#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 2.71 -0.30 4.52 1.04 -1.26 -5.13 113.70 115.28 3ha0 s SER 337 Ca 0.00 -1.24 -0.16 0.00 0.48 0.00 0.00 55.95 55.03 3ha0 s SER 337 Cb 0.00 -0.16 0.17 0.00 0.10 0.00 0.00 66.02 66.13 3ha0 s SER 337 CO 0.00 -0.41 1.02 0.00 0.98 0.00 0.00 173.24 174.82 3ha0 s ALA 338 N -3.07 -2.68 0.03 5.32 0.00 -1.26 -4.62 121.76 115.48 3ha0 s ALA 338 Ca 0.31 2.05 0.03 0.00 0.00 0.00 0.00 51.96 54.36 3ha0 s ALA 338 Cb 0.05 -2.02 -0.02 0.00 0.00 0.00 0.00 23.12 21.14 3ha0 s ALA 338 CO 0.13 -0.84 -0.11 -0.47 0.00 0.00 0.00 175.76 174.47 3ha0 s TYR 339 N 2.20 0.93 -0.15 0.00 5.04 -1.06 -5.05 117.35 119.26 3ha0 s TYR 339 Ca -0.03 -0.35 -0.05 0.00 -2.44 0.00 0.00 57.07 54.20 3ha0 s TYR 339 Cb -0.05 -0.55 0.06 0.00 0.35 0.00 0.00 41.96 41.76 3ha0 s TYR 339 CO -0.17 -0.01 0.09 -1.17 -1.34 0.00 0.00 175.55 172.96 3ha0 s LEU 340 N -1.11 0.29 0.89 6.97 2.96 -1.26 -1.82 118.68 125.60 3ha0 s LEU 340 Ca -0.02 -0.49 -0.14 0.00 -0.22 0.00 0.00 54.13 53.26 3ha0 s LEU 340 Cb -0.07 -0.20 0.14 0.00 0.50 0.00 0.00 46.19 46.56 3ha0 s LEU 340 CO 0.01 -0.33 1.25 -0.94 -1.32 0.00 0.00 176.35 175.02 3ha0 s SER 341 N 2.15 3.77 0.07 3.68 1.04 -0.09 -4.98 113.70 119.36 3ha0 s SER 341 Ca 0.03 0.50 0.00 0.00 0.48 0.00 0.00 55.95 56.96 3ha0 s SER 341 Cb -0.15 -0.75 -0.04 0.00 0.10 0.00 0.00 66.02 65.17 3ha0 s SER 341 CO -0.08 -2.34 -0.05 -0.13 0.98 0.00 0.00 173.24 171.62 3ha0 s ARG 342 N -5.74 0.73 0.30 4.02 0.52 -1.26 -3.88 118.95 113.64 3ha0 s ARG 342 Ca 0.68 -1.28 -0.29 0.00 -0.52 0.00 0.00 55.73 54.32 3ha0 s ARG 342 Cb -0.07 -0.00 -0.13 0.00 0.52 0.00 0.00 34.95 35.27 3ha0 s ARG 342 CO 0.51 -0.06 1.32 -2.30 0.02 0.00 0.00 175.30 174.79 3ha0 n PRO 343 N 0.03 2.06 -3.04 3.54 -0.02 -1.20 -4.92 135.00 131.44 3ha0 n PRO 343 Ca -0.13 0.73 -0.32 0.00 -2.02 0.00 0.00 63.50 61.76 3ha0 n PRO 343 Cb 0.61 -2.33 -0.06 0.00 -0.02 0.00 0.00 33.50 31.70 3ha0 n PRO 343 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3ha0 s SER 344 N -0.10 6.75 0.57 2.55 1.04 -1.26 -4.91 113.70 118.34 3ha0 s SER 344 Ca 0.60 1.31 0.28 0.00 0.48 0.00 0.00 55.95 58.62 3ha0 s SER 344 Cb -0.60 -2.39 1.49 0.00 0.10 0.00 0.00 66.02 64.63 3ha0 s SER 344 CO 0.57 -0.26 1.98 -0.65 0.98 0.00 0.00 173.24 175.86 3ha0 h PRO 345 N 2.03 0.00 0.58 4.02 0.11 -1.89 0.89 132.00 137.75 3ha0 h PRO 345 Ca -0.48 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 3ha0 h PRO 345 Cb 1.18 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.29 3ha0 h PRO 345 CO 0.65 0.00 -0.28 0.35 -0.21 0.00 0.00 178.00 178.51 3ha0 h PHE 346 N 0.00 -0.73 -0.12 0.65 3.57 -1.93 -1.82 116.94 116.56 3ha0 h PHE 346 Ca 0.20 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.63 3ha0 h PHE 346 Cb 0.97 0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.94 3ha0 h PHE 346 CO 0.00 -0.45 -0.19 -0.44 -2.23 0.00 0.00 178.31 175.00 3ha0 h ASP 347 N -1.12 0.19 0.01 0.41 3.45 -1.80 -1.45 116.42 116.11 3ha0 h ASP 347 Ca -0.08 -0.05 -0.00 0.00 0.43 0.00 0.00 57.03 57.33 3ha0 h ASP 347 Cb 0.60 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.32 3ha0 h ASP 347 CO 0.13 0.40 -0.01 0.25 -1.57 0.00 0.00 179.24 178.45 3ha0 h LEU 348 N 0.19 -0.01 0.00 1.55 5.85 -0.89 0.12 115.31 122.12 3ha0 h LEU 348 Ca 0.03 -0.75 -0.20 0.00 0.84 0.00 0.00 57.88 57.80 3ha0 h LEU 348 Cb 0.45 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 3ha0 h LEU 348 CO 0.03 0.77 -2.06 0.49 -0.34 0.00 0.00 178.44 177.32 3ha0 n PHE 349 N -4.72 0.00 -0.04 1.25 3.01 -0.69 -4.02 117.46 112.25 3ha0 n PHE 349 Ca -0.09 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.36 3ha0 n PHE 349 Cb 0.37 -0.69 -0.00 0.00 -0.01 0.00 0.00 39.48 39.15 3ha0 n PHE 349 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 3ha0 h ILE 350 N 0.00 0.00 -0.49 4.37 1.08 -1.32 -3.40 117.51 117.76 3ha0 h ILE 350 Ca -0.29 -0.69 0.00 0.00 -0.39 0.00 0.00 64.86 63.49 3ha0 h ILE 350 Cb 1.61 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.36 3ha0 h ILE 350 CO 0.02 0.00 0.00 -2.11 -0.69 0.00 0.00 178.15 175.37 3ha0 n ARG 351 N -3.90 3.04 -3.58 2.37 1.85 -1.21 -5.01 116.66 110.22 3ha0 n ARG 351 Ca -0.02 -2.47 -0.19 0.00 -1.00 0.00 0.00 57.85 54.17 3ha0 n ARG 351 Cb 0.07 -1.55 0.01 0.00 -1.05 0.00 0.00 32.46 29.94 3ha0 n ARG 351 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 3ha0 n LYS 352 N 0.76 -1.38 -2.72 2.89 4.01 -1.13 -4.95 118.16 115.64 3ha0 n LYS 352 Ca 0.19 0.91 -0.08 0.00 -0.51 0.00 0.00 58.31 58.82 3ha0 n LYS 352 Cb 0.63 -3.53 0.08 0.00 -0.51 0.00 0.00 35.03 31.71 3ha0 n LYS 352 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 3ha0 n SER 353 N -2.36 -2.27 -4.79 4.39 3.41 0.41 -4.99 113.62 107.42 3ha0 n SER 353 Ca -0.19 -3.18 -0.34 0.00 -0.26 0.00 0.00 58.87 54.89 3ha0 n SER 353 Cb 0.62 1.70 -0.02 0.00 -0.26 0.00 0.00 64.21 66.25 3ha0 n SER 353 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 3ha0 s PRO 354 N 0.35 3.66 0.05 4.33 0.04 -1.21 -4.73 135.00 137.50 3ha0 s PRO 354 Ca 0.25 1.43 -0.12 0.00 0.04 0.00 0.00 61.00 62.60 3ha0 s PRO 354 Cb 0.27 -2.07 0.01 0.00 0.04 0.00 0.00 34.50 32.75 3ha0 s PRO 354 CO -0.13 -0.56 0.26 0.95 0.04 0.00 0.00 177.00 177.56 3ha0 s THR 355 N -1.93 0.10 0.34 1.26 -4.23 -1.26 -2.41 115.64 107.51 3ha0 s THR 355 Ca 0.69 -0.80 0.09 0.00 -1.18 0.00 0.00 61.69 60.49 3ha0 s THR 355 Cb -0.19 -0.99 -0.05 0.00 1.34 0.00 0.00 72.50 72.61 3ha0 s THR 355 CO 0.22 -0.44 0.05 0.27 -0.54 0.00 0.00 174.62 174.18 3ha0 s ILE 356 N -2.79 2.72 -0.04 2.99 -4.36 -0.05 -3.27 121.20 116.40 3ha0 s ILE 356 Ca -0.03 -1.89 -0.07 0.00 -0.26 0.00 0.00 60.65 58.39 3ha0 s ILE 356 Cb -0.00 -2.85 0.01 0.00 1.25 0.00 0.00 42.46 40.87 3ha0 s ILE 356 CO -0.05 -0.19 0.18 -0.89 0.24 0.00 0.00 174.94 174.23 3ha0 s THR 357 N -2.50 0.04 0.47 8.37 2.01 -1.25 0.16 115.64 122.95 3ha0 s THR 357 Ca 0.36 -0.31 0.07 0.00 0.31 0.00 0.00 61.69 62.12 3ha0 s THR 357 Cb -0.01 -0.36 0.01 0.00 0.01 0.00 0.00 72.50 72.15 3ha0 s THR 357 CO 0.20 -0.17 0.42 0.00 -0.69 0.00 0.00 174.62 174.38 3ha0 s LEU 359 N -4.22 -1.25 -0.57 0.00 2.96 -0.76 -3.21 118.68 111.63 3ha0 s LEU 359 Ca 0.45 0.95 -0.06 0.00 -0.22 0.00 0.00 54.13 55.25 3ha0 s LEU 359 Cb -0.03 2.12 0.15 0.00 0.50 0.00 0.00 46.19 48.92 3ha0 s LEU 359 CO 0.27 -0.23 0.41 -0.69 -1.32 0.00 0.00 176.35 174.78 3ha0 s VAL 360 N 2.86 3.98 -1.10 1.68 1.01 -1.11 -2.55 120.40 125.19 3ha0 s VAL 360 Ca 0.14 -2.42 -0.18 0.00 0.00 0.00 0.00 61.98 59.51 3ha0 s VAL 360 Cb -0.14 -3.61 0.11 0.00 0.00 0.00 0.00 36.38 32.74 3ha0 s VAL 360 CO -0.20 -0.83 1.41 -0.69 0.00 0.00 0.00 175.10 174.79 3ha0 s VAL 361 N 0.57 4.48 -0.54 2.92 1.01 -1.26 -3.50 120.40 124.08 3ha0 s VAL 361 Ca 0.12 -1.71 -0.24 0.00 0.00 0.00 0.00 61.98 60.15 3ha0 s VAL 361 Cb -0.21 -4.97 0.04 0.00 0.00 0.00 0.00 36.38 31.24 3ha0 s VAL 361 CO -0.04 -1.75 0.95 -0.62 0.00 0.00 0.00 175.10 173.64 3ha0 s ASP 362 N 3.89 6.37 -0.18 3.32 2.15 -1.25 -4.55 116.67 126.41 3ha0 s ASP 362 Ca 0.43 -0.27 -0.06 0.00 0.43 0.00 0.00 52.55 53.08 3ha0 s ASP 362 Cb -0.01 -2.44 -0.24 0.00 -0.30 0.00 0.00 42.92 39.92 3ha0 s ASP 362 CO -0.04 -1.21 3.47 0.18 -0.17 0.00 0.00 175.17 177.40 3ha0 n LEU 363 N 7.46 5.48 0.00 -1.34 4.77 -1.26 -1.29 117.00 130.81 3ha0 n LEU 363 Ca 0.03 -3.23 0.00 0.00 -0.03 0.00 0.00 56.01 52.77 3ha0 n LEU 363 Cb 0.48 -1.