#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ha0 s SER 337 N 0.00 -0.38 0.08 4.52 1.04 -0.97 -5.04 113.70 112.95 3ha0 s SER 337 Ca 0.00 0.72 0.08 0.00 0.48 0.00 0.00 55.95 57.23 3ha0 s SER 337 Cb 0.00 0.71 -0.04 0.00 0.10 0.00 0.00 66.02 66.79 3ha0 s SER 337 CO 0.00 -0.13 -0.16 0.00 0.98 0.00 0.00 173.24 173.92 3ha0 s ALA 338 N 0.39 2.71 -0.00 5.32 0.00 -1.26 -1.60 121.76 127.31 3ha0 s ALA 338 Ca -0.02 -1.26 0.02 0.00 0.00 0.00 0.00 51.96 50.70 3ha0 s ALA 338 Cb -0.04 -0.74 -0.01 0.00 0.00 0.00 0.00 23.12 22.33 3ha0 s ALA 338 CO -0.02 0.60 -0.07 0.71 0.00 0.00 0.00 175.76 176.98 3ha0 s TYR 339 N -1.07 0.59 -0.15 0.00 1.51 0.15 -4.99 117.35 113.38 3ha0 s TYR 339 Ca 0.17 -0.13 0.00 0.00 -1.01 0.00 0.00 57.07 56.10 3ha0 s TYR 339 Cb -0.11 -0.38 0.03 0.00 -0.11 0.00 0.00 41.96 41.40 3ha0 s TYR 339 CO 0.09 -0.01 -0.10 -1.17 -1.11 0.00 0.00 175.55 173.24 3ha0 s LEU 340 N -0.23 1.65 0.49 -1.29 2.96 -1.26 -0.05 118.68 120.94 3ha0 s LEU 340 Ca 0.02 -0.54 0.04 0.00 -0.22 0.00 0.00 54.13 53.42 3ha0 s LEU 340 Cb -0.03 -1.06 0.02 0.00 0.50 0.00 0.00 46.19 45.62 3ha0 s LEU 340 CO -0.00 -0.11 0.68 -0.94 -1.32 0.00 0.00 176.35 174.66 3ha0 s SER 341 N 1.55 5.50 0.32 3.68 1.04 -1.07 -4.87 113.70 119.85 3ha0 s SER 341 Ca 0.03 -0.12 0.07 0.00 0.48 0.00 0.00 55.95 56.41 3ha0 s SER 341 Cb -0.14 -0.90 -0.02 0.00 0.10 0.00 0.00 66.02 65.06 3ha0 s SER 341 CO -0.09 -0.93 0.37 -0.13 0.98 0.00 0.00 173.24 173.44 3ha0 s ARG 342 N -4.57 2.99 0.38 4.02 0.52 -1.26 -4.34 118.95 116.69 3ha0 s ARG 342 Ca 0.55 -1.10 -0.27 0.00 -0.52 0.00 0.00 55.73 54.40 3ha0 s ARG 342 Cb -0.10 -2.68 -0.09 0.00 0.52 0.00 0.00 34.95 32.60 3ha0 s ARG 342 CO 0.36 0.14 1.28 -2.14 0.02 0.00 0.00 175.30 174.96 3ha0 s PRO 343 N -4.06 4.09 0.43 3.54 0.02 -1.25 -4.90 135.00 132.87 3ha0 s PRO 343 Ca 0.41 2.12 -0.24 0.00 0.02 0.00 0.00 61.00 63.31 3ha0 s PRO 343 Cb -0.08 -2.83 -0.08 0.00 0.02 0.00 0.00 34.50 31.53 3ha0 s PRO 343 CO 0.29 -0.38 1.19 -1.54 -0.33 0.00 0.00 177.00 176.23 3ha0 s SER 344 N -0.74 6.30 0.33 2.53 1.04 -1.26 -4.89 113.70 117.01 3ha0 s SER 344 Ca 0.55 2.38 0.06 0.00 0.48 0.00 0.00 55.95 59.42 3ha0 s SER 344 Cb -0.37 -2.61 0.72 0.00 0.10 0.00 0.00 66.02 63.85 3ha0 s SER 344 CO 0.48 -0.83 1.87 -0.65 0.98 0.00 0.00 173.24 175.09 3ha0 h PRO 345 N 2.35 0.79 0.70 4.02 0.11 -1.89 -0.96 132.00 137.13 3ha0 h PRO 345 Ca -0.49 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.54 3ha0 h PRO 345 Cb 1.24 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3ha0 h PRO 345 CO 0.61 0.52 -0.48 0.35 -0.21 0.00 0.00 178.00 178.79 3ha0 h PHE 346 N 0.81 -1.30 -0.77 0.65 3.57 -1.91 0.42 116.94 118.41 3ha0 h PHE 346 Ca 0.45 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.98 3ha0 h PHE 346 Cb 0.58 0.47 -0.04 0.00 2.79 0.00 0.00 35.95 39.75 3ha0 h PHE 346 CO -0.00 -0.70 0.51 -0.44 -2.23 0.00 0.00 178.31 175.44 3ha0 h ASP 347 N -1.13 0.80 0.10 0.41 3.45 -1.83 0.17 116.42 118.39 3ha0 h ASP 347 Ca -0.09 -0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.36 3ha0 h ASP 347 Cb 0.92 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 39.51 3ha0 h ASP 347 CO 0.06 0.55 -0.05 0.25 -1.57 0.00 0.00 179.24 178.48 3ha0 h LEU 348 N 0.93 -0.11 0.00 1.55 5.85 -0.81 0.15 115.31 122.87 3ha0 h LEU 348 Ca 0.31 -0.35 -0.37 0.00 0.84 0.00 0.00 57.88 58.30 3ha0 h LEU 348 Cb 0.07 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.06 3ha0 h LEU 348 CO -0.09 0.31 -2.39 0.49 -0.34 0.00 0.00 178.44 176.42 3ha0 n PHE 349 N -4.95 0.05 -0.11 1.25 3.01 0.14 -3.62 117.46 113.23 3ha0 n PHE 349 Ca -0.09 0.02 -0.25 0.00 1.01 0.00 0.00 57.45 58.14 3ha0 n PHE 349 Cb 0.24 -1.01 -0.11 0.00 -0.01 0.00 0.00 39.48 38.59 3ha0 n PHE 349 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 3ha0 n ILE 350 N -2.91 1.55 0.24 4.37 2.08 0.53 -4.37 119.36 120.84 3ha0 n ILE 350 Ca -0.36 -0.31 0.12 0.00 0.56 0.00 0.00 62.75 62.75 3ha0 n ILE 350 Cb 1.11 -1.87 0.12 0.00 -0.75 0.00 0.00 39.64 38.25 3ha0 n ILE 350 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 3ha0 h ARG 351 N -0.79 0.00 -5.45 0.38 3.08 -1.50 -3.48 114.38 106.61 3ha0 h ARG 351 Ca -0.55 0.00 -0.41 0.00 0.07 0.00 0.00 59.98 59.08 3ha0 h ARG 351 Cb 1.59 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.61 3ha0 h ARG 351 CO -0.27 0.00 -0.63 1.63 -1.07 0.00 0.00 179.97 179.63 3ha0 n LYS 352 N -2.76 -4.48 -3.26 0.04 5.02 -0.06 -4.91 118.16 107.76 3ha0 n LYS 352 Ca 0.02 0.63 -0.22 0.00 -2.02 0.00 0.00 58.31 56.72 3ha0 n LYS 352 Cb 0.52 -5.44 -0.08 0.00 -0.02 0.00 0.00 35.03 30.02 3ha0 n LYS 352 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3ha0 s SER 353 N -2.89 0.85 0.48 4.39 1.04 0.34 -4.85 113.70 113.06 3ha0 s SER 353 Ca 0.46 -2.70 -0.19 0.00 0.48 0.00 0.00 55.95 54.00 3ha0 s SER 353 Cb -0.23 0.09 -0.09 0.00 0.10 0.00 0.00 66.02 65.89 3ha0 s SER 353 CO 0.56 -0.15 0.98 -2.16 0.98 0.00 0.00 173.24 173.45 3ha0 s PRO 354 N 0.32 4.01 0.07 4.02 0.04 -1.21 -4.70 135.00 137.55 3ha0 s PRO 354 Ca 0.31 1.07 0.00 0.00 0.04 0.00 0.00 61.00 62.42 3ha0 s PRO 354 Cb 0.01 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 3ha0 s PRO 354 CO -0.15 -0.22 -0.05 0.95 0.04 0.00 0.00 177.00 177.56 3ha0 s THR 355 N -2.39 0.45 0.20 1.26 -4.23 -1.26 -1.80 115.64 107.87 3ha0 s THR 355 Ca 0.61 -1.83 0.10 0.00 -1.18 0.00 0.00 61.69 59.39 3ha0 s THR 355 Cb -0.10 -1.55 -0.04 0.00 1.34 0.00 0.00 72.50 72.14 3ha0 s THR 355 CO 0.24 -0.91 -0.20 0.27 -0.54 0.00 0.00 174.62 173.47 3ha0 s ILE 356 N -3.66 2.10 -0.05 2.99 -4.36 0.01 -3.95 121.20 114.28 3ha0 s ILE 356 Ca 0.08 -2.07 0.03 0.00 -0.26 0.00 0.00 60.65 58.44 3ha0 s ILE 356 Cb 0.06 -2.03 0.00 0.00 1.25 0.00 0.00 42.46 41.74 3ha0 s ILE 356 CO -0.07 -0.29 -0.14 -0.89 0.24 0.00 0.00 174.94 173.79 3ha0 s THR 357 N -2.09 1.23 -0.54 8.37 2.01 -1.26 -1.03 115.64 122.33 3ha0 s THR 357 Ca 0.20 -0.58 -0.16 0.00 0.31 0.00 0.00 61.69 61.46 3ha0 s THR 357 Cb -0.06 -1.09 0.12 0.00 0.01 0.00 0.00 72.50 71.49 3ha0 s THR 357 CO 0.09 0.37 0.52 0.00 -0.69 0.00 0.00 174.62 174.91 3ha0 s LEU 359 N 1.74 4.35 -0.24 0.00 2.96 0.92 -2.47 118.68 125.94 3ha0 s LEU 359 Ca 0.04 1.19 0.02 0.00 -0.22 0.00 0.00 54.13 55.16 3ha0 s LEU 359 Cb -0.29 -3.05 0.06 0.00 0.50 0.00 0.00 46.19 43.41 3ha0 s LEU 359 CO 0.04 -0.06 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.23 3ha0 s VAL 360 N 0.53 1.84 -0.34 1.68 1.01 0.27 -0.67 120.40 124.72 3ha0 s VAL 360 Ca 0.36 -1.36 -0.15 0.00 0.00 0.00 0.00 61.98 60.83 3ha0 s VAL 360 Cb -0.18 -1.99 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 3ha0 s VAL 360 CO 0.18 -0.01 0.34 -0.69 0.00 0.00 0.00 175.10 174.92 3ha0 s VAL 361 N 1.26 5.19 -0.37 2.92 1.01 -0.63 -1.89 120.40 127.89 3ha0 s VAL 361 Ca -0.06 -0.01 -0.04 0.00 0.00 0.00 0.00 61.98 61.87 3ha0 s VAL 361 Cb -0.19 -3.81 0.08 0.00 0.00 0.00 0.00 36.38 32.46 3ha0 s VAL 361 CO -0.06 -0.09 0.15 -0.62 0.00 0.00 0.00 175.10 174.47 3ha0 s ASP 362 N 1.73 5.22 0.51 3.32 2.15 -0.57 -2.30 116.67 126.73 3ha0 s ASP 362 Ca 0.11 -1.65 0.32 0.00 0.43 0.00 0.00 52.55 51.76 3ha0 s ASP 362 Cb -0.17 -1.82 1.32 0.00 -0.30 0.00 0.00 42.92 41.94 3ha0 s ASP 362 