34 1.12 0.00 0.00 -1.55 0.00 0.00 70.33 70.24 3naf n THR 942 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3naf n GLY 943 N -0.10 1.94 0.00 1.09 0.00 -1.26 -4.61 105.19 102.25 3naf n GLY 943 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.37 3naf n GLY 943 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3naf n GLY 944 N 0.00 0.44 3.66 -0.02 0.00 -1.26 -4.84 105.19 103.17 3naf n GLY 944 Ca 0.00 -1.49 -0.26 0.00 0.00 0.00 0.00 46.02 44.27 3naf n GLY 944 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3naf n ALA 945 N -0.69 -1.12 -0.35 4.61 0.00 -1.26 -4.82 120.51 116.88 3naf n ALA 945 Ca 0.00 -0.06 0.07 0.00 0.00 0.00 0.00 53.44 53.45 3naf n ALA 945 Cb 0.00 -2.15 0.24 0.00 0.00 0.00 0.00 19.45 17.54 3naf n ALA 945 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3naf h THR 946 N -0.72 0.94 0.06 0.00 1.35 -1.96 -3.15 112.91 109.44 3naf h THR 946 Ca -0.40 -0.34 -0.00 0.00 -0.55 0.00 0.00 66.41 65.12 3naf h THR 946 Cb 1.26 -0.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.54 3naf h THR 946 CO 0.56 0.18 -0.03 1.55 -0.25 0.00 0.00 175.52 177.53 3naf h PRO 947 N 1.00 -0.08 0.64 4.72 0.13 -1.90 -3.21 132.00 133.30 3naf h PRO 947 Ca 0.48 0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.58 3naf h PRO 947 Cb 0.45 0.02 0.01 0.00 0.13 0.00 0.00 31.00 31.60 3naf h PRO 947 CO -0.24 0.46 -0.31 1.49 -0.23 0.00 0.00 178.00 179.17 3naf h GLU 948 N -0.70 -0.84 -0.90 0.86 4.57 -1.91 -3.02 114.58 112.65 3naf h GLU 948 Ca -0.01 0.06 0.23 0.00 -1.18 0.00 0.00 59.36 58.46 3naf h GLU 948 Cb 0.58 0.19 -0.05 0.00 -0.16 0.00 0.00 28.75 29.31 3naf h GLU 948 CO 0.01 -0.56 0.62 -0.07 -1.18 0.00 0.00 179.01 177.83 3naf h LEU 949 N -0.87 0.20 -1.66 1.64 4.07 -1.73 0.11 115.31 117.06 3naf h LEU 949 Ca -0.09 0.02 -0.04 0.00 0.08 0.00 0.00 57.88 57.86 3naf h LEU 949 Cb 0.67 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.39 3naf h LEU 949 CO 0.14 0.07 -0.19 -0.08 -1.08 0.00 0.00 178.44 177.30 3naf h GLU 950 N 0.20 0.00 0.00 1.13 4.81 -1.53 0.35 114.58 119.54 3naf h GLU 950 Ca 0.45 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 59.40 3naf h GLU 950 Cb 1.45 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.78 3naf h GLU 950 CO -0.10 0.19 -1.68 0.00 -0.73 0.00 0.00 179.01 176.70 3naf n ALA 951 N -2.43 1.54 0.06 2.92 0.00 0.26 -3.95 120.51 118.91 3naf n ALA 951 Ca -0.02 -0.74 -0.03 0.00 0.00 0.00 0.00 53.44 52.65 3naf n ALA 951 Cb 0.27 -0.86 0.21 0.00 0.00 0.00 0.00 19.45 19.06 3naf n ALA 951 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3naf h LEU 952 N 0.00 0.35 -1.24 0.00 7.12 -0.51 -2.88 115.31 118.16 3naf h LEU 952 Ca -0.27 -0.14 -0.04 0.00 0.13 0.00 0.00 57.88 57.56 3naf h LEU 952 Cb 1.97 -0.10 -0.01 0.00 -0.53 0.00 0.00 40.66 42.00 3naf h LEU 952 CO 0.08 0.69 -0.20 0.40 -0.13 0.00 0.00 178.44 179.28 3naf h ILE 953 N 0.29 0.51 0.00 4.05 5.03 -0.47 -2.30 117.51 124.63 3naf h ILE 953 Ca 0.03 -1.01 0.00 0.00 -0.12 0.00 0.00 64.86 63.76 3naf h ILE 953 Cb 0.77 1.70 0.00 0.00 -3.03 0.00 0.00 36.82 36.26 3naf h ILE 953 CO 0.06 0.19 0.00 0.00 -0.68 0.00 0.00 178.15 177.72 3naf n ALA 954 N -2.22 2.06 -0.12 1.87 0.00 -1.09 -2.32 120.51 118.70 3naf n ALA 954 Ca -0.00 -0.09 -0.21 0.00 0.00 0.00 0.00 53.44 53.14 3naf n ALA 954 Cb 0.40 -1.23 -0.09 0.00 0.00 0.00 0.00 19.45 18.52 3naf n ALA 954 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3naf n GLU 955 N -0.97 0.53 0.00 0.00 -0.58 -0.86 -4.93 120.64 113.83 3naf n GLU 955 Ca 0.11 0.18 0.00 0.00 -0.42 0.00 0.00 57.16 57.03 3naf n GLU 955 Cb 0.05 -1.40 0.00 0.00 -0.57 0.00 0.00 31.44 29.52 3naf n GLU 955 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 3naf n GLU 956 N -3.67 1.61 -2.52 3.49 0.28 -1.19 -5.07 120.64 113.57 3naf n GLU 956 Ca -0.44 0.00 -0.07 0.00 -0.16 0.00 0.00 57.16 56.49 3naf