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 3ha0 n LEU 363 CO 0.64 1.68 0.00 0.00 -1.33 0.00 0.00 177.39 178.37 3ha0 n ALA 364 N 2.64 0.00 -1.87 -1.18 0.00 -1.25 -4.86 120.51 113.99 3ha0 n ALA 364 Ca 0.46 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.57 3ha0 n ALA 364 Cb 0.82 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.23 3ha0 n ALA 364 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3ha0 s PRO 365 N 0.00 2.37 0.04 0.00 0.04 -1.26 -4.95 135.00 131.24 3ha0 s PRO 365 Ca 0.00 0.63 -0.29 0.00 0.04 0.00 0.00 61.00 61.39 3ha0 s PRO 365 Cb 0.00 -4.60 -0.04 0.00 0.04 0.00 0.00 34.50 29.89 3ha0 s PRO 365 CO 0.00 -3.17 0.93 -1.12 0.04 0.00 0.00 177.00 173.68 3ha0 s SER 366 N 9.42 7.36 -0.18 6.66 0.01 -1.26 -4.96 113.70 130.75 3ha0 s SER 366 Ca 0.78 1.64 -0.31 0.00 1.31 0.00 0.00 55.95 59.37 3ha0 s SER 366 Cb -0.13 -2.55 -0.08 0.00 0.21 0.00 0.00 66.02 63.47 3ha0 s SER 366 CO 0.17 -0.15 2.12 1.17 0.41 0.00 0.00 173.24 176.96 3ha0 n LYS 367 N 3.38 1.96 0.00 12.44 3.00 -1.26 -4.67 118.16 133.01 3ha0 n LYS 367 Ca 0.03 0.61 0.00 0.00 -0.00 0.00 0.00 58.31 58.95 3ha0 n LYS 367 Cb 0.50 -2.94 0.00 0.00 0.00 0.00 0.00 35.03 32.59 3ha0 n LYS 367 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3ha0 n GLY 368 N 5.51 -0.69 3.15 3.14 0.00 -1.26 -5.08 105.19 109.95 3ha0 n GLY 368 Ca 0.29 0.24 -0.13 0.00 0.00 0.00 0.00 46.02 46.42 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 -1.10 0.00 -0.59 2.61 2.01 -1.26 -5.12 115.64 112.20 3ha0 s THR 369 Ca 0.00 -0.04 -0.06 0.00 0.31 0.00 0.00 61.69 61.90 3ha0 s THR 369 Cb 0.00 -0.38 0.15 0.00 0.01 0.00 0.00 72.50 72.28 3ha0 s THR 369 CO 0.00 -0.02 0.44 -0.69 -0.69 0.00 0.00 174.62 173.66 3ha0 s VAL 370 N 0.04 4.11 0.14 3.82 1.01 -1.26 -4.59 120.40 123.67 3ha0 s VAL 370 Ca -0.01 -2.45 -0.20 0.00 0.00 0.00 0.00 61.98 59.32 3ha0 s VAL 370 Cb -0.02 -3.67 -0.07 0.00 0.00 0.00 0.00 36.38 32.62 3ha0 s VAL 370 CO 0.01 -0.85 0.66 -1.10 0.00 0.00 0.00 175.10 173.82 3ha0 s GLN 371 N 0.51 4.28 0.51 2.72 -1.52 -1.00 -4.91 119.66 120.25 3ha0 s GLN 371 Ca 0.13 0.85 0.05 0.00 -1.95 0.00 0.00 55.36 