CO 0.11 -0.44 1.95 -0.07 -0.17 0.00 0.00 175.17 176.55 3ha0 h LEU 363 N 8.11 0.00 -7.08 -1.34 3.38 -1.92 -1.81 115.31 114.65 3ha0 h LEU 363 Ca -0.18 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.17 3ha0 h LEU 363 Cb 1.06 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.40 3ha0 h LEU 363 CO 0.65 0.00 -0.68 0.00 0.09 0.00 0.00 178.44 178.50 3ha0 s ALA 364 N -3.62 2.88 -0.52 1.53 0.00 -1.26 -4.72 121.76 116.04 3ha0 s ALA 364 Ca 0.02 -3.12 -0.26 0.00 0.00 0.00 0.00 51.96 48.60 3ha0 s ALA 364 Cb 0.09 -2.02 -0.08 0.00 0.00 0.00 0.00 23.12 21.11 3ha0 s ALA 364 CO 0.52 -2.05 2.43 -2.30 0.00 0.00 0.00 175.76 174.36 3ha0 n PRO 365 N 2.94 0.98 -4.09 0.00 -0.02 -1.26 -4.95 135.00 128.60 3ha0 n PRO 365 Ca 0.12 -0.07 -0.27 0.00 -2.02 0.00 0.00 63.50 61.26 3ha0 n PRO 365 Cb 0.35 -3.43 -0.06 0.00 -0.02 0.00 0.00 33.50 30.34 3ha0 n PRO 365 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3ha0 s SER 366 N 12.11 5.42 0.53 2.55 0.15 -1.26 -5.09 113.70 128.10 3ha0 s SER 366 Ca 0.99 -0.14 -0.22 0.00 0.70 0.00 0.00 55.95 57.27 3ha0 s SER 366 Cb -0.19 -1.39 -0.05 0.00 -1.71 0.00 0.00 66.02 62.67 3ha0 s SER 366 CO 0.25 0.09 1.34 -0.54 1.20 0.00 0.00 173.24 175.59 3ha0 s LYS 367 N -2.95 3.24 0.00 5.44 -0.14 -1.26 -4.86 119.74 119.21 3ha0 s LYS 367 Ca 0.30 2.20 0.00 0.00 -1.36 0.00 0.00 55.97 57.11 3ha0 s LYS 367 Cb -0.10 -2.30 0.00 0.00 -1.68 0.00 0.00 37.83 33.75 3ha0 s LYS 367 CO 0.22 -1.10 0.00 0.41 -0.76 0.00 0.00 175.35 174.13 3ha0 n GLY 368 N 0.69 3.11 3.70 -3.33 0.00 -1.26 -4.88 105.19 103.20 3ha0 n GLY 368 Ca 0.10 -1.42 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 3ha0 n GLY 368 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ha0 s THR 369 N -0.42 4.22 0.33 2.61 2.01 -1.26 -4.82 115.64 118.31 3ha0 s THR 369 Ca 0.00 1.57 -0.27 0.00 0.31 0.00 0.00 61.69 63.30 3ha0 s THR 369 Cb 0.00 -4.00 -0.09 0.00 0.01 0.00 0.00 72.50 68.41 3ha0 s THR 369 CO 0.00 0.04 1.00 -0.69 -0.69 0.00 0.00 174.62 174.29 3ha0 s VAL 370 N 1.79 3.91 -0.13 3.82 1.01 -1.26 -4.59 120.40 124.95 3ha0 s VAL 370 Ca 0.57 1.65 -0.02 0.00 0.00 0.00 0.00 61.98 64.18 3ha0 s VAL 370 Cb -0.26 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.15 3ha0 s VAL 370 CO 0.25 0.19 -0.07 -1.10 0.00 0.00 0.00 175.10 174.37 3ha0 s GLN 371 N -1.95 3.43 -0.32 2.72 -1.52 -0.60 -4.98 119.66 116.44 3ha0 s GLN 371 Ca 0.50 -0.57 0.03 0.00 -1.95 0.00 0.00 55.36 53.37 3ha0 s GLN 371 Cb -0.23 -2.78 0.09 0.00 -0.22 0.00 0.00 33.01 29.88 3ha0 s GLN 371 CO 0.29 0.31 0.03 -0.51 -0.25 0.00 0.00 175.29 175.16 3ha0 s LEU 372 N 0.15 3.96 -0.17 2.90 1.43 -1.26 -1.35 118.68 124.33 3ha0 s LEU 372 Ca -0.03 -1.89 -0.09 0.00 -1.03 0.00 0.00 54.13 51.09 3ha0 s LEU 372 Cb -0.14 -1.44 -0.05 0.00 0.03 0.00 0.00 46.19 44.60 3ha0 s LEU 372 CO 0.03 -0.35 0.13 -0.89 0.23 0.00 0.00 176.35 175.50 3ha0 s THR 373 N 1.10 5.38 0.06 5.49 2.01 -0.47 -4.93 115.64 124.29 3ha0 s THR 373 Ca 0.07 0.17 0.00 0.00 0.31 0.00 0.00 61.69 62.25 3ha0 s THR 373 Cb -0.19 -3.41 -0.04 0.00 0.01 0.00 0.00 72.50 68.87 3ha0 s THR 373 CO -0.11 0.50 0.20 0.26 -0.69 0.00 0.00 174.62 174.78 3ha0 s TRP 374 N -0.10 3.50 0.12 4.92 0.52 -1.26 -0.88 118.94 125.76 3ha0 s TRP 374 Ca 0.10 0.24 -0.24 0.00 0.02 0.00 0.00 56.10 56.21 3ha0 s TRP 374 Cb -0.11 -1.75 0.08 0.00 -1.15 0.00 0.00 33.47 30.53 3ha0 s TRP 374 CO 0.00 0.59 0.67 -1.54 0.02 0.00 0.00 176.95 176.69 3ha0 s SER 375 N -2.50 -0.52 0.20 2.95 1.04 -0.48 -4.95 113.70 109.44 3ha0 s SER 375 Ca 0.35 0.00 0.07 0.00 0.48 0.00 0.00 55.95 56.85 3ha0 s SER 375 Cb -0.13 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.50 3ha0 s SER 375 CO 0.28 -0.88 0.03 -0.13 0.98 0.00 0.00 173.24 173.52 3ha0 s ARG 376 N -3.58 2.50 0.25 4.02 0.52 -1.26 0.09 118.95 121.48 3ha0 s ARG 376 Ca 0.02 -1.12 0.03 0.00 -0.52 0.00 0.00 55.73 54.14 3ha0 s ARG 376 Cb -0.01 -2.38 0.30 0.00 0.52 0.00 0.00 34.95 33.38 3ha0 s ARG 376 CO -0.12 0.44 1.61 0.00 0.02 0.00 0.00 175.30 177.25 3ha0 h ALA 377 N 2.41 0.92 0.00 2.13 0.00 -1.49 -2.75 119.26 120.48 3ha0 h ALA 377 Ca -0.47 -0.48 -0.09 0.00 0.00 0.00 0.00 54.91 53.88 3ha0 h ALA 377 Cb 1.21 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 3ha0 h ALA 377 CO 0.59 0.66 -0.41 0.66 0.00 0.00 0.00 179.25 180.76 3ha0 h SER 378 N 0.25 0.00 0.00 0.00 4.64 -1.96 -3.47 113.55 113.01 3ha0 h SER 378 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3ha0 h SER 378 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 3ha0 h SER 378 CO 0.08 0.41 0.00 0.61 -0.87 0.00 0.00 176.83 177.06 3ha0 n GLY 379 N 0.22 0.68 3.93 -0.77 0.00 -1.04 -5.08 105.19 103.13 3ha0 n GLY 379 Ca -0.00 -0.51 -0.25 0.00 0.00 0.00 0.00 46.02 45.25 3ha0 n GLY 379 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ha0 s LYS 380 N -0.99 2.99 0.25 1.61 1.02 -1.26 -4.97 119.74 118.38 3ha0 s LYS 380 Ca 0.00 -0.15 -0.30 0.00 0.02 0.00 0.00 55.97 55.55 3ha0 s LYS 380 Cb 0.00 -2.36 -0.09 0.00 -0.52 0.00 0.00 37.83 34.85 3ha0 s LYS 380 CO 0.00 -0.55 1.27 -2.14 -0.92 0.00 0.00 175.35 173.01 3ha0 s PRO 381 N -4.85 4.42 0.28 -1.68 0.02 -1.26 -4.39 135.00 127.54 3ha0 s PRO 381 Ca 0.52 2.05 -0.08 0.00 0.02 0.00 0.00 61.00 63.51 3ha0 s PRO 381 Cb -0.10 -3.16 -0.07 0.00 0.02 0.00 0.00 34.50 31.19 3ha0 s PRO 381 CO 0.43 -0.16 0.59 0.14 -0.33 0.00 0.00 177.00 177.68 3ha0 s VAL 382 N -0.42 4.93 0.93 3.83 -7.23 -1.26 -5.02 120.40 116.15 3ha0 s VAL 382 Ca 0.53 0.38 -0.14 0.00 -1.81 0.00 0.00 61.98 60.94 3ha0 s VAL 382 Cb -0.37 -3.67 0.15 0.00 0.56 0.00 0.00 36.38 33.06 3ha0 s VAL 382 CO 0.43 -0.23 1.18 -1.10 -0.31 0.00 0.00 175.10 175.07 3ha0 s GLN 383 N -3.22 0.97 0.19 4.82 -0.21 -1.26 -4.99 119.66 115.95 3ha0 s GLN 383 Ca 0.47 0.07 -0.31 0.00 0.02 0.00 0.00 55.36 55.61 3ha0 s GLN 383 Cb -0.11 -1.84 -0.09 0.00 1.00 0.00 0.00 33.01 31.97 3ha0 s GLN 383 CO 0.25 -2.27 1.45 -1.58 -2.12 0.00 0.00 175.29 171.03 3ha0 s HIS 384 N -3.45 3.11 0.37 0.91 5.65 -1.26 -4.89 115.29 115.73 3ha0 s HIS 384 Ca 0.66 0.91 0.07 0.00 0.25 0.00 0.00 55.06 56.96 3ha0 s HIS 384 Cb -0.11 -3.79 -0.01 0.00 -1.18 0.00 0.00 32.58 27.49 3ha0 s HIS 384 CO 0.53 -2.74 0.45 -1.54 -0.65 0.00 0.00 174.74 170.79 3ha0 s SER 385 N 0.77 5.62 -0.24 9.88 1.04 -1.26 -4.55 113.70 124.96 3ha0 s SER 385 Ca 0.63 -0.39 -0.03 0.00 0.48 0.00 0.00 55.95 56.64 3ha0 s SER 385 Cb -0.41 -0.93 0.01 0.00 0.10 0.00 0.00 66.02 64.79 3ha0 s SER 385 CO 0.36 -0.54 -0.04 -0.89 0.98 0.00 0.00 173.24 173.11 3ha0 s THR 386 N -2.29 3.21 0.14 2.02 2.01 -0.14 -4.94 115.64 115.65 3ha0 s THR 386 Ca 0.47 -0.73 -0.13 0.00 0.31 0.00 0.00 61.69 61.61 3ha0 s THR 386 Cb -0.08 -2.54 -0.07 0.00 0.01 0.00 0.00 72.50 69.82 3ha0 s THR 386 CO 0.30 0.31 0.53 -0.60 -0.69 0.00 0.00 174.62 174.47 3ha0 s ARG 387 N 1.42 3.94 -0.17 4.92 3.52 -1.26 -1.24 118.95 130.07 3ha0 s ARG 387 Ca 0.03 0.44 -0.15 0.00 -0.13 0.00 0.00 55.73 55.92 3ha0 s ARG 387 Cb -0.15 -2.92 0.05 0.00 -1.56 0.00 0.00 34.95 30.36 3ha0 s ARG 387 CO -0.03 0.48 0.46 0.21 -0.81 0.00 0.00 175.30 175.60 3ha0 s LYS 388 N -2.01 0.51 0.03 5.12 2.20 -0.24 -5.00 119.74 120.36 3ha0 s LYS 388 Ca 0.38 0.68 0.04 0.00 -0.36 0.00 0.00 55.97 56.71 