n GLU 956 Cb 0.88 -0.57 0.04 0.00 1.43 0.00 0.00 31.44 33.21 3naf n GLU 956 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 3naf n ASN 957 N -0.61 -2.55 -3.65 -1.84 4.13 -0.98 -5.06 115.26 104.70 3naf n ASN 957 Ca 0.00 -0.28 0.01 0.00 1.68 0.00 0.00 54.58 55.99 3naf n ASN 957 Cb 0.06 -2.51 -0.00 0.00 -1.54 0.00 0.00 39.78 35.78 3naf n ASN 957 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3naf s ALA 958 N -3.16 -2.14 -0.04 5.41 0.00 -1.26 -4.87 121.76 115.71 3naf s ALA 958 Ca 0.05 0.45 -0.30 0.00 0.00 0.00 0.00 51.96 52.17 3naf s ALA 958 Cb -0.01 0.50 -0.04 0.00 0.00 0.00 0.00 23.12 23.57 3naf s ALA 958 CO 0.32 -1.07 1.31 -0.51 0.00 0.00 0.00 175.76 175.81 3naf s LEU 959 N -3.11 4.29 0.25 0.00 1.43 -1.26 -4.85 118.68 115.43 3naf s LEU 959 Ca 0.16 1.96 0.12 0.00 -1.03 0.00 0.00 54.13 55.35 3naf s LEU 959 Cb 0.03 -3.56 0.68 0.00 0.03 0.00 0.00 46.19 43.37 3naf s LEU 959 CO -0.02 -0.67 1.30 0.54 0.23 0.00 0.00 176.35 177.73 3naf n ARG 960 N 5.40 0.08 0.00 1.70 5.12 -1.26 -4.92 116.66 122.79 3naf n ARG 960 Ca 0.12 0.54 0.00 0.00 -1.93 0.00 0.00 57.85 56.58 3naf n ARG 960 Cb 0.45 -1.95 0.00 0.00 -1.16 0.00 0.00 32.46 29.79 3naf n ARG 960 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3naf n GLY 961 N -1.30 -2.43 3.45 -0.13 0.00 -1.26 -4.77 105.19 98.74 3naf n GLY 961 Ca -0.01 -1.31 -0.26 0.00 0.00 0.00 0.00 46.02 44.44 3naf n GLY 961 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3naf s GLY 962 N -2.56 1.75 -0.22 -0.02 0.00 -0.60 -1.64 107.32 104.03 3naf s GLY 962 Ca 0.00 -1.68 -0.01 0.00 0.00 0.00 0.00 44.72 43.03 3naf s GLY 962 CO 0.00 -1.71 0.01 -0.19 0.00 0.00 0.00 173.10 171.21 3naf s TYR 963 N -1.84 1.55 0.17 1.90 2.02 -1.26 0.13 117.35 120.01 3naf s TYR 963 Ca 0.23 -1.24 -0.32 0.00 -0.37 0.00 0.00 57.07 55.37 3naf s TYR 963 Cb -0.07 -1.28 -0.11 0.00 -0.40 0.00 0.00 41.96 40.10 3naf s TYR 963 CO 0.11 -0.69 1.64 -1.54 -1.57 0.00 0.00 175.55 173.50 3naf s SER 964 N 1.68 6.51 0.25 2.29 1.04 -1.26 -4.91 113.70 119.30 3naf s SER 964 Ca -0.02 2.70 0.05 0.00 0.48 0.00 0.00 55.95 59.17 3naf s SER 964 Cb -0.18 -2.59 -0.05 0.00 0.10 0.00 0.00 66.02 63.30 3naf s SER 964 CO -0.09 -0.89 -0.04 0.42 0.98 0.00 0.00 173.24 173.62 3naf s THR 965 N 1.35 1.39 -0.66 2.02 -4.23 -1.26 -5.01 115.64 109.25 3naf s THR 965 Ca 0.73 -2.09 0.12 0.00 -1.18 0.00 0.00 61.69 59.27 3naf s THR 965 Cb -0.46 -2.36 0.12 0.00 1.34 0.00 0.00 72.50 71.14 3naf s THR 965 CO 0.32 -0.34 1.38 -0.81 -0.54 0.00 0.00 174.62 174.62 3naf n PRO 966 N -0.49 0.07 -0.03 3.99 -0.04 -1.26 -2.08 135.00 135.16 3naf n PRO 966 Ca -0.06 0.51 -0.21 0.00 -0.04 0.00 0.00 63.50 63.70 3naf n PRO 966 Cb 0.63 -1.71 -0.13 0.00 -0.04 0.00 0.00 33.50 32.26 3naf n PRO 966 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 3naf h GLN 967 N 0.00 0.17 0.00 0.54 4.20 -1.97 -3.30 115.11 114.75 3naf h GLN 967 Ca 0.00 -0.28 -0.08 0.00 0.06 0.00 0.00 58.65 58.35 3naf h GLN 967 Cb 0.08 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 3naf h GLN 967 CO 0.00 1.14 -0.36 1.79 -0.67 0.00 0.00 178.83 180.73 3naf h THR 968 N -0.46 1.12 0.00 -0.54 1.35 -1.77 -1.84 112.91 110.76 3naf h THR 968 Ca -0.33 -1.29 -0.01 0.00 -0.55 0.00 0.00 66.41 64.23 3naf h THR 968 Cb 1.65 1.72 -0.00 0.00 -1.73 0.00 0.00 68.15 69.79 3naf h THR 968 CO -0.02 0.35 -0.05 -0.07 -0.25 0.00 0.00 175.52 175.49 3naf h LEU 969 N 0.00 0.00 0.00 3.87 3.38 -1.57 -1.74 115.31 119.24 3naf h LEU 969 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3naf h LEU 969 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3naf h LEU 969 CO 0.05 0.05 -0.35 0.00 0.09 0.00 0.00 178.44 178.27 3naf n ALA 970 N -2.12 3.10 0.61 1.53 0.00 -0.71 -3.64 120.51 119.28 3naf n ALA 970 Ca 0.01 -0.26 0.13 0.00 0.00 0.00 0.00 53.44 53.32 3naf n ALA 970 Cb 0.35 -1.24 0.38 0.00 0.00 