54.44 3ha0 s GLN 371 Cb -0.21 -3.11 0.01 0.00 -0.22 0.00 0.00 33.01 29.48 3ha0 s GLN 371 CO -0.04 0.54 0.25 -0.51 -0.25 0.00 0.00 175.29 175.28 3ha0 s LEU 372 N -1.44 2.68 -0.30 2.90 1.43 -1.26 -0.54 118.68 122.14 3ha0 s LEU 372 Ca 0.35 -1.32 -0.08 0.00 -1.03 0.00 0.00 54.13 52.06 3ha0 s LEU 372 Cb -0.19 -1.12 0.17 0.00 0.03 0.00 0.00 46.19 45.08 3ha0 s LEU 372 CO 0.21 -0.92 0.77 -0.89 0.23 0.00 0.00 176.35 175.76 3ha0 s THR 373 N -2.76 -0.77 -0.16 5.49 2.01 -0.76 -4.91 115.64 113.78 3ha0 s THR 373 Ca 0.28 0.00 -0.06 0.00 0.31 0.00 0.00 61.69 62.21 3ha0 s THR 373 Cb 0.00 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 3ha0 s THR 373 CO 0.16 0.00 0.06 0.26 -0.69 0.00 0.00 174.62 174.42 3ha0 s TRP 374 N 2.83 3.28 -0.30 4.92 0.52 -1.26 -1.07 118.94 127.86 3ha0 s TRP 374 Ca 0.07 0.15 -0.15 0.00 0.02 0.00 0.00 56.10 56.20 3ha0 s TRP 374 Cb -0.12 -2.01 0.16 0.00 -1.15 0.00 0.00 33.47 30.35 3ha0 s TRP 374 CO -0.18 0.28 0.97 -1.54 0.02 0.00 0.00 176.95 176.51 3ha0 s SER 375 N -0.02 -0.58 0.92 2.95 1.04 -1.13 -4.90 113.70 111.98 3ha0 s SER 375 Ca 0.06 0.82 -0.12 0.00 0.48 0.00 0.00 55.95 57.20 3ha0 s SER 375 Cb -0.12 1.58 0.14 0.00 0.10 0.00 0.00 66.02 67.72 3ha0 s SER 375 CO 0.01 -0.12 1.10 0.00 0.98 0.00 0.00 173.24 175.21 3ha0 s ARG 376 N 2.22 1.06 0.43 4.02 1.70 -1.26 -3.55 118.95 123.57 3ha0 s ARG 376 Ca -0.04 0.63 0.21 0.00 -0.47 0.00 0.00 55.73 56.06 3ha0 s ARG 376 Cb -0.06 -1.80 0.97 0.00 -0.57 0.00 0.00 34.95 33.49 3ha0 s ARG 376 CO -0.17 -2.33 1.87 0.00 -1.08 0.00 0.00 175.30 173.60 3ha0 h ALA 377 N -1.60 1.17 0.00 7.88 0.00 -0.64 -2.62 119.26 123.44 3ha0 h ALA 377 Ca -0.51 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.07 3ha0 h ALA 377 Cb 1.30 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 3ha0 h ALA 377 CO 0.57 0.34 -0.39 0.66 0.00 0.00 0.00 179.25 180.43 3ha0 h SER 378 N 0.00 0.00 0.00 0.00 4.64 -1.93 -3.48 113.55 112.79 3ha0 h SER 378 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ha0 h SER 378 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 3ha0 h SER 378 CO 0.04 0.39 0.00 0.61 -0.87 0.00 0.00 176.83 176.99 3ha0 n GLY 379 N 1.05 0.76 3.85 -0.77 0.00 -0.99 -5.08 105.19 104.01 3ha0 n GLY 379 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.85 3.84 0.89 1.61 1.02 -1.26 -4.95 119.74 120.04 3ha0 s LYS 380 Ca 0.00 0.92 -0.12 