3ha0 s LYS 388 Cb -0.15 0.21 -0.02 0.00 -1.51 0.00 0.00 37.83 36.36 3ha0 s LYS 388 CO 0.19 -0.08 -0.12 -1.21 -0.36 0.00 0.00 175.35 173.77 3ha0 s GLU 389 N 0.49 0.79 -0.28 4.03 2.02 -1.26 -1.43 118.70 123.07 3ha0 s GLU 389 Ca -0.02 -0.69 -0.25 0.00 0.02 0.00 0.00 54.97 54.04 3ha0 s GLU 389 Cb -0.04 -0.75 0.10 0.00 0.10 0.00 0.00 34.13 33.53 3ha0 s GLU 389 CO -0.02 0.18 0.88 -1.83 0.02 0.00 0.00 175.26 174.49 3ha0 s GLU 390 N -1.09 0.66 -0.15 1.61 -1.05 -0.98 -5.03 118.70 112.66 3ha0 s GLU 390 Ca -0.01 0.80 -0.14 0.00 -0.15 0.00 0.00 54.97 55.47 3ha0 s GLU 390 Cb -0.08 0.32 -0.05 0.00 -0.44 0.00 0.00 34.13 33.89 3ha0 s GLU 390 CO 0.01 -0.08 0.32 0.15 0.95 0.00 0.00 175.26 176.60 3ha0 s LYS 391 N 0.34 4.25 0.80 -4.83 1.02 -1.26 -1.23 119.74 118.83 3ha0 s LYS 391 Ca 0.01 0.14 -0.10 0.00 0.02 0.00 0.00 55.97 56.04 3ha0 s LYS 391 Cb -0.05 -3.42 0.11 0.00 -0.52 0.00 0.00 37.83 33.95 3ha0 s LYS 391 CO -0.03 0.25 1.14 -0.65 -0.92 0.00 0.00 175.35 175.13 3ha0 s GLN 392 N 0.43 1.70 0.44 1.68 -1.52 0.13 -4.97 119.66 117.55 3ha0 s GLN 392 Ca 0.18 -0.26 0.24 0.00 -1.95 0.00 0.00 55.36 53.57 3ha0 s GLN 392 Cb -0.13 -2.04 0.80 0.00 -0.22 0.00 0.00 33.01 31.42 3ha0 s GLN 392 CO 0.05 -1.66 1.77 0.07 -0.25 0.00 0.00 175.29 175.27 3ha0 h ARG 393 N -0.99 0.00 -1.13 2.91 0.11 -1.99 -3.21 114.38 110.08 3ha0 h ARG 393 Ca -0.44 0.00 -0.46 0.00 0.10 0.00 0.00 59.98 59.17 3ha0 h ARG 393 Cb 1.30 0.00 -0.23 0.00 1.11 0.00 0.00 29.97 32.15 3ha0 h ARG 393 CO 0.55 0.20 0.60 0.27 0.10 0.00 0.00 179.97 181.69 3ha0 n ASN 394 N -3.29 5.58 -1.78 0.08 6.94 -1.26 -4.85 115.26 116.69 3ha0 n ASN 394 Ca 0.01 -3.36 -0.18 0.00 -0.02 0.00 0.00 54.58 51.03 3ha0 n ASN 394 Cb 0.46 -0.90 -0.03 0.00 -2.36 0.00 0.00 39.78 36.95 3ha0 n ASN 394 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3ha0 n GLY 395 N -0.53 0.45 3.60 4.83 0.00 -1.21 -4.99 105.19 107.34 3ha0 n GLY 395 Ca 0.47 -0.15 -0.31 0.00 0.00 0.00 0.00 46.02 46.03 3ha0 n GLY 395 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ha0 s THR 396 N -2.80 3.59 -0.10 2.61 2.01 -1.26 -4.54 115.64 115.14 3ha0 s THR 396 Ca 0.00 -1.01 -0.03 0.00 0.31 0.00 0.00 61.69 60.96 3ha0 s THR 396 Cb 0.00 -2.63 -0.03 0.00 0.01 0.00 0.00 72.50 69.85 3ha0 s THR 396 CO 0.00 0.24 0.02 -0.22 -0.69 0.00 0.00 174.62 173.97 3ha0 s LEU 397 N -1.87 3.68 -0.25 4.42 2.96 -0.68 0.20 118.68 127.14 3ha0 s LEU 397 Ca 0.20 0.16 0.01 0.00 -0.22 0.00 0.00 54.13 54.28 3ha0 s LEU 397 Cb -0.11 -1.86 0.07 0.00 0.50 0.00 0.00 46.19 44.78 3ha0 s LEU 397 CO 0.12 0.35 -0.04 -0.89 -1.32 0.00 0.00 176.35 174.56 3ha0 s THR 398 N -0.69 1.63 -0.15 3.68 2.01 -0.36 -1.52 115.64 120.23 3ha0 s THR 398 Ca 0.11 -1.37 -0.02 0.00 0.31 0.00 0.00 61.69 60.72 3ha0 s THR 398 Cb -0.12 -1.91 -0.02 0.00 0.01 0.00 0.00 72.50 70.46 3ha0 s THR 398 CO 0.02 -0.16 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.02 3ha0 s VAL 399 N 1.33 3.47 0.03 3.82 1.01 -0.79 -2.32 120.40 126.95 3ha0 s VAL 399 Ca -0.04 -0.50 0.05 0.00 0.00 0.00 0.00 61.98 61.48 3ha0 s VAL 399 Cb -0.19 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.67 3ha0 s VAL 399 CO -0.07 0.50 -0.14 0.42 0.00 0.00 0.00 175.10 175.80 3ha0 s THR 400 N 0.51 1.11 -0.09 3.92 -4.23 -0.51 -0.56 115.64 115.77 3ha0 s THR 400 Ca -0.06 -0.91 0.01 0.00 -1.18 0.00 0.00 61.69 59.55 3ha0 s THR 400 Cb -0.15 -0.99 0.02 0.00 1.34 0.00 0.00 72.50 72.72 3ha0 s THR 400 CO 0.03 0.07 -0.11 -0.55 -0.54 0.00 0.00 174.62 173.53 3ha0 s SER 401 N -0.96 2.05 -0.17 3.99 0.15 -1.03 -1.08 113.70 116.65 3ha0 s SER 401 Ca 0.02 -0.32 -0.04 0.00 0.70 0.00 0.00 55.95 56.32 3ha0 s SER 401 Cb -0.07 -0.87 -0.02 0.00 -1.71 0.00 0.00 66.02 63.34 3ha0 s SER 401 CO 0.01 -0.04 -0.04 -0.89 1.20 0.00 0.00 173.24 173.48 3ha0 s THR 402 N 1.19 3.70 -0.15 6.45 2.01 -0.37 -0.97 115.64 127.49 3ha0 s THR 402 Ca -0.04 -0.41 -0.01 0.00 0.31 0.00 0.00 61.69 61.54 3ha0 s THR 402 Cb -0.14 -2.64 -0.01 0.00 0.01 0.00 0.00 72.50 69.72 3ha0 s THR 402 CO -0.03 0.47 -0.11 -0.22 -0.69 0.00 0.00 174.62 174.04 3ha0 s LEU 403 N 0.70 2.72 0.11 4.42 2.96 -0.20 -0.97 118.68 128.42 3ha0 s LEU 403 Ca -0.02 -0.36 -0.30 0.00 -0.22 0.00 0.00 54.13 53.23 3ha0 s LEU 403 Cb -0.15 -1.63 -0.06 0.00 0.50 0.00 0.00 46.19 44.85 3ha0 s LEU 403 CO 0.02 0.11 0.95 -2.16 -1.32 0.00 0.00 176.35 173.95 3ha0 s PRO 404 N 0.68 4.69 0.31 0.98 0.04 -1.26 -0.81 135.00 139.63 3ha0 s PRO 404 Ca -0.06 1.44 0.11 0.00 0.04 0.00 0.00 61.00 62.53 3ha0 s PRO 404 Cb -0.15 -3.37 -0.06 0.00 0.04 0.00 0.00 34.50 30.96 3ha0 s PRO 404 CO 0.02 0.22 -0.15 0.14 0.04 0.00 0.00 177.00 177.28 3ha0 s VAL 405 N -0.03 2.41 0.32 -0.36 -7.23 -0.75 -4.55 120.40 110.21 3ha0 s VAL 405 Ca 0.46 -2.31 -0.24 0.00 -1.81 0.00 0.00 61.98 58.08 3ha0 s VAL 405 Cb -0.23 -2.47 -0.10 0.00 0.56 0.00 0.00 36.38 34.15 3ha0 s VAL 405 CO 0.30 -0.31 0.91 -0.83 -0.31 0.00 0.00 175.10 174.85 3ha0 s GLY 406 N -3.56 2.73 0.02 2.32 0.00 -1.26 -4.18 107.32 103.38 3ha0 s GLY 406 Ca 0.31 0.45 -0.16 0.00 0.00 0.00 0.00 44.72 45.32 3ha0 s GLY 406 CO 0.16 0.86 1.06 -0.84 0.00 0.00 0.00 173.10 174.34 3ha0 h THR 407 N 2.56 0.00 -0.77 0.90 2.02 -1.94 -2.12 112.91 113.56 3ha0 h THR 407 Ca -0.47 -0.09 0.15 0.00 0.77 0.00 0.00 66.41 66.78 3ha0 h THR 407 Cb 1.19 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 67.50 3ha0 h THR 407 CO 0.65 0.00 0.30 -0.09 0.37 0.00 0.00 175.52 176.75 3ha0 h ARG 408 N -0.65 0.41 -0.51 6.66 2.43 -1.98 -2.23 114.38 118.51 3ha0 h ARG 408 Ca -0.06 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.14 3ha0 h ARG 408 Cb 0.43 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.84 3ha0 h ARG 408 CO 0.10 0.27 0.23 -0.44 -1.51 0.00 0.00 179.97 178.62 3ha0 h ASP 409 N 0.42 0.31 -0.16 -3.80 3.32 -1.95 -1.42 116.42 113.14 3ha0 h ASP 409 Ca 0.44 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.49 3ha0 h ASP 409 Cb 0.70 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 3ha0 h ASP 409 CO -0.44 0.21 -0.04 -0.25 -1.72 0.00 0.00 179.24 177.00 3ha0 h TRP 410 N 0.45 0.35 -0.81 4.55 2.91 -0.79 -2.85 115.95 119.76 3ha0 h TRP 410 Ca 0.23 -0.08 0.00 0.00 1.13 0.00 0.00 58.89 60.18 3ha0 h TRP 410 Cb 0.18 -0.08 -0.04 0.00 -0.51 0.00 0.00 29.16 28.71 3ha0 h TRP 410 CO -0.12 0.59 0.52 0.82 -1.03 0.00 0.00 178.44 179.22 3ha0 h ILE 411 N 0.01 1.22 0.00 2.65 1.08 -1.23 -1.52 117.51 119.72 3ha0 h ILE 411 Ca 0.04 -0.42 0.00 0.00 -0.39 0.00 0.00 64.86 64.09 3ha0 h ILE 411 Cb 0.48 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.27 3ha0 h ILE 411 CO 0.02 0.21 0.00 -0.62 -0.69 0.00 0.00 178.15 177.07 3ha0 n GLU 412 N -4.50 0.45 -0.18 2.37 1.02 -0.56 -4.86 120.64 114.39 3ha0 n GLU 412 Ca 0.08 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.27 3ha0 n GLU 412 Cb 0.03 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.95 3ha0 n GLU 412 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ha0 n GLY 413 N 0.36 0.59 3.86 0.62 0.00 -0.57 -5.08 105.19 104.96 3ha0 n GLY 413 Ca 0.12 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 3ha0 n GLY 413 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ha0 s GLU 414 N 0.38 3.93 -0.21 1.61 2.56 -1.09 -4.94 118.70 120.95 3ha0 s GLU 414 Ca 0.00 0.48 -0.04 0.00 0.00 0.00 0.00 54.97 55.41 3ha0 s GLU 414 Cb 0.00 -2.65 -0.01 0.00 2.00 0.00 0.00 34.13 33.47 3ha0 s GLU 414 CO 0.00 0.30 -0.03 0.99 -0.56 0.00 0.00 175.26 175.96 3ha0 s THR 415 N -1.78 3.49 0.18 -1.70 2.01 -1.26 -4.31 115.64 112.28 3ha0 s THR 415 Ca 0.47 -0.46 0.01 0.00 0.31 0.00 0.00 61.69 62.02 3ha0 s THR 415 Cb -0.12 -2.58 -0.04 0.00 0.01 0.00 0.00 72.50 69.77 3ha0 s THR 415 CO 0.20 0.42 0.35 -0.31 -0.69 0.00 0.00 174.62 174.59 3ha0 s TYR 416 N 1.35 3.48 -0.01 4.92 1.51 -0.72 -1.15 117.35 126.74 3ha0 s TYR 416 Ca 0.04 0.25 -0.01 0.00 -1.01 0.00 0.00 57.07 56.34 3ha0 s TYR 416 Cb -0.14 -1.77 0.00 0.00 -0.11 0.00 0.00 41.96 39.94 3ha0 s TYR 416 CO -0.02 0.43 0.02 -0.65 -1.11 0.00 0.00 175.55 174.23 3ha0 s GLN 417 N -3.31 0.02 -0.22 -0.62 -0.21 0.11 -1.84 119.66 113.59 3ha0 s GLN 417 Ca 0.37 0.04 0.01 0.00 0.02 0.00 0.00 55.36 55.80 3ha0 s GLN 417 Cb -0.11 -0.01 0.05 0.00 1.00 0.00 0.00 33.01 33.94 3ha0 s GLN 417 CO 0.29 -0.02 -0.09 0.00 -2.12 0.00 0.00 175.29 173.35 3ha0 s ARG 419 N 1.35 3.89 -0.16 0.00 3.52 -0.05 -1.62 118.95 125.88 3ha0 s ARG 419 Ca -0.04 -0.33 -0.07 0.00 -0.13 0.00 0.00 55.73 55.17 3ha0 s ARG 419 Cb -0.18 -3.68 -0.04 0.00 -1.56 0.00 0.00 34.95 29.49 3ha0 s ARG 419 CO -0.07 -0.23 0.07 0.08 -0.81 0.00 0.00 175.30 174.34 3ha0 s VAL 420 N 1.79 4.90 -0.21 7.11 1.01 0.11 -1.36 120.40 133.74 3ha0 s VAL 420 Ca 0.08 -0.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.03 3ha0 s VAL 420 Cb -0.16 -3.18 0.07 0.00 0.00 0.00 0.00 36.38 33.10 3ha0 s VAL 420 CO 0.11 0.50 0.03 -0.89 0.00 0.00 0.00 175.10 174.86 3ha0 s THR 421 N -0.03 0.66 0.17 3.92 2.01 -0.46 -1.52 115.64 120.39 3ha0 s THR 421 Ca 0.07 -0.73 -0.14 0.00 0.31 0.00 0.00 61.69 61.20 3ha0 s THR 421 Cb -0.12 -1.19 -0.07 0.00 0.01 0.00 0.00 72.50 71.13 3ha0 s THR 421 CO 0.01 -0.26 0.56 -2.28 -0.69 0.00 0.00 174.62 171.96 3ha0 s HIS 422 N 1.78 3.58 0.19 4.92 2.46 -1.26 -1.56 115.29 125.40 3ha0 s HIS 422 Ca -0.00 1.06 -0.14 0.00 0.47 0.00 0.00 55.06 56.45 3ha0 s HIS 422 Cb -0.17 -2.37 0.18 0.00 -0.13 0.00 0.00 32.58 30.08 3ha0 s HIS 422 CO -0.10 0.40 1.67 -1.35 -2.47 0.00 0.00 174.74 172.89 3ha0 h PRO 423 N 3.39 0.07 -2.72 2.88 0.11 -1.88 -3.17 132.00 130.68 3ha0 h PRO 423 Ca -0.48 -0.00 -0.80 0.00 0.11 0.00 0.00 66.00 64.82 3ha0 h PRO 423 Cb 1.19 -0.02 -0.25 0.00 0.11 0.00 0.00 31.00 32.03 3ha0 h PRO 423 CO 0.66 0.05 1.15 0.72 -0.21 0.00 0.00 178.00 180.37 3ha0 n HIS 424 N -5.27 2.51 -3.63 0.65 8.25 -1.26 -4.89 115.22 111.57 3ha0 n HIS 424 Ca 0.05 -2.61 -0.11 0.00 -0.26 0.00 0.00 57.72 54.80 3ha0 n HIS 424 Cb 0.27 -1.36 -0.07 0.00 1.12 0.00 0.00 29.99 29.95 3ha0 n HIS 424 CO 0.00 0.00 0.00 -0.48 0.64 0.00 0.00 176.34 176.50 3ha0 s LEU 425 N -3.00 -0.74 -0.02 2.41 0.05 -1.20 -5.09 118.68 111.10 3ha0 s LEU 425 Ca 0.37 1.34 -0.18 0.00 0.05 0.00 0.00 54.13 55.71 3ha0 s LEU 425 Cb 0.11 2.31 -0.10 0.00 -2.05 0.00 0.00 46.19 46.47 3ha0 s LEU 425 CO -0.00 -0.22 0.78 -0.65 -0.55 0.00 0.00 176.35 175.70 3ha0 h PRO 426 N 5.42 -0.61 -5.49 1.48 0.11 -1.90 -3.44 132.00 127.57 3ha0 h PRO 426 Ca -0.29 0.04 -0.59 0.00 0.11 0.00 0.00 66.00 65.27 3ha0 h PRO 426 Cb 1.18 0.14 -0.10 0.00 0.11 0.00 0.00 31.00 32.33 3ha0 h PRO 426 CO 0.09 -0.41 -0.34 1.03 -0.21 0.00 0.00 178.00 178.17 3ha0 s ARG 427 N -3.65 4.21 0.51 1.05 3.00 -1.26 -5.07 118.95 117.74 3ha0 s ARG 427 Ca -0.09 0.07 -0.19 0.00 0.00 0.00 0.00 55.73 55.52 3ha0 s ARG 427 Cb 0.01 -3.41 -0.07 0.00 0.00 0.00 0.00 34.95 31.47 3ha0 s ARG 427 CO 0.28 0.27 1.03 0.00 0.00 0.00 0.00 175.30 176.88 3ha0 s ALA 428 N 0.36 2.87 -0.07 2.13 0.00 -1.26 -4.99 121.76 120.80 3ha0 s ALA 428 Ca 0.16 0.50 -0.15 0.00 0.00 0.00 0.00 51.96 52.47 3ha0 s ALA 428 Cb -0.13 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 3ha0 s ALA 428 CO 0.04 -0.40 0.38 -0.51 0.00 0.00 0.00 175.76 175.27 3ha0 s LEU 429 N -3.77 4.37 -0.05 0.00 1.43 -0.57 -4.93 118.68 115.16 3ha0 s LEU 429 Ca 0.65 0.79 0.06 0.00 -1.03 0.00 0.00 54.13 54.60 3ha0 s LEU 429 Cb -0.15 -2.53 -0.01 0.00 0.03 0.00 0.00 46.19 43.53 3ha0 s LEU 429 CO 0.25 0.20 -0.23 -0.04 0.23 0.00 0.00 176.35 176.76 3ha0 s MET 430 N -0.31 2.29 -0.02 1.70 -1.94 -1.26 0.05 119.30 119.80 3ha0 s MET 430 Ca 0.22 -0.84 0.04 0.00 -1.71 0.00 0.00 55.69 53.40 3ha0 s MET 430 Cb -0.15 -1.99 -0.01 0.00 2.01 0.00 0.00 34.83 34.69 3ha0 s MET 430 CO 0.10 0.38 -0.13 1.03 -0.01 0.00 0.00 175.02 176.38 3ha0 s ARG 431 N -0.20 1.17 0.14 2.03 1.81 -0.64 -5.01 118.95 118.26 3ha0 s ARG 431 Ca -0.01 -0.47 0.08 0.00 -1.72 0.00 0.00 55.73 53.60 3ha0 s ARG 431 Cb -0.12 -1.11 -0.04 0.00 -0.45 0.00 0.00 34.95 33.23 3ha0 s ARG 431 CO 0.03 0.25 -0.18 -1.54 -0.68 0.00 0.00 175.30 173.18 3ha0 s SER 432 N -0.18 2.50 0.04 0.23 1.04 -1.26 -0.54 113.70 115.52 3ha0 s SER 432 Ca 0.03 -0.80 0.01 0.00 0.48 0.00 0.00 55.95 55.66 3ha0 s SER 432 Cb -0.07 -0.13 -0.03 0.00 0.10 0.00 0.00 66.02 65.89 3ha0 s SER 432 CO 0.00 -0.03 -0.05 0.28 0.98 0.00 0.00 173.24 174.42 3ha0 s THR 433 N -1.81 0.29 0.07 2.02 -1.32 -0.77 -4.93 115.64 109.18 3ha0 s THR 433 Ca 0.12 -1.16 -0.26 0.00 -1.21 0.00 0.00 61.69 59.17 3ha0 s THR 433 Cb -0.07 -0.64 0.09 0.00 -1.51 0.00 0.00 72.50 70.37 3ha0 s THR 433 CO 0.05 -0.57 0.81 0.28 -2.21 0.00 0.00 174.62 172.99 3ha0 s THR 434 N -1.95 0.00 -0.10 5.08 -1.32 -1.26 -1.76 115.64 114.33 3ha0 s THR 434 Ca -0.09 -0.11 -0.33 0.00 -1.21 0.00 0.00 61.69 59.95 3ha0 s THR 434 Cb -0.06 -1.14 -0.11 0.00 -1.51 0.00 0.00 72.50 69.68 3ha0 s THR 434 CO -0.02 0.00 1.95 1.17 -2.21 0.00 0.00 174.62 175.51 3ha0 n LYS 435 N -0.31 2.19 -1.87 7.08 4.81 -1.26 -4.92 118.16 123.87 3ha0 n LYS 435 Ca -0.11 0.78 -0.41 0.00 -0.87 0.00 0.00 58.31 57.70 3ha0 n LYS 435 Cb 0.62 -2.74 -0.01 0.00 0.02 0.00 0.00 35.03 32.92 3ha0 n LYS 435 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 3ha0 s THR 436 N 4.75 2.25 -0.15 3.15 -4.23 -1.26 -4.99 115.64 115.16 3ha0 s THR 436 Ca 0.94 0.23 0.02 0.00 -1.18 0.00 0.00 61.69 61.70 3ha0 s THR 436 Cb -0.64 -3.15 0.02 0.00 1.34 0.00 0.00 72.50 70.07 3ha0 s THR 436 CO 0.49 0.05 -0.20 -0.44 -0.54 0.00 0.00 174.62 173.98 3ha0 s SER 437 N 0.07 2.98 0.06 3.99 0.01 -1.26 -4.98 113.70 114.56 3ha0 s SER 437 Ca 0.56 -0.58 -0.07 0.00 1.31 0.00 0.00 55.95 57.17 3ha0 s SER 437 Cb -0.45 -1.38 0.03 0.00 0.21 0.00 0.00 66.02 64.43 3ha0 s SER 437 CO 0.54 0.03 0.36 0.61 0.41 0.00 0.00 173.24 175.19 3ha0 n GLY 438 N 4.35 1.04 3.72 3.44 0.00 -1.26 -5.14 105.19 111.34 3ha0 n GLY 438 Ca -0.20 -0.99 -0.35 0.00 0.00 0.00 0.00 46.02 44.48 3ha0 n GLY 438 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ha0 s PRO 439 N -2.02 2.20 0.09 1.61 0.04 -1.26 -4.95 135.00 130.71 3ha0 s PRO 439 Ca 0.08 1.90 0.04 0.00 0.04 0.00 0.00 61.00 63.06 3ha0 s PRO 439 Cb -0.01 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 3ha0 s PRO 439 CO 0.02 -1.82 0.05 1.03 0.04 0.00 0.00 177.00 176.31 3ha0 s ARG 440 N -3.72 2.74 -0.09 4.56 1.81 -1.26 -4.38 118.95 118.61 3ha0 s ARG 440 Ca 0.78 -0.77 -0.07 0.00 -1.72 0.00 0.00 55.73 53.95 3ha0 s ARG 440 Cb -0.33 -2.64 0.02 0.00 -0.45 0.00 0.00 