0.00 0.00 19.45 18.94 3naf n ALA 970 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3naf n ASN 971 N -1.58 0.83 -0.39 0.00 3.02 -0.66 -3.63 115.26 112.86 3naf n ASN 971 Ca 0.06 0.54 0.13 0.00 -0.03 0.00 0.00 54.58 55.27 3naf n ASN 971 Cb 0.35 -0.71 0.32 0.00 -0.61 0.00 0.00 39.78 39.12 3naf n ASN 971 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 3naf n ARG 972 N -2.27 1.18 -1.48 3.52 1.85 -1.24 -4.46 116.66 113.76 3naf n ARG 972 Ca 0.05 -0.79 -0.34 0.00 -1.00 0.00 0.00 57.85 55.77 3naf n ARG 972 Cb 0.43 -1.48 -0.05 0.00 -1.05 0.00 0.00 32.46 30.32 3naf n ARG 972 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 3naf n ASP 973 N -0.22 7.87 -4.09 2.89 -0.08 -1.24 -4.33 116.55 117.36 3naf n ASP 973 Ca 0.13 -2.78 -0.15 0.00 -1.51 0.00 0.00 54.79 50.48 3naf n ASP 973 Cb 0.39 -1.45 -0.12 0.00 2.34 0.00 0.00 41.12 42.28 3naf n ASP 973 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3naf s ARG 974 N 0.70 0.62 1.05 -0.67 1.70 -1.26 -4.81 118.95 116.29 3naf s ARG 974 Ca 0.64 -0.77 -0.13 0.00 -0.47 0.00 0.00 55.73 55.00 3naf s ARG 974 Cb 0.22 -0.48 0.17 0.00 -0.57 0.00 0.00 34.95 34.29 3naf s ARG 974 CO -0.08 0.10 0.76 0.00 -1.08 0.00 0.00 175.30 175.00 3naf s ARG 976 N -4.15 0.91 0.32 0.00 1.70 -0.80 -4.94 118.95 111.99 3naf s ARG 976 Ca 0.64 -0.85 -0.26 0.00 -0.47 0.00 0.00 55.73 54.79 3naf s ARG 976 Cb -0.22 0.38 -0.10 0.00 -0.57 0.00 0.00 34.95 34.45 3naf s ARG 976 CO 0.64 -0.31 0.94 0.08 -1.08 0.00 0.00 175.30 175.56 3naf s VAL 977 N -3.73 4.22 0.32 4.99 1.01 -1.26 -2.18 120.40 123.77 3naf s VAL 977 Ca 0.03 1.80 -0.13 0.00 0.00 0.00 0.00 61.98 63.69 3naf s VAL 977 Cb 0.03 -4.00 0.02 0.00 0.00 0.00 0.00 36.38 32.43 3naf s VAL 977 CO -0.11 0.14 0.62 0.00 0.00 0.00 0.00 175.10 175.75 3naf s ALA 978 N -1.62 -0.37 -0.29 5.51 0.00 -0.88 -4.86 121.76 119.27 3naf s ALA 978 Ca 0.50 -0.87 0.03 0.00 0.00 0.00 0.00 51.96 51.62 3naf s ALA 978 Cb -0.18 0.93 0.17 0.00 0.00 0.00 0.00 23.12 24.03 3naf s ALA 978 CO 0.24 -0.92 0.47 -1.14 0.00 0.00 0.00 175.76 174.41 3naf s GLN 979 N -3.28 0.46 -0.01 0.00 0.74 -1.26 -2.38 119.66 113.93 3naf s GLN 979 Ca 0.20 0.34 -0.00 0.00 0.05 0.00 0.00 55.36 55.94 3naf s GLN 979 Cb -0.03 -0.11 -0.04 0.00 1.10 0.00 0.00 33.01 33.94 3naf s GLN 979 CO 0.12 -0.98 0.07 -0.51 -0.55 0.00 0.00 175.29 173.43 3naf s LEU 980 N 2.65 3.85 0.53 3.68 1.02 -1.20 -4.81 118.68 124.39 3naf s LEU 980 Ca 0.11 0.14 -0.02 0.00 0.02 0.00 0.00 54.13 54.38 3naf s LEU 980 Cb -0.12 -2.21 0.01 0.00 0.02 0.00 0.00 46.19 43.89 3naf s LEU 980 CO -0.27 0.28 0.78 0.00 0.02 0.00 0.00 176.35 177.16 3naf s ALA 981 N -1.16 3.61 -0.25 4.21 0.00 -1.26 -1.39 121.76 125.52 3naf s ALA 981 Ca 0.22 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 51.20 3naf s ALA 981 Cb -0.12 -2.29 -0.18 0.00 0.00 0.00 0.00 23.12 20.53 3naf s ALA 981 CO 0.13 -0.63 -0.19 1.28 0.00 0.00 0.00 175.76 176.35 3naf n LEU 982 N -2.33 2.86 -0.15 0.00 4.77 -1.20 -4.12 117.00 116.82 3naf n LEU 982 Ca 0.04 -0.12 0.15 0.00 -0.03 0.00 0.00 56.01 56.06 3naf n LEU 982 Cb 0.58 -0.87 0.51 0.00 -2.33 0.00 0.00 43.42 41.31 3naf n LEU 982 CO 0.49 0.92 1.21 -0.07 -1.33 0.00 0.00 177.39 178.61 3naf h LEU 983 N 0.00 0.37 -3.56 2.23 4.07 -1.87 -2.14 115.31 114.41 3naf h LEU 983 Ca -0.57 0.02 -0.30 0.00 0.08 0.00 0.00 57.88 57.11 3naf h LEU 983 Cb 1.92 -0.05 -0.18 0.00 1.08 0.00 0.00 40.66 43.43 3naf h LEU 983 CO -0.08 0.19 0.14 0.47 -1.08 0.00 0.00 178.44 178.09 3naf n ASP 984 N -4.47 2.93 -0.94 -0.43 8.00 -1.26 -5.00 116.55 115.38 3naf n ASP 984 Ca 0.14 -3.74 0.00 0.00 0.71 0.00 0.00 54.79 51.90 3naf n ASP 984 Cb 0.53 -0.70 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 3naf n ASP 984 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3naf n GLY 985 N -1.13 3.67 0.06 0.44 0.00 -0.80 -4.96 105.19 102.47 