0.00 0.02 0.00 0.00 55.97 56.80 3ha0 s LYS 380 Cb 0.00 -2.12 0.09 0.00 -0.52 0.00 0.00 37.83 35.28 3ha0 s LYS 380 CO 0.00 -0.36 0.91 -2.30 -0.92 0.00 0.00 175.35 172.67 3ha0 n PRO 381 N -1.85 -0.22 -4.10 -1.68 -0.02 -1.26 -4.30 135.00 121.57 3ha0 n PRO 381 Ca 0.07 -0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.45 3ha0 n PRO 381 Cb 0.54 -2.21 -0.10 0.00 -0.02 0.00 0.00 33.50 31.71 3ha0 n PRO 381 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3ha0 s VAL 382 N -2.40 0.41 0.85 -1.45 -7.23 -1.26 -4.91 120.40 104.41 3ha0 s VAL 382 Ca 0.65 -1.65 -0.13 0.00 -1.81 0.00 0.00 61.98 59.04 3ha0 s VAL 382 Cb -0.25 -1.31 0.11 0.00 0.56 0.00 0.00 36.38 35.50 3ha0 s VAL 382 CO 0.59 -0.82 1.22 -1.10 -0.31 0.00 0.00 175.10 174.68 3ha0 s GLN 383 N -3.30 1.58 0.36 4.82 -1.52 -1.26 -5.03 119.66 115.32 3ha0 s GLN 383 Ca 0.04 -0.02 -0.26 0.00 -1.95 0.00 0.00 55.36 53.17 3ha0 s GLN 383 Cb 0.03 -1.92 -0.09 0.00 -0.22 0.00 0.00 33.01 30.81 3ha0 s GLN 383 CO -0.06 -1.84 1.04 -1.01 -0.25 0.00 0.00 175.29 173.18 3ha0 s HIS 384 N -3.65 3.41 0.00 0.91 3.76 -1.26 -4.81 115.29 113.65 3ha0 s HIS 384 Ca 0.65 1.68 0.00 0.00 -0.15 0.00 0.00 55.06 57.25 3ha0 s HIS 384 Cb -0.09 -3.12 0.00 0.00 1.11 0.00 0.00 32.58 30.48 3ha0 s HIS 384 CO 0.50 -0.46 0.00 -1.13 -0.85 0.00 0.00 174.74 172.81 3ha0 n SER 385 N 0.31 0.00 -3.41 1.40 3.41 -1.26 -4.41 113.62 109.66 3ha0 n SER 385 Ca 0.03 -0.49 -0.20 0.00 -0.26 0.00 0.00 58.87 57.96 3ha0 n SER 385 Cb 0.49 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.34 3ha0 n SER 385 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3ha0 s THR 386 N 1.26 -0.29 -0.04 6.66 2.01 -1.15 -4.96 115.64 119.14 3ha0 s THR 386 Ca 0.00 -0.78 -0.30 0.00 0.31 0.00 0.00 61.69 60.92 3ha0 s THR 386 Cb 0.00 -0.91 -0.06 0.00 0.01 0.00 0.00 72.50 71.54 3ha0 s THR 386 CO 0.00 -0.58 1.60 -0.60 -0.69 0.00 0.00 174.62 174.35 3ha0 s ARG 387 N 1.94 4.20 -0.77 4.92 3.52 -1.26 -3.70 118.95 127.79 3ha0 s ARG 387 Ca 0.12 2.15 0.02 0.00 -0.13 0.00 0.00 55.73 57.90 3ha0 s ARG 387 Cb -0.15 -3.87 0.32 0.00 -1.56 0.00 0.00 34.95 29.69 3ha0 s ARG 387 CO -0.22 -0.79 1.28 1.17 -0.81 0.00 0.00 175.30 175.93 3ha0 n LYS 388 N 6.69 4.05 -1.94 5.12 4.81 -0.81 -5.01 118.16 131.07 3ha0 n LYS 388 Ca 0.16 -4.77 -0.42 0.00 -0.87 0.00 0.00 58.31 52.42 3ha0 n LYS 388 Cb 0.43 -2.34 -0.03 0.00 0.02 