34.95 31.55 3ha0 s ARG 440 CO 0.44 0.55 0.23 0.00 -0.68 0.00 0.00 175.30 175.83 3ha0 s ALA 441 N -1.38 -0.55 0.36 2.13 0.00 -0.95 -4.93 121.76 116.43 3ha0 s ALA 441 Ca 0.28 0.67 -0.25 0.00 0.00 0.00 0.00 51.96 52.67 3ha0 s ALA 441 Cb -0.12 -0.40 -0.10 0.00 0.00 0.00 0.00 23.12 22.50 3ha0 s ALA 441 CO 0.21 -0.12 0.96 0.00 0.00 0.00 0.00 175.76 176.80 3ha0 s ALA 442 N 0.25 3.16 0.41 0.00 0.00 -1.26 -3.39 121.76 120.93 3ha0 s ALA 442 Ca -0.01 0.51 -0.22 0.00 0.00 0.00 0.00 51.96 52.24 3ha0 s ALA 442 Cb -0.03 -3.18 -0.10 0.00 0.00 0.00 0.00 23.12 19.81 3ha0 s ALA 442 CO -0.01 0.13 0.97 -1.25 0.00 0.00 0.00 175.76 175.60 3ha0 s PRO 443 N -2.36 4.24 -0.23 0.00 0.04 -1.26 -4.44 135.00 130.98 3ha0 s PRO 443 Ca 0.54 1.24 -0.08 0.00 0.04 0.00 0.00 61.00 62.74 3ha0 s PRO 443 Cb -0.17 -2.34 -0.03 0.00 0.04 0.00 0.00 34.50 32.00 3ha0 s PRO 443 CO 0.22 -0.03 0.08 -1.21 0.04 0.00 0.00 177.00 176.10 3ha0 s GLU 444 N -2.88 3.77 -0.12 4.56 2.02 -0.71 -4.96 118.70 120.39 3ha0 s GLU 444 Ca 0.60 -0.43 -0.03 0.00 0.02 0.00 0.00 54.97 55.13 3ha0 s GLU 444 Cb -0.13 -3.33 -0.03 0.00 0.10 0.00 0.00 34.13 30.73 3ha0 s GLU 444 CO 0.18 -0.07 0.00 0.08 0.02 0.00 0.00 175.26 175.47 3ha0 s VAL 445 N 1.30 4.28 -0.00 2.63 1.01 -1.26 -1.59 120.40 126.77 3ha0 s VAL 445 Ca 0.05 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.80 3ha0 s VAL 445 Cb -0.15 -2.83 -0.00 0.00 0.00 0.00 0.00 36.38 33.40 3ha0 s VAL 445 CO 0.04 0.56 -0.04 -0.31 0.00 0.00 0.00 175.10 175.35 3ha0 s TYR 446 N -0.41 0.37 -0.04 5.22 1.51 0.12 -4.86 117.35 119.26 3ha0 s TYR 446 Ca 0.08 -0.08 0.01 0.00 -1.01 0.00 0.00 57.07 56.07 3ha0 s TYR 446 Cb -0.12 -0.24 0.02 0.00 -0.11 0.00 0.00 41.96 41.51 3ha0 s TYR 446 CO 0.02 -0.01 -0.05 0.00 -1.11 0.00 0.00 175.55 174.41 3ha0 s ALA 447 N -0.12 0.66 0.08 3.71 0.00 -1.26 0.45 121.76 125.28 3ha0 s ALA 447 Ca 0.01 -0.07 0.05 0.00 0.00 0.00 0.00 51.96 51.96 3ha0 s ALA 447 Cb -0.02 -0.39 -0.03 0.00 0.00 0.00 0.00 23.12 22.69 3ha0 s ALA 447 CO -0.00 0.01 -0.14 -0.06 0.00 0.00 0.00 175.76 175.57 3ha0 s PHE 448 N 0.79 1.22 -0.05 0.00 0.40 0.32 -4.82 117.98 115.84 3ha0 s PHE 448 Ca -0.11 -0.48 0.06 0.00 -0.60 0.00 0.00 56.93 55.81 3ha0 s PHE 448 Cb -0.13 -0.68 -0.01 0.00 0.51 0.00 0.00 43.02 42.70 3ha0 s PHE 448 CO 0.00 0.06 -0.25 0.00 0.70 0.00 0.00 175.22 175.74 3ha0 s ALA 449 N -1.41 2.19 0.47 5.36 0.00 -1.26 0.05 121.76 127.16 3ha0 s ALA 449 Ca -0.01 -1.06 -0.20 0.00 0.00 0.00 0.00 51.96 50.69 3ha0 s ALA 449 Cb -0.09 -0.66 -0.09 0.00 0.00 0.00 0.00 23.12 22.28 3ha0 s ALA 449 CO 0.02 0.45 0.99 0.95 0.00 0.00 0.00 175.76 178.17 3ha0 s THR 450 N -0.31 4.19 0.91 0.00 -4.23 -0.37 -5.00 115.64 110.83 3ha0 s THR 450 Ca 0.01 1.31 -0.13 0.00 -1.18 0.00 0.00 61.69 61.70 3ha0 s THR 450 Cb -0.13 -3.56 0.14 0.00 1.34 0.00 0.00 72.50 70.30 3ha0 s THR 450 CO 0.02 -0.35 1.16 -2.16 -0.54 0.00 0.00 174.62 172.75 3ha0 s PRO 451 N -3.35 1.12 0.02 3.99 0.04 -1.26 -4.72 135.00 130.84 3ha0 s PRO 451 Ca 0.63 0.18 -0.30 0.00 0.04 0.00 0.00 61.00 61.55 3ha0 s PRO 451 Cb -0.12 -1.85 -0.07 0.00 0.04 0.00 0.00 34.50 32.51 3ha0 s PRO 451 CO 0.18 -2.19 1.54 -2.00 0.04 0.00 0.00 177.00 174.58 3ha0 s GLU 452 N -5.39 4.23 -0.05 4.56 2.12 -1.26 -4.91 118.70 118.01 3ha0 s GLU 452 Ca 0.65 2.14 -0.20 0.00 0.36 0.00 0.00 54.97 57.92 3ha0 s GLU 452 Cb -0.13 -3.65 -0.05 0.00 0.26 0.00 0.00 34.13 30.57 3ha0 s GLU 452 CO 0.53 -0.68 0.58 -0.46 -0.54 0.00 0.00 175.26 174.68 3ha0 s TRP 453 N 2.75 3.62 0.06 5.30 -0.11 -1.26 -4.99 118.94 124.31 3ha0 s TRP 453 Ca 0.69 1.12 -0.38 0.00 1.22 0.00 0.00 56.10 58.76 3ha0 s TRP 453 Cb -0.35 -2.62 -0.18 0.00 -1.50 0.00 0.00 33.47 28.82 3ha0 s TRP 453 CO 0.29 0.26 1.18 -2.30 -4.62 0.00 0.00 176.95 171.77 3ha0 n PRO 454 N 3.15 0.62 0.00 5.86 -0.02 -1.26 -1.85 135.00 141.49 3ha0 n PRO 454 Ca -0.06 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 3ha0 n PRO 454 Cb 0.51 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 3ha0 n PRO 454 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ha0 n GLY 455 N 2.03 2.41 3.53 -1.23 0.00 -1.26 -4.93 105.19 105.74 3ha0 n GLY 455 Ca 0.19 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 3ha0 n GLY 455 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ha0 s SER 456 N 0.00 6.54 0.03 1.61 0.01 -0.77 -4.79 113.70 116.33 3ha0 s SER 456 Ca 0.00 -1.61 0.22 0.00 1.31 0.00 0.00 55.95 55.87 3ha0 s SER 456 Cb 0.00 -2.53 -0.25 0.00 0.21 0.00 0.00 66.02 63.45 3ha0 s SER 456 CO 0.00 -1.40 0.63 -2.11 0.41 0.00 0.00 173.24 170.77 3ha0 n ARG 457 N 8.32 0.65 -0.39 12.44 1.85 -1.26 -4.09 116.66 134.17 3ha0 n ARG 457 Ca 0.31 -0.11 0.05 0.00 -1.00 0.00 0.00 57.85 57.09 3ha0 n ARG 457 Cb 0.50 -1.60 0.20 0.00 -1.05 0.00 0.00 32.46 30.52 3ha0 n ARG 457 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 3ha0 n ASP 458 N -2.37 3.07 -3.62 2.89 8.00 -1.26 -4.85 116.55 118.40 3ha0 n ASP 458 Ca -0.03 -2.33 -0.16 0.00 0.71 0.00 0.00 54.79 52.98 3ha0 n ASP 458 Cb 0.57 -0.49 -0.07 0.00 -0.02 0.00 0.00 41.12 41.10 3ha0 n ASP 458 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 3ha0 s LYS 459 N -1.79 0.85 0.09 -1.24 -2.85 -1.26 -1.70 119.74 111.84 3ha0 s LYS 459 Ca 0.28 0.35 0.02 0.00 -1.00 0.00 0.00 55.97 55.62 3ha0 s LYS 459 Cb 0.19 0.40 -0.04 0.00 -2.06 0.00 0.00 37.83 36.33 3ha0 s LYS 459 CO 0.12 -0.22 -0.07 1.03 0.10 0.00 0.00 175.35 176.31 3ha0 s ARG 460 N -0.72 0.77 -0.16 1.78 1.81 -0.87 -4.83 118.95 116.74 3ha0 s ARG 460 Ca -0.08 -1.19 -0.05 0.00 -1.72 0.00 0.00 55.73 52.69 3ha0 s ARG 460 Cb -0.03 -0.27 -0.03 0.00 -0.45 0.00 0.00 34.95 34.17 3ha0 s ARG 460 CO 0.06 0.01 0.01 0.99 -0.68 0.00 0.00 175.30 175.69 3ha0 s THR 461 N -2.97 4.37 -0.11 0.02 2.01 -1.26 -0.81 115.64 116.89 3ha0 s THR 461 Ca 0.06 -0.19 -0.05 0.00 0.31 0.00 0.00 61.69 61.82 3ha0 s THR 461 Cb 0.01 -2.93 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 3ha0 s THR 461 CO -0.03 0.50 0.10 -0.76 -0.69 0.00 0.00 174.62 173.74 3ha0 s LEU 462 N 0.16 4.14 0.05 4.42 1.43 0.87 -1.24 118.68 128.51 3ha0 s LEU 462 Ca 0.02 0.37 0.08 0.00 -1.03 0.00 0.00 54.13 53.57 3ha0 s LEU 462 Cb -0.13 -1.99 -0.03 0.00 0.03 0.00 0.00 46.19 44.07 3ha0 s LEU 462 CO 0.02 0.40 -0.24 0.00 0.23 0.00 0.00 176.35 176.75 3ha0 s ALA 463 N -0.97 2.04 -0.05 4.21 0.00 0.11 -1.29 121.76 125.81 3ha0 s ALA 463 Ca 0.14 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.94 3ha0 s ALA 463 Cb -0.12 -0.41 0.01 0.00 0.00 0.00 0.00 23.12 22.61 3ha0 s ALA 463 CO 0.03 0.47 -0.10 0.00 0.00 0.00 0.00 175.76 176.17 3ha0 s LEU 465 N 0.61 3.21 -0.22 0.00 2.96 0.17 -1.47 118.68 123.93 3ha0 s LEU 465 Ca -0.11 -0.27 0.02 0.00 -0.22 0.00 0.00 54.13 53.54 3ha0 s LEU 465 Cb -0.14 -1.84 0.05 0.00 0.50 0.00 0.00 46.19 44.76 3ha0 s LEU 465 CO 0.02 -0.01 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.28 3ha0 s ILE 466 N 1.44 1.99 0.16 6.68 1.01 -0.28 -0.70 121.20 131.50 3ha0 s ILE 466 Ca 0.05 -1.29 -0.00 0.00 0.00 0.00 0.00 60.65 59.40 3ha0 s ILE 466 Cb -0.15 -2.02 -0.04 0.00 0.01 0.00 0.00 42.46 40.26 3ha0 s ILE 466 CO 0.01 0.16 0.07 0.00 0.00 0.00 0.00 174.94 175.17 3ha0 s GLN 467 N 1.23 1.05 -1.15 