3naf n GLY 985 Ca 0.42 -1.51 -0.07 0.00 0.00 0.00 0.00 46.02 44.86 3naf n GLY 985 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3naf h PRO 986 N 0.00 0.00 -1.89 1.61 0.11 -1.89 -3.35 132.00 126.60 3naf h PRO 986 Ca 0.00 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 65.91 3naf h PRO 986 Cb 0.00 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 31.04 3naf h PRO 986 CO 0.00 1.00 0.05 1.19 -0.21 0.00 0.00 178.00 180.03 3naf n PHE 987 N -3.35 0.58 -0.10 0.65 0.99 -1.26 -4.37 117.46 110.60 3naf n PHE 987 Ca -0.00 -1.49 -0.20 0.00 -0.00 0.00 0.00 57.45 55.76 3naf n PHE 987 Cb 0.94 -1.03 -0.11 0.00 -1.00 0.00 0.00 39.48 38.28 3naf n PHE 987 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3naf h ALA 988 N 1.94 0.21 -0.00 4.37 0.00 -1.70 -3.31 119.26 120.77 3naf h ALA 988 Ca 0.17 -1.06 0.00 0.00 0.00 0.00 0.00 54.91 54.03 3naf h ALA 988 Cb 1.08 0.60 -0.00 0.00 0.00 0.00 0.00 17.79 19.47 3naf h ALA 988 CO 0.36 0.57 0.01 0.38 0.00 0.00 0.00 179.25 180.57 3naf h ASP 989 N -1.00 0.00 0.72 0.00 2.03 -1.90 -0.28 116.42 115.98 3naf h ASP 989 Ca -0.27 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.03 3naf h ASP 989 Cb 1.22 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.72 3naf h ASP 989 CO -0.17 0.00 -0.84 -0.11 -1.03 0.00 0.00 179.24 177.09 3naf n LEU 990 N -3.23 0.68 0.01 0.15 -0.00 -1.26 -3.87 117.00 109.49 3naf n LEU 990 Ca -0.03 0.15 0.13 0.00 -0.00 0.00 0.00 56.01 56.26 3naf n LEU 990 Cb 0.08 -0.13 0.36 0.00 -0.00 0.00 0.00 43.42 43.73 3naf n LEU 990 CO 0.21 -0.04 0.62 0.61 -0.00 0.00 0.00 177.39 178.79 3naf n GLY 991 N 1.32 -1.36 0.12 -3.96 0.00 -0.12 -3.34 105.19 97.85 3naf n GLY 991 Ca 0.02 -0.25 -0.18 0.00 0.00 0.00 0.00 46.02 45.61 3naf n GLY 991 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3naf h ASP 992 N 0.00 0.48 0.00 1.61 1.82 -1.66 -2.69 116.42 115.99 3naf h ASP 992 Ca 0.00 -0.61 0.00 0.00 -0.39 0.00 0.00 57.03 56.03 3naf h ASP 992 Cb 0.53 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 40.39 3naf h ASP 992 CO 0.00 1.50 0.00 0.61 -1.61 0.00 0.00 179.24 179.74 3naf n GLY 993 N 1.66 1.06 0.00 -0.78 0.00 -1.25 -4.89 105.19 101.00 3naf n GLY 993 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3naf n GLY 993 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3naf n GLY 994 N 2.72 -0.53 2.71 -0.02 0.00 -1.21 -4.07 105.19 104.80 3naf n GLY 994 Ca 0.00 -0.70 -0.00 0.00 0.00 0.00 0.00 46.02 45.32 3naf n GLY 994 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3naf h TYR 996 N 0.42 0.34 -0.68 0.00 3.20 -0.78 0.12 116.97 119.58 3naf h TYR 996 Ca 0.00 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.90 3naf h TYR 996 Cb 0.99 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 39.13 3naf h TYR 996 CO 0.15 -0.06 0.45 0.78 -1.64 0.00 0.00 178.16 177.84 3naf h GLY 997 N 0.12 0.97 2.00 1.82 0.00 -0.59 -1.06 103.07 106.33 3naf h GLY 997 Ca 0.72 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 47.66 3naf h GLY 997 CO -0.23 0.33 -0.21 -0.55 0.00 0.00 0.00 176.54 175.89 3naf h ASP 998 N 0.91 0.00 1.03 0.19 3.32 -0.94 -2.62 116.42 118.30 3naf h ASP 998 Ca 0.26 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.11 3naf h ASP 998 Cb -0.08 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 3naf h ASP 998 CO -0.07 0.21 -0.93 0.25 -1.72 0.00 0.00 179.24 176.99 3naf h LEU 999 N 0.00 0.00 0.18 1.55 6.46 -1.19 -3.07 115.31 119.23 3naf h LEU 999 Ca -0.00 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.75 3naf h LEU 999 Cb 0.46 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.39 3naf h LEU 999 CO 0.03 0.93 -0.08 0.15 -0.62 0.00 0.00 178.44 178.84 3naf h PHE 1000N 0.00 -0.22 0.00 1.25 3.57 -0.86 -2.45 116.94 118.24 3naf h PHE 1000Ca -0.01 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 3naf h PHE 1000Cb 