0.00 0.00 35.03 33.11 3ha0 n LYS 388 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 3ha0 s GLU 389 N -3.67 4.21 -0.10 1.64 4.04 -1.26 -4.19 118.70 119.38 3ha0 s GLU 389 Ca 0.44 2.35 -0.05 0.00 0.04 0.00 0.00 54.97 57.74 3ha0 s GLU 389 Cb 0.22 -3.27 0.04 0.00 0.02 0.00 0.00 34.13 31.15 3ha0 s GLU 389 CO -0.11 -0.64 0.23 -1.21 -1.84 0.00 0.00 175.26 171.69 3ha0 s GLU 390 N 1.52 0.19 -1.24 -4.83 0.41 -1.20 -5.06 118.70 108.50 3ha0 s GLU 390 Ca 0.71 0.47 -0.20 0.00 -0.41 0.00 0.00 54.97 55.54 3ha0 s GLU 390 Cb -0.43 -0.10 0.01 0.00 -1.78 0.00 0.00 34.13 31.83 3ha0 s GLU 390 CO 0.31 -0.15 1.81 0.21 -0.49 0.00 0.00 175.26 176.96 3ha0 s LYS 391 N 1.10 3.36 0.49 1.61 2.20 -1.26 -3.61 119.74 123.62 3ha0 s LYS 391 Ca -0.08 -1.61 -0.23 0.00 -0.36 0.00 0.00 55.97 53.69 3ha0 s LYS 391 Cb -0.09 -5.41 -0.07 0.00 -1.51 0.00 0.00 37.83 30.75 3ha0 s LYS 391 CO -0.07 -2.95 1.31 -0.65 -0.36 0.00 0.00 175.35 172.63 3ha0 s GLN 392 N 5.19 3.51 0.00 4.03 -1.52 -1.11 -4.91 119.66 124.84 3ha0 s GLN 392 Ca 0.60 2.13 0.17 0.00 -1.95 0.00 0.00 55.36 56.30 3ha0 s GLN 392 Cb 0.02 -2.43 0.49 0.00 -0.22 0.00 0.00 33.01 30.87 3ha0 s GLN 392 CO 0.09 -0.86 1.39 -2.13 -0.25 0.00 0.00 175.29 173.54 3ha0 n ARG 393 N -0.58 1.99 -0.83 2.91 3.00 -1.26 -3.85 116.66 118.04 3ha0 n ARG 393 Ca 0.08 -1.53 0.00 0.00 -0.00 0.00 0.00 57.85 56.40 3ha0 n ARG 393 Cb 0.45 -1.38 0.30 0.00 0.00 0.00 0.00 32.46 31.84 3ha0 n ARG 393 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 3ha0 n ASN 394 N 0.74 4.73 -1.87 6.15 6.94 -1.26 -4.90 115.26 125.79 3ha0 n ASN 394 Ca 0.16 -2.92 -0.08 0.00 -0.02 0.00 0.00 54.58 51.72 3ha0 n ASN 394 Cb 0.39 -0.69 0.03 0.00 -2.36 0.00 0.00 39.78 37.15 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 0.21 0.23 3.43 4.83 0.00 -1.25 -5.04 105.19 107.60 3ha0 n GLY 395 Ca 0.30 -0.27 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.14 0.01 -0.63 2.61 2.01 -1.25 -3.89 115.64 111.37 3ha0 s THR 396 Ca 0.11 -0.21 0.02 0.00 0.31 0.00 0.00 61.69 61.93 3ha0 s THR 396 Cb -0.05 -1.12 0.16 0.00 0.01 0.00 0.00 72.50 71.50 3ha0 s THR 396 CO 0.29 -0.07 0.41 -0.22 -0.69 0.00 0.00 174.62 174.34 3ha0 s LEU 397 N -2.78 4.75 -0.45 4.42 2.96 -0.41 -2.76 118.68 124.40 3ha0 s LEU 397 Ca 0.02 -3.29 -0.27 0.00 -0.22 0.00 0.00 54.13 50.37 3ha0 s LEU 397 Cb -0.01 -1.71 -0.02 0.00 0.50 0.00 0.00 46.19 