2.79 -2.07 -0.62 -0.16 119.66 120.73 3ha0 s GLN 467 Ca -0.03 -1.52 -0.04 0.00 -1.82 0.00 0.00 55.36 51.94 3ha0 s GLN 467 Cb -0.17 0.15 0.00 0.00 -1.09 0.00 0.00 33.01 31.90 3ha0 s GLN 467 CO -0.08 -0.28 0.58 0.09 -1.32 0.00 0.00 175.29 174.29 3ha0 n ASN 468 N -0.18 -5.14 -4.55 12.60 3.02 -0.37 -1.74 115.26 118.91 3ha0 n ASN 468 Ca -0.03 -0.27 -0.25 0.00 -0.03 0.00 0.00 54.58 54.00 3ha0 n ASN 468 Cb 0.64 -3.92 -0.09 0.00 -0.61 0.00 0.00 39.78 35.80 3ha0 n ASN 468 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 3ha0 s PHE 469 N -3.08 2.52 -0.15 3.10 -0.12 -1.04 -4.54 117.98 114.67 3ha0 s PHE 469 Ca 0.29 -0.27 -0.27 0.00 -0.05 0.00 0.00 56.93 56.63 3ha0 s PHE 469 Cb -0.13 -1.17 0.07 0.00 -0.63 0.00 0.00 43.02 41.16 3ha0 s PHE 469 CO 0.36 0.59 0.67 0.00 -0.05 0.00 0.00 175.22 176.78 3ha0 s MET 470 N -3.19 0.92 0.78 1.99 0.23 -1.22 -0.20 119.30 118.61 3ha0 s MET 470 Ca 0.27 0.58 -0.13 0.00 -1.03 0.00 0.00 55.69 55.38 3ha0 s MET 470 Cb -0.07 0.44 0.19 0.00 -1.53 0.00 0.00 34.83 33.86 3ha0 s MET 470 CO 0.16 -0.21 0.71 -2.30 -2.03 0.00 0.00 175.02 171.34 3ha0 n PRO 471 N 1.80 -2.30 0.27 3.16 -0.02 -1.26 -2.24 135.00 134.41 3ha0 n PRO 471 Ca -0.17 -1.13 0.16 0.00 -2.02 0.00 0.00 63.50 60.35 3ha0 n PRO 471 Cb 0.56 -1.04 0.72 0.00 -0.02 0.00 0.00 33.50 33.73 3ha0 n PRO 471 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3ha0 h GLU 472 N 0.00 0.00 -6.56 -0.52 4.11 -1.99 -3.44 114.58 106.17 3ha0 h GLU 472 Ca -0.26 0.00 -0.53 0.00 0.07 0.00 0.00 59.36 58.64 3ha0 h GLU 472 Cb 0.80 0.00 0.05 0.00 0.50 0.00 0.00 28.75 30.10 3ha0 h GLU 472 CO 0.17 0.06 1.08 -0.25 0.07 0.00 0.00 179.01 180.14 3ha0 n ASP 473 N -3.23 4.04 -3.63 3.06 8.00 -1.26 -4.87 116.55 118.66 3ha0 n ASP 473 Ca -0.00 1.01 -0.11 0.00 0.71 0.00 0.00 54.79 56.40 3ha0 n ASP 473 Cb 0.29 -1.56 -0.07 0.00 -0.02 0.00 0.00 41.12 39.76 3ha0 n ASP 473 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3ha0 s ILE 474 N 2.16 0.00 0.05 0.53 2.07 -1.26 -4.73 121.20 120.01 3ha0 s ILE 474 Ca 0.79 0.00 -0.03 0.00 -1.41 0.00 0.00 60.65 60.01 3ha0 s ILE 474 Cb -0.49 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.06 3ha0 s ILE 474 CO 0.35 0.00 0.24 -0.44 -1.91 0.00 0.00 174.94 173.18 3ha0 s SER 475 N 0.74 6.41 -0.03 4.50 0.01 -0.83 -4.86 113.70 119.64 3ha0 s SER 475 Ca -0.03 0.39 0.01 0.00 1.31 0.00 0.00 55.95 57.64 3ha0 s SER 475 Cb -0.05 -2.01 0.02 0.00 0.21 0.00 0.00 66.02 64.18 3ha0 s SER 475 CO -0.07 0.19 -0.03 -0.69 0.41 0.00 0.00 173.24 173.05 3ha0 s VAL 476 N -1.45 0.40 -0.01 3.43 1.01 -1.26 -0.75 120.40 121.76 3ha0 s VAL 476 Ca 0.33 -0.08 -0.06 0.00 0.00 0.00 0.00 61.98 62.17 3ha0 s VAL 476 Cb -0.13 -0.42 0.00 0.00 0.00 0.00 0.00 36.38 35.83 3ha0 s VAL 476 CO 0.23 0.17 0.12 0.00 0.00 0.00 0.00 175.10 175.62 3ha0 s GLN 477 N 0.69 0.38 0.06 2.72 -2.07 0.33 -5.01 119.66 116.74 3ha0 s GLN 477 Ca -0.08 -0.27 0.03 0.00 -1.82 0.00 0.00 55.36 53.23 3ha0 s GLN 477 Cb -0.11 0.16 -0.04 0.00 -1.09 0.00 0.00 33.01 31.93 3ha0 s GLN 477 CO -0.00 -0.08 0.01 -1.58 -1.32 0.00 0.00 175.29 172.32 3ha0 s TRP 478 N -1.01 3.05 0.01 9.60 0.52 -1.26 -0.37 118.94 129.47 3ha0 s TRP 478 Ca -0.11 0.03 -0.00 0.00 0.02 0.00 0.00 56.10 56.04 3ha0 s TRP 478 Cb -0.06 -1.60 -0.01 0.00 -1.15 0.00 0.00 33.47 30.66 3ha0 s TRP 478 CO 0.01 0.48 -0.01 -0.51 0.02 0.00 0.00 176.95 176.94 3ha0 s LEU 479 N -2.06 2.09 -0.03 2.99 1.02 -0.53 -1.42 118.68 120.75 3ha0 s LEU 479 Ca 0.24 -0.20 0.01 0.00 0.02 0.00 0.00 54.13 54.20 3ha0 s LEU 479 Cb -0.12 0.05 0.02 0.00 0.02 0.00 0.00 46.19 46.16 3ha0 s LEU 479 CO 0.16 -0.12 -0.00 -2.28 0.02 0.00 0.00 176.35 174.12 3ha0 s HIS 480 N -0.59 0.31 -1.43 0.29 2.46 -0.23 -1.40 115.29 114.71 3ha0 s HIS 480 Ca -0.06 -0.01 -0.09 0.00 0.47 0.00 0.00 55.06 55.36 3ha0 s HIS 480 Cb -0.04 -0.38 0.05 0.00 -0.13 0.00 0.00 32.58 32.08 3ha0 s HIS 480 CO -0.00 -0.11 0.98 0.09 -2.47 0.00 0.00 174.74 173.22 3ha0 n ASN 481 N 3.98 -4.30 -1.96 9.88 3.02 -1.26 -0.79 115.26 123.83 3ha0 n ASN 481 Ca -0.25 -0.72 -0.12 0.00 -0.03 0.00 0.00 54.58 53.45 3ha0 n ASN 481 Cb 0.51 -4.27 -0.03 0.00 -0.61 0.00 0.00 39.78 35.39 3ha0 n ASN 481 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3ha0 n GLU 482 N -4.65 -1.80 -4.79 3.52 -0.58 -1.26 -4.95 120.64 106.13 3ha0 n GLU 482 Ca -0.05 0.66 -0.33 0.00 -0.42 0.00 0.00 57.16 57.02 3ha0 n GLU 482 Cb 0.57 -5.09 -0.16 0.00 -0.57 0.00 0.00 31.44 26.19 3ha0 n GLU 482 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3ha0 s VAL 483 N -2.37 2.57 0.00 2.62 1.01 0.03 -5.10 120.40 119.17 3ha0 s VAL 483 Ca 0.00 -0.82 -0.30 0.00 0.00 0.00 0.00 61.98 60.86 3ha0 s VAL 483 Cb 0.00 -2.06 -0.06 0.00 0.00 0.00 0.00 36.38 34.27 3ha0 s VAL 483 CO 0.00 0.53 1.39 -1.58 0.00 0.00 0.00 175.10 175.44 3ha0 s GLN 484 N 0.56 4.29 0.62 2.72 0.74 -1.26 -1.06 119.66 126.27 3ha0 s GLN 484 Ca -0.11 1.96 -0.13 0.00 0.05 0.00 0.00 55.36 57.13 3ha0 s GLN 484 Cb -0.16 -3.56 -0.03 0.00 1.10 0.00 0.00 33.01 30.36 3ha0 s GLN 484 CO 0.04 -0.56 1.04 -0.51 -0.55 0.00 0.00 175.29 174.75 3ha0 s LEU 485 N 2.33 3.34 0.49 3.68 1.43 -0.51 -4.96 118.68 124.49 3ha0 s LEU 485 Ca 0.64 1.65 -0.23 0.00 -1.03 0.00 0.00 54.13 55.15 3ha0 s LEU 485 Cb -0.31 -4.51 -0.06 0.00 0.03 0.00 0.00 46.19 41.34 3ha0 s LEU 485 CO 0.26 -1.15 1.27 -2.84 0.23 0.00 0.00 176.35 174.13 3ha0 s PRO 486 N -4.61 3.49 0.43 1.29 0.02 -1.26 -4.79 135.00 129.57 3ha0 s PRO 486 Ca 0.59 2.04 0.09 0.00 0.02 0.00 0.00 61.00 63.74 3ha0 s PRO 486 Cb -0.14 -2.37 0.93 0.00 0.02 0.00 0.00 34.50 32.94 3ha0 s PRO 486 CO 0.45 -0.85 2.07 -0.44 -0.33 0.00 0.00 177.00 177.90 3ha0 h ASP 487 N 1.83 0.36 0.21 2.53 3.32 -1.94 -1.36 116.42 121.38 3ha0 h ASP 487 Ca -0.50 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.53 3ha0 h ASP 487 Cb 1.27 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3ha0 h ASP 487 CO 0.59 0.28 0.00 0.00 -1.72 0.00 0.00 179.24 178.39 3ha0 n ALA 488 N -2.49 1.25 0.05 3.45 0.00 -1.26 -2.62 120.51 118.88 3ha0 n ALA 488 Ca 0.02 0.06 -0.11 0.00 0.00 0.00 0.00 53.44 53.41 3ha0 n ALA 488 Cb 0.08 -1.20 -0.13 0.00 0.00 0.00 0.00 19.45 18.20 3ha0 n ALA 488 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ha0 h ARG 489 N 0.00 0.10 -5.70 0.00 2.47 -1.61 -3.47 114.38 106.18 3ha0 h ARG 489 Ca 0.00 -0.18 -0.62 0.00 -1.26 0.00 0.00 59.98 57.93 3ha0 h ARG 489 Cb 0.11 0.07 -0.07 0.00 -1.65 0.00 0.00 29.97 28.42 3ha0 h ARG 489 CO 0.00 0.98 -0.36 -3.38 0.56 0.00 0.00 179.97 177.77 3ha0 s HIS 490 N -2.66 1.64 -0.15 3.04 -3.43 -1.08 -4.38 115.29 108.28 3ha0 s HIS 490 Ca -0.03 -0.89 -0.07 0.00 -0.80 0.00 0.00 55.06 53.27 3ha0 s HIS 490 Cb 0.08 -1.81 0.06 0.00 -1.43 0.00 0.00 32.58 29.48 3ha0 s HIS 490 CO 0.84 -0.29 0.33 0.45 -2.00 0.00 0.00 174.74 174.07 3ha0 s SER 491 N -4.17 -0.16 -0.05 7.38 0.15 -0.56 -4.99 113.70 111.31 3ha0 s SER 491 Ca 0.24 0.74 0.07 0.00 0.70 0.00 0.00 55.95 57.70 3ha0 s SER 491 Cb -0.01 0.79 -0.01 0.00 -1.71 0.00 0.00 66.02 65.07 3ha0 s SER 491 CO 0.15 -0.21 -0.25 -0.89 1.20 0.00 0.00 173.24 173.24 3ha0 s THR 492 N 1.91 2.06 0.63 6.45 2.01 -1.26 -1.06 115.64 126.38 3ha0 s THR 492 Ca -0.05 -1.08 -0.10 0.00 0.31 