1.69 0.07 0.00 0.00 2.79 0.00 0.00 35.95 40.50 3naf h PHE 1000CO 0.00 0.20 0.00 0.00 -2.23 0.00 0.00 178.31 176.28 3naf n LYS 1002N -1.10 0.65 -0.07 0.00 0.00 -1.16 -3.58 118.16 112.89 3naf n LYS 1002Ca 0.20 -0.12 0.12 0.00 0.00 0.00 0.00 58.31 58.52 3naf n LYS 1002Cb 0.16 -1.58 0.18 0.00 0.00 0.00 0.00 35.03 33.79 3naf n LYS 1002CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3naf n ALA 1003N -2.29 2.46 -0.12 3.14 0.00 -0.92 -3.49 120.51 119.28 3naf n ALA 1003Ca -0.06 -0.78 -0.16 0.00 0.00 0.00 0.00 53.44 52.45 3naf n ALA 1003Cb 0.62 -0.87 -0.13 0.00 0.00 0.00 0.00 19.45 19.06 3naf n ALA 1003CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3naf n LEU 1004N 1.28 2.10 0.01 0.00 0.00 -0.96 -1.21 117.00 118.22 3naf n LEU 1004Ca 0.16 -0.10 -0.15 0.00 0.00 0.00 0.00 56.01 55.92 3naf n LEU 1004Cb 0.57 -0.50 -0.04 0.00 0.00 0.00 0.00 43.42 43.45 3naf n LEU 1004CO 0.15 0.81 0.26 0.11 0.00 0.00 0.00 177.39 178.72 3naf h LYS 1005N 0.00 0.64 0.00 1.96 1.57 -1.72 -2.07 116.57 116.96 3naf h LYS 1005Ca -0.57 -0.56 -0.28 0.00 -1.87 0.00 0.00 60.65 57.38 3naf h LYS 1005Cb 2.00 0.13 -0.05 0.00 0.08 0.00 0.00 32.23 34.39 3naf h LYS 1005CO -0.05 1.17 -1.66 1.15 -0.57 0.00 0.00 179.45 179.49 3naf h THR 1006N 0.42 0.83 0.00 -0.16 2.02 -1.78 -3.41 112.91 110.84 3naf h THR 1006Ca -0.06 -2.65 0.00 0.00 0.77 0.00 0.00 66.41 64.47 3naf h THR 1006Cb 1.43 2.39 0.00 0.00 -1.74 0.00 0.00 68.15 70.23 3naf h THR 1006CO 0.16 0.47 0.00 -1.22 0.37 0.00 0.00 175.52 175.30 3naf n TYR 1007N -3.04 0.00 -2.82 3.16 4.02 -1.24 -5.00 117.16 112.24 3naf n TYR 1007Ca -0.16 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.56 3naf n TYR 1007Cb 1.03 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 40.35 3naf n TYR 1007CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3naf n ASN 1008N -0.07 -4.14 -4.70 7.72 3.02 -0.78 -4.54 115.26 111.77 3naf n ASN 1008Ca 0.00 -0.06 -0.36 0.00 -0.03 0.00 0.00 54.58 54.13 3naf n ASN 1008Cb 0.14 -3.46 -0.09 0.00 -0.61 0.00 0.00 39.78 35.76 3naf n ASN 1008CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3naf s MET 1009N -5.44 4.13 -0.41 3.52 0.23 -0.35 -4.42 119.30 116.55 3naf s MET 1009Ca 0.17 -0.25 -0.14 0.00 -1.03 0.00 0.00 55.69 54.45 3naf s MET 1009Cb -0.09 -3.47 0.03 0.00 -1.53 0.00 0.00 34.83 29.77 3naf s MET 1009CO 0.21 0.19 0.30 -1.17 -2.03 0.00 0.00 175.02 172.52 3naf s LEU 1010N 0.68 5.12 0.28 0.18 0.20 -1.20 -3.65 118.68 120.29 3naf s LEU 1010Ca 0.08 -1.02 -0.29 0.00 0.69 0.00 0.00 54.13 53.59 3naf s LEU 1010Cb -0.12 -2.13 -0.09 0.00 -0.43 0.00 0.00 46.19 43.42 3naf s LEU 1010CO 0.01 -0.47 1.01 0.00 -0.29 0.00 0.00 176.35 176.60 3naf n PHE 1012N 1.11 0.00 -3.71 0.00 1.16 0.23 -4.98 117.46 111.27 3naf n PHE 1012Ca -0.00 0.00 0.01 0.00 -1.87 0.00 0.00 57.45 55.59 3naf n PHE 1012Cb 0.47 0.01 -0.00 0.00 -1.61 0.00 0.00 39.48 38.35 3naf n PHE 1012CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 3naf s GLY 1013N -0.21 -0.32 0.01 4.97 0.00 -1.18 -2.20 107.32 108.39 3naf s GLY 1013Ca 0.00 0.47 -0.02 0.00 0.00 0.00 0.00 44.72 45.18 3naf s GLY 1013CO 0.00 1.25 0.01 -0.42 0.00 0.00 0.00 173.10 173.94 3naf s ILE 1014N -2.40 0.09 -0.56 0.90 1.01 -0.63 -2.31 121.20 117.30 3naf s ILE 1014Ca 0.17 -0.71 0.04 0.00 0.00 0.00 0.00 60.65 60.15 3naf s ILE 1014Cb 0.03 -0.26 0.17 0.00 0.01 0.00 0.00 42.46 42.41 3naf s ILE 1014CO -0.02 -0.39 0.41 -0.47 0.00 0.00 0.00 174.94 174.46 3naf s TYR 1015N -1.20 2.41 0.45 3.97 6.04 -0.13 -1.00 117.35 127.89 3naf s TYR 1015Ca -0.13 -2.84 -0.02 0.00 0.04 0.00 0.00 57.07 54.12 3naf s TYR 1015Cb -0.08 -1.89 -0.01 0.00 -1.04 0.00 0.00 41.96 38.93 3naf s TYR 1015CO -0.00 -0.68 0.70 1.03 -1.54 0.00 0.00 175.55 175.05 3naf s ARG 1016N -0.68 3.23 0.44 4.97 0.52 -1.06 -3.38 118.95 122.99 3naf s ARG 1016Ca 0.28 -0.25 -0.23 0.00 -0.52 