0.00 0.00 61.69 60.77 3ha0 s THR 492 Cb -0.11 -1.73 -0.02 0.00 0.01 0.00 0.00 72.50 70.65 3ha0 s THR 492 CO -0.11 0.57 1.02 0.42 -0.69 0.00 0.00 174.62 175.84 3ha0 s THR 493 N -0.31 4.32 0.40 -0.82 -4.23 -0.56 -5.02 115.64 109.43 3ha0 s THR 493 Ca 0.01 0.65 -0.24 0.00 -1.18 0.00 0.00 61.69 60.92 3ha0 s THR 493 Cb -0.13 -3.73 -0.09 0.00 1.34 0.00 0.00 72.50 69.89 3ha0 s THR 493 CO 0.02 -0.93 1.11 0.00 -0.54 0.00 0.00 174.62 174.27 3ha0 s GLN 494 N -5.18 4.09 -0.01 3.99 -2.07 -1.26 -4.64 119.66 114.59 3ha0 s GLN 494 Ca 0.55 1.67 -0.30 0.00 -1.82 0.00 0.00 55.36 55.46 3ha0 s GLN 494 Cb -0.11 -2.60 -0.07 0.00 -1.09 0.00 0.00 33.01 29.14 3ha0 s GLN 494 CO 0.52 -0.24 1.79 -2.14 -1.32 0.00 0.00 175.29 173.91 3ha0 s PRO 495 N -2.40 4.16 0.23 9.60 0.02 -1.26 -4.81 135.00 140.54 3ha0 s PRO 495 Ca 0.58 2.39 0.08 0.00 0.02 0.00 0.00 61.00 64.06 3ha0 s PRO 495 Cb -0.26 -4.04 -0.04 0.00 0.02 0.00 0.00 34.50 30.18 3ha0 s PRO 495 CO 0.33 -0.89 0.04 1.03 -0.33 0.00 0.00 177.00 177.18 3ha0 s ARG 496 N 4.15 2.48 0.26 5.54 0.52 -0.72 -4.91 118.95 126.27 3ha0 s ARG 496 Ca 0.80 -1.23 -0.30 0.00 -0.52 0.00 0.00 55.73 54.49 3ha0 s ARG 496 Cb -0.38 -2.32 -0.09 0.00 0.52 0.00 0.00 34.95 32.68 3ha0 s ARG 496 CO 0.35 0.40 1.00 0.15 0.02 0.00 0.00 175.30 177.22 3ha0 s LYS 497 N -3.46 4.76 0.46 3.54 -0.14 -1.26 -0.21 119.74 123.43 3ha0 s LYS 497 Ca 0.30 1.60 -0.04 0.00 -1.36 0.00 0.00 55.97 56.47 3ha0 s LYS 497 Cb -0.08 -3.22 0.10 0.00 -1.68 0.00 0.00 37.83 32.96 3ha0 s LYS 497 CO 0.21 0.39 0.63 0.25 -0.76 0.00 0.00 175.35 176.07 3ha0 n THR 498 N 1.32 0.00 0.16 2.17 -2.24 -0.37 -4.82 114.28 110.50 3ha0 n THR 498 Ca -0.01 -0.71 0.04 0.00 -2.27 0.00 0.00 64.05 61.09 3ha0 n THR 498 Cb 0.46 -1.40 0.16 0.00 -2.10 0.00 0.00 70.33 67.45 3ha0 n THR 498 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3ha0 h LYS 499 N 0.00 0.00 0.00 -0.78 1.79 -1.97 -3.44 116.57 112.17 3ha0 h LYS 499 Ca -0.21 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.26 3ha0 h LYS 499 Cb 0.66 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.31 3ha0 h LYS 499 CO 0.18 0.46 0.00 0.41 -1.08 0.00 0.00 179.45 179.42 3ha0 n GLY 500 N 0.81 0.67 0.00 3.86 0.00 -1.26 -4.99 105.19 104.28 3ha0 n GLY 500 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3ha0 n GLY 500 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3ha0 n SER 501 N 0.00 1.41 -4.94 1.61 2.88 -1.26 -5.06 113.62 108.26 3ha0 n SER 501 Ca 0.00 -1.47 -0.25 0.00 -1.33 0.00 0.00 58.87 55.81 3ha0 n SER 501 Cb 0.00 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 3ha0 n SER 501 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3ha0 s GLY 502 N -0.47 2.26 0.23 0.46 0.00 -1.26 -4.94 107.32 103.60 3ha0 s GLY 502 Ca 0.00 -1.37 0.08 0.00 0.00 0.00 0.00 44.72 43.44 3ha0 s GLY 502 CO 0.00 -1.91 0.03 -1.36 0.00 0.00 0.00 173.10 169.86 3ha0 s PHE 503 N -2.78 2.82 0.14 1.90 0.40 0.72 -1.24 117.98 119.94 3ha0 s PHE 503 Ca 0.38 -0.17 0.05 0.00 -0.60 0.00 0.00 56.93 56.59 3ha0 s PHE 503 Cb -0.03 -1.29 -0.04 0.00 0.51 0.00 0.00 43.02 42.17 3ha0 s PHE 503 CO 0.24 0.57 -0.11 -0.59 0.70 0.00 0.00 175.22 176.03 3ha0 s PHE 504 N -2.09 1.29 -0.14 0.36 -0.12 0.71 -1.24 117.98 116.76 3ha0 s PHE 504 Ca 0.30 -0.70 -0.13 0.00 -0.05 0.00 0.00 56.93 56.36 3ha0 s PHE 504 Cb -0.08 -0.66 0.04 0.00 -0.63 0.00 0.00 43.02 41.69 3ha0 s PHE 504 CO 0.20 0.10 0.37 0.54 -0.05 0.00 0.00 175.22 176.38 3ha0 s VAL 505 N -3.00 -0.00 0.17 -2.49 0.11 0.77 -1.76 120.40 114.20 3ha0 s VAL 505 Ca 0.14 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.24 3ha0 s VAL 505 Cb 0.00 -0.52 -0.04 0.00 -1.53 0.00 0.00 36.38 34.30 3ha0 s VAL 505 CO 0.01 0.00 0.24 -0.36 -3.33 0.00 0.00 175.10 171.67 3ha0 s PHE 506 N 0.24 3.36 -0.06 1.54 0.40 -1.26 -1.13 117.98 121.07 3ha0 s PHE 506 Ca -0.00 0.05 -0.03 0.00 -0.60 0.00 0.00 56.93 56.34 3ha0 s PHE 506 Cb -0.03 -1.59 0.03 0.00 0.51 0.00 0.00 43.02 41.94 3ha0 s PHE 506 CO 0.00 0.51 0.14 0.45 0.70 0.00 0.00 175.22 177.02 3ha0 s SER 507 N -3.31 -0.12 -0.04 1.36 0.15 -0.54 -1.49 113.70 109.71 3ha0 s SER 507 Ca 0.33 0.28 0.06 0.00 0.70 0.00 0.00 55.95 57.32 3ha0 s SER 507 Cb -0.10 0.21 -0.02 0.00 -1.71 0.00 0.00 66.02 64.40 3ha0 s SER 507 CO 0.27 -0.11 -0.21 -0.60 1.20 0.00 0.00 173.24 173.79 3ha0 s ARG 508 N 0.78 2.40 -0.11 5.44 3.52 -0.22 -1.11 118.95 129.65 3ha0 s ARG 508 Ca -0.06 -0.82 -0.04 0.00 -0.13 0.00 0.00 55.73 54.68 3ha0 s ARG 508 Cb -0.08 -2.22 0.06 0.00 -1.56 0.00 0.00 34.95 31.15 3ha0 s ARG 508 CO -0.04 0.54 0.22 -1.17 -0.81 0.00 0.00 175.30 174.04 3ha0 s LEU 509 N -0.53 -0.18 -0.05 -0.88 2.96 -0.41 -1.50 118.68 118.09 3ha0 s LEU 509 Ca 0.07 0.49 -0.27 0.00 -0.22 0.00 0.00 54.13 54.20 3ha0 s LEU 509 Cb -0.11 0.53 -0.03 0.00 0.50 0.00 0.00 46.19 47.08 3ha0 s LEU 509 CO 0.01 -0.24 0.86 -1.61 -1.32 0.00 0.00 176.35 174.05 3ha0 s GLU 510 N 2.32 4.47 0.34 1.98 2.02 -1.26 -0.09 118.70 128.48 3ha0 s GLU 510 Ca 0.02 1.17 0.09 0.00 0.02 0.00 0.00 54.97 56.26 3ha0 s GLU 510 Cb -0.12 -3.47 -0.05 0.00 0.10 0.00 0.00 34.13 30.59 3ha0 s GLU 510 CO -0.07 -0.06 0.10 0.14 0.02 0.00 0.00 175.26 175.38 3ha0 s VAL 511 N 1.14 2.94 0.29 2.63 -7.23 0.01 -4.97 120.40 115.20 3ha0 s VAL 511 Ca 0.45 -1.79 0.10 0.00 -1.81 0.00 0.00 61.98 58.93 3ha0 s VAL 511 Cb -0.19 -2.92 -0.05 0.00 0.56 0.00 0.00 36.38 33.78 3ha0 s VAL 511 CO 0.22 -0.20 -0.05 0.42 -0.31 0.00 0.00 175.10 175.18 3ha0 s THR 512 N -2.45 2.94 0.38 5.32 -4.23 -1.26 -2.04 115.64 114.30 3ha0 s THR 512 Ca 0.36 -2.06 0.06 0.00 -1.18 0.00 0.00 61.69 58.87 3ha0 s THR 512 Cb -0.02 -2.69 0.23 0.00 1.34 0.00 0.00 72.50 71.36 3ha0 s THR 512 CO 0.22 -0.33 1.99 -0.09 -0.54 0.00 0.00 174.62 175.87 3ha0 h ARG 513 N 1.96 0.56 0.00 3.99 2.43 -1.66 -1.49 114.38 120.16 3ha0 h ARG 513 Ca -0.43 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 58.66 3ha0 h ARG 513 Cb 1.25 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.69 3ha0 h ARG 513 CO 0.62 0.44 -0.09 0.00 -1.51 0.00 0.00 179.97 179.43 3ha0 h ALA 514 N 1.65 1.31 0.09 2.80 0.00 -1.96 -2.76 119.26 120.38 3ha0 h ALA 514 Ca 0.14 -0.08 -0.23 0.00 0.00 0.00 0.00 54.91 54.75 3ha0 h ALA 514 Cb 0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3ha0 h ALA 514 CO -0.02 0.11 -1.15 0.93 0.00 0.00 0.00 179.25 179.12 3ha0 h GLU 515 N 0.00 0.18 0.00 0.00 5.08 -1.66 -3.22 114.58 114.96 3ha0 h GLU 515 Ca -0.00 -0.32 -0.12 0.00 -1.00 0.00 0.00 59.36 57.92 3ha0 h GLU 515 Cb 0.27 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 3ha0 h GLU 515 CO 0.01 1.15 -0.58 0.11 -1.00 0.00 0.00 179.01 178.70 3ha0 h TRP 516 N -0.50 0.00 0.00 4.33 0.09 -1.58 -1.87 115.95 116.43 3ha0 h TRP 516 Ca -0.26 0.00 -0.08 0.00 0.09 0.00 0.00 58.89 58.64 3ha0 h TRP 516 Cb 1.59 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 30.82 3ha0 h TRP 516 CO 0.15 0.58 -0.40 0.93 0.09 0.00 0.00 178.44 179.79 3ha0 h GLU 517 N 0.00 0.00 -0.03 0.12 5.08 -1.65 0.57 114.58 118.67 3ha0 h GLU 517 Ca -0.01 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 3ha0 h GLU 517 Cb 1.35 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.61 3ha0 h GLU 517 CO 0.08 0.40 -0.42 0.37 -1.00 0.00 0.00 179.01 178.43 3ha0 h GLN 518 N 0.00 0.33 -1.18 2.33 -0.00 -1.52 -3.44 115.11 111.63 3ha0 h GLN 518 Ca -0.00 -0.32 0.02 0.00 -0.00 0.00 0.00 58.65 58.34 3ha0 h GLN 518 Cb 0.93 0.08 -0.23 0.00 0.00 0.00 0.00 27.48 28.27 3ha0 h GLN 518 CO 0.05 1.00 -0.34 0.21 0.00 0.00 0.00 178.83 179.75 3ha0 s LYS 519 N -3.34 0.52 -1.37 1.69 2.47 -0.72 -5.07 119.74 113.92 3ha0 s LYS 519 Ca -0.14 0.77 -0.13 0.00 -1.56 0.00 0.00 55.97 54.91 3ha0 s LYS 519 Cb 0.03 0.28 0.09 0.00 -1.46 0.00 0.00 37.83 36.77 3ha0 s LYS 519 CO 0.79 -0.75 2.03 -3.47 0.16 0.00 0.00 175.35 174.10 3ha0 n ASP 520 N 5.41 4.44 -3.61 1.43 4.64 0.18 -4.27 116.55 124.76 3ha0 n ASP 520 Ca 0.00 -2.94 -0.03 0.00 -1.38 0.00 0.00 54.79 50.44 3ha0 n ASP 520 Cb 0.51 -1.61 -0.06 0.00 -1.04 0.00 0.00 41.12 38.93 3ha0 n ASP 520 CO 0.00 0.00 0.00 -0.70 -0.82 0.00 0.00 177.20 175.68 3ha0 s GLU 521 N 2.31 0.54 -0.03 -0.67 2.12 -1.26 -4.62 118.70 117.09 3ha0 s GLU 521 Ca 0.45 1.07 0.03 0.00 0.36 0.00 0.00 54.97 56.88 3ha0 s GLU 521 Cb 0.11 0.33 -0.00 0.00 0.26 0.00 0.00 34.13 34.82 3ha0 s GLU 521 CO -0.04 -0.14 -0.13 -0.06 -0.54 0.00 0.00 175.26 174.36 3ha0 s PHE 522 N 1.95 1.29 -0.20 5.30 0.40 0.87 -4.58 117.98 123.02 3ha0 s PHE 522 Ca -0.08 -0.33 -0.07 0.00 -0.60 0.00 0.00 56.93 55.85 3ha0 s PHE 522 Cb -0.06 -0.88 -0.04 0.00 0.51 0.00 0.00 43.02 42.55 3ha0 s PHE 522 CO -0.18 -0.11 0.06 0.42 0.70 0.00 0.00 175.22 176.10 3ha0 s ILE 523 N 0.06 4.63 -0.41 0.64 1.09 -0.49 -0.64 121.20 126.08 3ha0 s ILE 523 Ca -0.02 -0.08 -0.15 0.00 -1.10 0.00 0.00 60.65 59.30 3ha0 s ILE 523 Cb -0.09 -3.10 0.02 0.00 -1.06 0.00 0.00 42.46 38.23 3ha0 s ILE 523 CO 0.01 0.43 0.30 0.00 -0.10 0.00 0.00 174.94 175.57 3ha0 s ARG 525 N 1.67 3.31 -0.09 0.00 3.52 0.50 -1.70 118.95 126.16 3ha0 s ARG 525 Ca 0.05 -0.72 0.02 0.00 -0.13 0.00 0.00 55.73 54.94 3ha0 s ARG 525 Cb -0.19 -2.59 -0.02 0.00 -1.56 0.00 0.00 34.95 30.58 3ha0 s ARG 525 CO 0.10 0.17 -0.13 0.00 -0.81 0.00 0.00 175.30 174.62 3ha0 s ALA 526 N 0.45 2.67 -0.24 6.12 0.00 0.47 -0.52 121.76 130.71 3ha0 s ALA 526 Ca -0.11 -0.93 -0.08 0.00 0.00 0.00 0.00 51.96 50.84 3ha0 s ALA 526 Cb -0.16 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.82 3ha0 s ALA 526 CO 0.05 0.42 0.08 0.08 0.00 0.00 0.00 175.76 176.39 3ha0 s VAL 527 N -0.24 4.50 0.00 0.00 1.01 0.07 -1.60 120.40 124.14 3ha0 s VAL 527 Ca 0.01 -0.11 -0.03 0.00 0.00 0.00 0.00 61.98 61.86 3ha0 s VAL 527 Cb -0.13 -3.10 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 3ha0 s VAL 527 CO 0.03 0.34 0.05 -2.28 0.00 0.00 0.00 175.10 173.24 3ha0 s HIS 528 N 1.47 0.11 0.23 5.22 5.04 -0.94 -1.96 115.29 124.45 3ha0 s HIS 528 Ca 0.06 -0.22 -0.06 0.00 -1.54 0.00 0.00 55.06 53.29 3ha0 s HIS 528 Cb -0.15 -0.09 0.36 0.00 0.04 0.00 0.00 32.58 32.74 3ha0 s HIS 528 CO 0.04 -0.18 1.76 1.49 -2.34 0.00 0.00 174.74 175.52 3ha0 h GLU 529 N 4.91 0.53 -0.57 2.88 4.81 -1.85 -1.77 114.58 123.51 3ha0 h GLU 529 Ca -0.30 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 3ha0 h GLU 529 Cb 1.20 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.46 3ha0 h GLU 529 CO 0.42 0.35 0.00 0.00 -0.73 0.00 0.00 179.01 179.06 3ha0 n ALA 530 N -2.44 2.54 -2.57 2.92 0.00 -1.26 -4.85 120.51 114.85 3ha0 n ALA 530 Ca 0.12 -1.03 -0.41 0.00 0.00 0.00 0.00 53.44 52.11 3ha0 n ALA 530 Cb 0.31 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.75 3ha0 n ALA 530 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ha0 s ALA 531 N -1.37 2.76 0.57 0.00 0.00 -0.67 -4.15 121.76 118.90 3ha0 s ALA 531 Ca 0.38 -1.72 -0.17 0.00 0.00 0.00 0.00 51.96 50.44 3ha0 s ALA 531 Cb 0.21 -4.33 -0.05 0.00 0.00 0.00 0.00 23.12 18.95 3ha0 s ALA 531 CO 0.24 -3.37 1.07 -1.12 0.00 0.00 0.00 175.76 172.58 3ha0 s SER 532 N 4.16 5.80 0.05 0.00 0.01 -1.26 -0.75 113.70 121.71 3ha0 s SER 532 Ca 0.38 1.94 0.22 0.00 1.31 0.00 0.00 55.95 59.80 3ha0 s SER 532 Cb -0.06 -2.55 -0.18 0.00 0.21 0.00 0.00 66.02 63.44 3ha0 s SER 532 CO 0.06 -1.16 0.74 -0.81 0.41 0.00 0.00 173.24 172.48 3ha0 n PRO 533 N -1.71 0.58 -2.44 12.44 -0.04 -1.26 -4.64 135.00 137.92 3ha0 n PRO 533 Ca 0.10 -0.07 -0.20 0.00 -0.04 0.00 0.00 63.50 63.29 3ha0 n PRO 533 Cb 0.52 -1.63 0.01 0.00 -0.04 0.00 0.00 33.50 32.37 3ha0 n PRO 533 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3ha0 n SER 534 N -2.33 3.83 -0.43 3.54 3.41 -1.25 -4.93 113.62 115.47 3ha0 n SER 534 Ca -0.02 -3.37 -0.06 0.00 -0.26 0.00 0.00 58.87 55.16 3ha0 n SER 534 Cb 0.54 -0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 64.02 3ha0 n SER 534 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ha0 n GLN 535 N -0.46 -1.40 -4.09 4.33 1.13 0.07 -4.95 117.38 112.01 3ha0 n GLN 535 Ca 0.31 0.62 -0.14 0.00 -1.94 0.00 0.00 57.00 55.86 3ha0 n GLN 535 Cb 0.77 -4.79 -0.12 0.00 0.11 0.00 0.00 30.24 26.21 3ha0 n GLN 535 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 3ha0 s THR 536 N -1.70 0.48 -0.08 5.09 2.01 -1.06 -2.23 115.64 118.15 3ha0 s THR 536 Ca 0.00 -0.81 -0.04 0.00 0.31 0.00 0.00 61.69 61.15 3ha0 s THR 536 Cb 0.00 -0.51 0.04 0.00 0.01 0.00 0.00 72.50 72.04 3ha0 s THR 536 CO 0.00 -0.23 0.19 -0.69 -0.69 0.00 0.00 174.62 173.20 3ha0 s VAL 537 N -1.00 -0.04 0.08 3.82 1.01 -0.63 -4.41 120.40 119.24 3ha0 s VAL 537 Ca -0.07 0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.07 3ha0 s VAL 537 Cb -0.08 -0.30 -0.04 0.00 0.00 0.00 0.00 36.38 35.96 3ha0 s VAL 537 CO 0.00 0.06 -0.05 0.00 0.00 0.00 0.00 175.10 175.11 3ha0 s GLN 538 N 1.12 0.76 -0.10 2.72 -2.07 -1.26 -0.40 119.66 120.44 3ha0 s GLN 538 Ca -0.08 -1.30 -0.08 0.00 -1.82 0.00 0.00 55.36 52.07 3ha0 s GLN 538 Cb -0.10 -0.07 0.03 0.00 -1.09 0.00 0.00 33.01 31.78 3ha0 s GLN 538 CO -0.07 -0.05 0.26 0.50 -1.32 0.00 0.00 175.29 174.61 3ha0 s ARG 539 N -3.86 0.29 0.20 9.60 3.52 -0.69 -4.99 118.95 123.02 3ha0 s ARG 539 Ca 0.10 0.39 -0.04 0.00 -0.13 0.00 0.00 55.73 56.05 3ha0 s ARG 539 Cb 0.06 0.11 -0.05 0.00 -1.56 0.00 0.00 34.95 33.50 3ha0 s ARG 539 CO -0.06 -0.06 0.43 0.00 -0.81 0.00 0.00 175.30 174.80 3ha0 s ALA 540 N 0.32 3.75 0.02 6.12 0.00 -1.26 -1.39 121.76 129.32 3ha0 s ALA 540 Ca -0.01 -0.62 -0.07 0.00 0.00 0.00 0.00 51.96 51.25 3ha0 s ALA 540 Cb -0.03 -2.15 -0.00 0.00 0.00 0.00 0.00 23.12 20.94 3ha0 s ALA 540 CO -0.01 0.49 0.14 0.54 0.00 0.00 0.00 175.76 176.91 3ha0 s VAL 541 N -1.83 0.11 0.10 0.00 0.11 0.19 -4.87 120.40 114.20 3ha0 s VAL 541 Ca 0.41 -0.87 0.08 0.00 -2.93 0.00 0.00 61.98 58.67 3ha0 s VAL 541 Cb -0.11 -0.70 -0.03 0.00 -1.53 0.00 0.00 36.38 34.00 3ha0 s VAL 541 CO 0.27 -0.48 -0.20 -0.44 -3.33 0.00 0.00 175.10 170.92 3ha0 s SER 542 N -1.80 2.40 0.11 3.54 0.01 -1.26 -0.09 113.70 116.61 3ha0 s SER 542 Ca -0.09 -0.68 -0.12 0.00 1.31 0.00 0.00 55.95 56.37 3ha0 s SER 542 Cb -0.04 -0.12 -0.15 0.00 0.21 0.00 0.00 66.02 65.92 3ha0 s SER 542 CO -0.02 0.04 1.32 0.58 0.41 0.00 0.00 173.24 175.57 3ha0 h VAL 543 N 4.11 1.28 0.00 3.43 2.07 -1.97 -3.43 116.25 121.74 3ha0 h VAL 543 Ca -0.45 -1.95 0.00 0.00 0.82 0.00 0.00 66.70 65.11 3ha0 h VAL 543 Cb 1.18 1.95 0.00 0.00 -1.52 0.00 0.00 31.29 32.90 3ha0 h VAL 543 CO 0.40 0.62 0.00 0.59 0.02 0.00 0.00 177.57 179.20