0.00 0.00 55.73 55.00 3naf s ARG 1016Cb -0.03 -2.51 -0.08 0.00 0.52 0.00 0.00 34.95 32.86 3naf s ARG 1016CO -0.17 -0.22 1.14 -0.51 0.02 0.00 0.00 175.30 175.56 3naf s LEU 1017N -4.60 4.07 0.05 2.53 2.01 -1.26 -0.89 118.68 120.58 3naf s LEU 1017Ca 0.47 2.25 -0.34 0.00 0.01 0.00 0.00 54.13 56.52 3naf s LEU 1017Cb -0.10 -4.20 -0.19 0.00 0.01 0.00 0.00 46.19 41.71 3naf s LEU 1017CO 0.40 -0.79 1.43 -0.09 1.01 0.00 0.00 176.35 178.31 3naf h ARG 1018N 2.23 -1.19 -5.79 1.70 2.43 -1.65 -3.34 114.38 108.78 3naf h ARG 1018Ca -0.49 0.08 -0.38 0.00 -0.81 0.00 0.00 59.98 58.38 3naf h ARG 1018Cb 1.24 0.27 -0.06 0.00 -0.42 0.00 0.00 29.97 31.00 3naf h ARG 1018CO 0.61 -0.80 0.98 -0.51 -1.51 0.00 0.00 179.97 178.74 3naf s ASP 1019N -4.10 5.49 0.22 -3.80 1.11 -1.26 -4.30 116.67 110.04 3naf s ASP 1019Ca -0.18 -0.99 0.00 0.00 0.18 0.00 0.00 52.55 51.56 3naf s ASP 1019Cb 0.02 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.44 3naf s ASP 1019CO 0.54 -2.45 0.00 0.00 1.18 0.00 0.00 175.17 174.45 3naf n ALA 1020N 12.69 1.66 0.32 5.23 0.00 -1.25 -4.77 120.51 134.39 3naf n ALA 1020Ca 0.39 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.66 3naf n ALA 1020Cb 0.48 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.84 3naf n ALA 1020CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 3naf h HIS 1021N 0.00 -0.91 -3.45 0.00 2.07 -1.85 -3.44 115.15 107.58 3naf h HIS 1021Ca 0.00 -0.01 -0.37 0.00 -2.85 0.00 0.00 60.37 57.14 3naf h HIS 1021Cb 0.00 0.32 -0.14 0.00 2.57 0.00 0.00 27.41 30.16 3naf h HIS 1021CO 0.00 -0.53 -0.63 -1.17 -3.07 0.00 0.00 177.93 172.53 3naf s LEU 1022N -10.10 1.99 0.00 6.12 1.98 -1.26 -4.81 118.68 112.59 3naf s LEU 1022Ca -0.17 -1.30 0.00 0.00 -2.89 0.00 0.00 54.13 49.77 3naf s LEU 1022Cb 0.04 -0.16 0.00 0.00 0.66 0.00 0.00 46.19 46.73 3naf s LEU 1022CO 0.62 -0.61 0.00 -0.24 -1.89 0.00 0.00 176.35 174.23 3naf n SER 1023N -0.46 0.00 -4.08 3.68 2.88 -1.26 -4.19 113.62 110.19 3naf n SER 1023Ca -0.03 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.11 3naf n SER 1023Cb 0.65 -0.15 -0.01 0.00 -0.75 0.00 0.00 64.21 63.95 3naf n SER 1023CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 3naf n THR 1024N -2.00 -2.74 -1.34 2.46 -1.04 -1.26 -4.91 114.28 103.45 3naf n THR 1024Ca 0.00 -0.62 -0.29 0.00 -2.04 0.00 0.00 64.05 61.11 3naf n THR 1024Cb 0.00 -2.28 0.17 0.00 -1.82 0.00 0.00 70.33 66.40 3naf n THR 1024CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3naf s PRO 1025N -7.18 0.56 0.34 -2.82 0.02 -1.26 -4.98 135.00 119.68 3naf s PRO 1025Ca 0.34 0.32 -0.29 0.00 0.02 0.00 0.00 61.00 61.39 3naf s PRO 1025Cb -0.17 -1.77 -0.11 0.00 0.02 0.00 0.00 34.50 32.47 3naf s PRO 1025CO 0.96 -2.60 1.45 -1.54 -0.33 0.00 0.00 177.00 174.94 3naf s SER 1026N -3.79 6.49 0.35 2.53 1.04 -1.26 -4.88 113.70 114.18 3naf s SER 1026Ca 0.65 2.91 0.15 0.00 0.48 0.00 0.00 55.95 60.14 3naf s SER 1026Cb -0.16 -2.65 1.15 0.00 0.10 0.00 0.00 66.02 64.46 3naf s SER 1026CO 0.55 -0.78 1.59 0.06 0.98 0.00 0.00 173.24 175.65 3naf h GLN 1027N 3.54 0.06 0.00 4.02 -0.00 -1.93 -3.46 115.11 117.33 3naf h GLN 1027Ca -0.49 -0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.15 3naf h GLN 1027Cb 1.23 -0.01 0.00 0.00 -0.00 0.00 0.00 27.48 28.70 3naf h GLN 1027CO 0.68 0.04 0.00 0.00 -0.00 0.00 0.00 178.83 179.54 3naf n THR 1029N 0.00 0.00 -1.48 0.00 -1.04 -1.26 -5.12 114.28 105.38 3naf n THR 1029Ca 0.00 0.00 -0.49 0.00 -2.04 0.00 0.00 64.05 61.52 3naf n THR 1029Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 3naf n THR 1029CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3naf n LYS 1030N -0.24 0.45 -3.80 -2.82 4.76 -1.26 -4.87 118.16 110.38 3naf n LYS 1030Ca 0.00 0.16 -0.13 0.00 -2.87 0.00 0.00 58.31 55.47 3naf n LYS 1030Cb 0.00 -1.37 -0.14 0.00 -1.84 0.00 0.00 35.03 31.68 3naf n LYS 1030CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3naf s ARG 1031N -0.91 0.11 0.48 1.97 0.52 -1.26 -1.64 118.95 118.22 3naf s ARG 1031Ca 0.67 0.24 0.02 0.00 -0.52 0.00 0.00 55.73 56.15 3naf s ARG 1031Cb -0.91 -0.05 -0.03 0.00 0.52 0.00 0.00 34.95 34.48 3naf s ARG 1031CO 0.56 -0.08 0.01 1.52 0.02 0.00 0.00 175.30 177.33 3naf s TYR 1032N 0.55 1.99 -0.20 -0.53 -0.85 -0.07 -4.14 117.35 114.09 3naf s TYR 1032Ca -0.04 -0.92 -0.05 0.00 -0.52 0.00 0.00 57.07 55.54 3naf s TYR 1032Cb -0.06 -1.62 -0.03 0.00 0.38 0.00 0.00 41.96 40.64 3naf s TYR 1032CO -0.02 0.24 0.01 0.08 -1.52 0.00 0.00 175.55 174.34 3naf s VAL 1033N -2.87 4.06 -0.44 -3.49 1.01 -1.10 -2.57 120.40 115.00 3naf s VAL 1033Ca 0.12 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.83 3naf s VAL 1033Cb 0.03 -2.84 0.12 0.00 0.00 0.00 0.00 36.38 33.69 3naf s VAL 1033CO 0.06 0.43 0.20 -0.63 0.00 0.00 0.00 175.10 175.17 3naf s ILE 1034N 0.95 2.94 0.14 2.22 1.09 -0.17 -4.70 121.20 123.66 3naf s ILE 1034Ca 0.02 -2.49 -0.28 0.00 -1.10 0.00 0.00 60.65 56.79 3naf s ILE 1034Cb -0.14 -3.04 -0.07 0.00 -1.06 0.00 0.00 42.46 38.15 3naf s ILE 1034CO 0.02 -0.71 0.87 0.28 -0.10 0.00 0.00 174.94 175.30 3naf s THR 1035N 0.65 4.41 -0.84 2.92 -1.32 -1.26 -1.60 115.64 118.59 3naf s THR 1035Ca 0.12 1.90 -0.01 0.00 -1.21 0.00 0.00 61.69 62.49 3naf s THR 1035Cb -0.22 -4.24 0.00 0.00 -1.51 0.00 0.00 72.50 66.54 3naf s THR 1035CO -0.05 0.42 0.60 -3.20 -2.21 0.00 0.00 174.62 170.19 3naf n ASN 1036N 2.18 -4.80 -4.65 8.08 5.15 -0.93 -4.49 115.26 115.80 3naf n ASN 1036Ca -0.02 -0.99 -0.29 0.00 -0.60 0.00 0.00 54.58 52.69 3naf n ASN 1036Cb 0.49 -1.63 0.17 0.00 -0.53 0.00 0.00 39.78 38.27 3naf n ASN 1036CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3naf s PRO 1037N -5.01 0.58 0.75 1.20 0.04 -1.26 -4.95 135.00 126.35 3naf s PRO 1037Ca 0.01 0.33 -0.11 0.00 0.04 0.00 0.00 61.00 61.27 3naf s PRO 1037Cb -0.00 -1.77 0.05 0.00 0.04 0.00 0.00 34.50 32.81 3naf s PRO 1037CO 0.90 -2.59 1.09 -2.14 0.04 0.00 0.00 177.00 174.30 3naf s PRO 1038N -5.16 2.35 0.42 0.56 0.02 -1.26 -4.95 135.00 126.99 3naf s PRO 1038Ca 0.65 1.20 0.10 0.00 0.02 0.00 0.00 61.00 62.97 3naf s PRO 1038Cb -0.16 -1.91 0.90 0.00 0.02 0.00 0.00 34.50 33.36 3naf s PRO 1038CO 0.55 -1.57 2.02 -0.92 -0.33 0.00 0.00 177.00 176.75 3naf h TYR 1039N -0.93 0.32 -0.61 6.54 5.03 -1.95 -2.30 116.97 123.08 3naf h TYR 1039Ca -0.44 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 60.86 3naf h TYR 1039Cb 1.23 -0.10 0.00 0.00 1.55 0.00 0.00 36.73 39.41 3naf h TYR 1039CO 0.57 0.28 0.00 -0.85 -1.32 0.00 0.00 178.16 176.85 3naf n GLU 1040N -4.41 3.84 -2.25 1.82 0.00 -1.26 0.03 120.64 118.41 3naf n GLU 1040Ca 0.00 -2.78 -0.43 0.00 0.00 0.00 0.00 57.16 53.96 3naf n GLU 1040Cb 0.15 -1.95 -0.02 0.00 0.00 0.00 0.00 31.44 29.61 3naf n GLU 1040CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.13 177.25 3naf s PHE 1041N -2.01 2.55 0.56 -1.84 5.36 -0.86 -4.38 117.98 117.36 3naf s PHE 1041Ca 0.49 0.70 -0.21 0.00 -0.96 0.00 0.00 56.93 56.96 3naf s PHE 1041Cb 0.33 -3.67 -0.04 0.00 -0.34 0.00 0.00 43.02 39.30 3naf s PHE 1041CO 0.22 -2.54 1.31 -1.21 -1.46 0.00 0.00 175.22 171.53 3naf s GLU 1042N 3.51 3.06 0.35 10.12 2.02 -1.26 -0.45 118.70 136.05 3naf s GLU 1042Ca 0.62 2.11 0.08 0.00 0.02 0.00 0.00 54.97 57.80 3naf s GLU 1042Cb -0.27 -2.15 -0.04 0.00 0.10 0.00 0.00 34.13 31.77 3naf s GLU 1042CO 0.22 -1.22 0.15 -0.51 0.02 0.00 0.00 175.26 173.92 3naf s LEU 1043N -3.72 3.23 0.02 1.80 1.43 -1.26 -4.76 118.68 115.43 3naf s LEU 1043Ca 0.74 -0.82 0.01 0.00 -1.03 0.00 0.00 54.13 53.02 3naf s LEU 1043Cb -0.38 -1.69 -0.01 0.00 0.03 0.00 0.00 46.19 44.14 3naf s LEU 1043CO 0.43 -0.34 -0.03 0.68 0.23 0.00 0.00 176.35 177.32 3naf s VAL 1044N -2.45 0.21 0.31 -1.59 -7.23 -1.18 -4.46 120.40 104.00 3naf s VAL 1044Ca 0.38 -0.61 0.08 0.00 -1.81 0.00 0.00 61.98 60.03 3naf s VAL 1044Cb -0.02 -0.27 0.32 0.00 0.56 0.00 0.00 36.38 36.97 3naf s VAL 1044CO 0.23 -0.26 1.65 -0.65 -0.31 0.00 0.00 175.10 175.76 3naf h PRO 1045N 5.21 0.26 -2.25 4.82 0.11 -1.82 -2.60 132.00 135.73 3naf h PRO 1045Ca -0.30 -0.02 -0.41 0.00 0.11 0.00 0.00 66.00 65.39 3naf h PRO 1045Cb 1.21 -0.06 -0.08 0.00 0.11 0.00 0.00 31.00 32.18 3naf h PRO 1045CO 0.45 0.17 0.87 0.25 -0.21 0.00 0.00 178.00 179.53 3naf n THR 1046N -5.15 3.55 -4.38 -1.15 -2.24 -1.26 -3.86 114.28 99.79 3naf n THR 1046Ca 0.26 -2.33 -0.29 0.00 -2.27 0.00 0.00 64.05 59.42 3naf n THR 1046Cb 0.83 -2.03 -0.13 0.00 -2.10 0.00 0.00 70.33 66.90 3naf n THR 1046CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3naf s ASP 1047N 1.48 3.42 0.13 3.42 1.11 -0.98 -4.42 116.67 120.83 3naf s ASP 1047Ca 0.64 -0.74 0.08 0.00 0.18 0.00 0.00 52.55 52.72 3naf s ASP 1047Cb 0.30 -0.27 -0.04 0.00 1.07 0.00 0.00 42.92 43.97 3naf s ASP 1047CO -0.07 0.17 -0.12 -0.76 1.18 0.00 0.00 175.17 175.56 3naf s LEU 1048N -2.16 2.91 -0.20 1.23 1.02 -1.22 -3.23 118.68 117.04 3naf s LEU 1048Ca 0.16 -0.50 -0.01 0.00 0.02 0.00 0.00 54.13 53.80 3naf s LEU 1048Cb -0.10 -1.69 0.05 0.00 0.02 0.00 0.00 46.19 44.48 3naf s LEU 1048CO 0.07 0.15 -0.03 -0.63 0.02 0.00 0.00 176.35 175.93 3naf s ILE 1049N -1.35 1.13 0.02 -0.59 1.01 -0.48 -0.95 121.20 119.98 3naf s ILE 1049Ca 0.21 -0.82 -0.30 0.00 0.00 0.00 0.00 60.65 59.74 3naf s ILE 1049Cb -0.10 -1.41 -0.08 0.00 0.01 0.00 0.00 42.46 40.88 3naf s ILE 1049CO 0.13 -0.03 1.74 -0.36 0.00 0.00 0.00 174.94 176.42 3naf s PHE 1050N 1.60 1.98 0.15 3.97 0.08 -0.98 -3.20 117.98 121.58 3naf s PHE 1050Ca -0.02 0.07 -0.00 0.00 0.12 0.00 0.00 56.93 57.09 3naf s PHE 1050Cb -0.17 -4.03 -0.04 0.00 -0.57 0.00 0.00 43.02 38.21 3naf s PHE 1050CO -0.07 -4.34 0.05 0.00 -0.10 0.00 0.00 175.22 170.76 3naf s LEU 1052N -3.09 5.01 0.38 0.00 1.43 -0.69 -2.06 118.68 119.65 3naf s LEU 1052Ca 0.25 -3.14 -0.26 0.00 -1.03 0.00 0.00 54.13 49.96 3naf s LEU 1052Cb 0.07 -1.79 -0.09 0.00 0.03 0.00 0.00 46.19 44.42 3naf s LEU 1052CO 0.03 -0.27 1.12 -0.04 0.23 0.00 0.00 176.35 177.42 3naf s MET 1053N -0.47 4.19 0.33 1.70 -1.94 -0.92 -3.23 119.30 118.96 3naf s MET 1053Ca 0.19 1.73 -0.25 0.00 -1.71 0.00 0.00 55.69 55.66 3naf s MET 1053Cb -0.18 -2.73 -0.10 0.00 2.01 0.00 0.00 34.83 33.83 3naf s MET 1053CO -0.05 -0.17 0.93 -1.14 -0.01 0.00 0.00 175.02 174.58 3naf s GLN 1054N -2.20 4.53 -0.05 2.03 2.00 -1.26 -1.91 119.66 122.79 3naf s GLN 1054Ca 0.55 1.28 -0.30 0.00 -2.00 0.00 0.00 55.36 54.90 3naf s GLN 1054Cb -0.28 -2.73 -0.06 0.00 0.80 0.00 0.00 33.01 30.73 3naf s GLN 1054CO 0.36 0.25 1.77 0.12 -0.50 0.00 0.00 175.29 177.29 3naf s PHE 1055N -1.68 1.75 0.29 1.67 5.36 -1.26 -4.96 117.98 119.15 3naf s PHE 1055Ca 0.51 0.06 0.07 0.00 -0.96 0.00 0.00 56.93 56.61 3naf s PHE 1055Cb -0.17 -4.02 -0.03 0.00 -0.34 0.00 0.00 43.02 38.46 3naf s PHE 1055CO 0.22 -4.27 0.28 0.34 -1.46 0.00 0.00 175.22 170.34 3naf s ASP 1056N 4.00 5.63 -1.04 6.13 2.15 -1.26 -4.88 116.67 127.39 3naf s ASP 1056Ca 0.79 -0.27 -0.06 0.00 0.43 0.00 0.00 52.55 53.44 3naf s ASP 1056Cb -0.35 -1.32 0.26 0.00 -0.30 0.00 0.00 42.92 41.21 3naf s ASP 1056CO 0.33 -0.19 1.04 1.41 -0.17 0.00 0.00 175.17 177.59 3naf n HIS 1057N -1.33 4.75 -3.44 -5.34 8.25 -1.26 -5.01 115.22 111.84 3naf n HIS 1057Ca -0.05 -3.90 -0.22 0.00 -0.26 0.00 0.00 57.72 53.29 3naf n HIS 1057Cb 0.58 -1.49 0.01 0.00 1.12 0.00 0.00 29.99 30.21 3naf n HIS 1057CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 3naf s ASN 1058N 0.59 5.01 0.00 0.41 0.01 -1.26 -5.27 114.94 114.42 3naf s ASN 1058Ca 0.30 -0.89 0.00 0.00 -0.71 0.00 0.00 52.86 51.56 3naf s ASN 1058Cb -0.08 -0.02 0.00 0.00 0.41 0.00 0.00 41.25 41.57 3naf s ASN 1058CO -0.08 -1.01 0.13 0.00 -1.51 0.00 0.00 177.10 174.62