44.95 3ha0 s LEU 397 CO -0.11 -0.21 1.89 -0.89 -1.32 0.00 0.00 176.35 175.70 3ha0 s THR 398 N -0.68 3.38 -0.52 3.68 2.01 -1.24 -3.92 115.64 118.36 3ha0 s THR 398 Ca 0.20 0.32 0.03 0.00 0.31 0.00 0.00 61.69 62.55 3ha0 s THR 398 Cb -0.17 -3.69 0.13 0.00 0.01 0.00 0.00 72.50 68.78 3ha0 s THR 398 CO -0.06 -0.56 0.26 -0.69 -0.69 0.00 0.00 174.62 172.88 3ha0 s VAL 399 N 8.26 2.71 0.58 3.82 1.01 -1.23 -3.27 120.40 132.29 3ha0 s VAL 399 Ca 0.77 -3.19 -0.01 0.00 0.00 0.00 0.00 61.98 59.55 3ha0 s VAL 399 Cb -0.18 -2.87 0.04 0.00 0.00 0.00 0.00 36.38 33.36 3ha0 s VAL 399 CO 0.28 -0.79 0.83 0.42 0.00 0.00 0.00 175.10 175.84 3ha0 s THR 400 N -0.16 2.69 -0.29 3.92 -4.23 -1.26 -2.73 115.64 113.57 3ha0 s THR 400 Ca 0.16 -0.54 0.04 0.00 -1.18 0.00 0.00 61.69 60.17 3ha0 s THR 400 Cb -0.25 -3.04 0.19 0.00 1.34 0.00 0.00 72.50 70.74 3ha0 s THR 400 CO -0.01 -0.04 0.57 -0.55 -0.54 0.00 0.00 174.62 174.05 3ha0 s SER 401 N -4.43 -1.36 -0.19 3.99 0.15 -1.20 -1.93 113.70 108.74 3ha0 s SER 401 Ca 0.57 0.27 -0.25 0.00 0.70 0.00 0.00 55.95 57.24 3ha0 s SER 401 Cb -0.10 1.95 -0.01 0.00 -1.71 0.00 0.00 66.02 66.15 3ha0 s SER 401 CO 0.40 -0.30 0.84 -0.89 1.20 0.00 0.00 173.24 174.49 3ha0 s THR 402 N 2.80 4.86 -0.13 6.45 2.01 -1.24 -1.99 115.64 128.40 3ha0 s THR 402 Ca 0.12 1.62 -0.01 0.00 0.31 0.00 0.00 61.69 63.73 3ha0 s THR 402 Cb -0.11 -4.13 -0.02 0.00 0.01 0.00 0.00 72.50 68.24 3ha0 s THR 402 CO -0.25 -0.01 -0.09 -0.22 -0.69 0.00 0.00 174.62 173.36 3ha0 s LEU 403 N 2.37 2.97 0.23 4.42 2.96 0.12 -2.91 118.68 128.84 3ha0 s LEU 403 Ca 0.37 -0.22 -0.30 0.00 -0.22 0.00 0.00 54.13 53.77 3ha0 s LEU 403 Cb -0.16 -1.69 -0.09 0.00 0.50 0.00 0.00 46.19 44.75 3ha0 s LEU 403 CO 0.11 0.19 1.23 -2.84 -1.32 0.00 0.00 176.35 173.71 3ha0 s PRO 404 N 0.24 4.47 0.28 0.98 0.02 -1.26 -0.87 135.00 138.85 3ha0 s PRO 404 Ca -0.06 1.97 0.09 0.00 0.02 0.00 0.00 61.00 63.03 3ha0 s PRO 404 Cb -0.15 -3.19 -0.05 0.00 0.02 0.00 0.00 34.50 31.13 3ha0 s PRO 404 CO 0.04 -0.10 -0.13 0.14 -0.33 0.00 0.00 177.00 176.62 3ha0 s VAL 405 N -0.37 2.11 0.75 3.83 -7.23 -1.01 -4.49 120.40 113.98 3ha0 s VAL 405 Ca 0.52 -2.26 -0.11 0.00 -1.81 0.00 0.00 61.98 58.31 3ha0 s VAL 405 Cb -0.35 -2.36 0.05 0.00 0.56 0.00 0.00 36.38 34.27 3ha0 s VAL 405 CO 0.40 -0.37 1.09 -0.83 -0.31 0.00 0.00 175.10 175.09 3ha0 s GLY 406 N -3.48 1.75 -0.09 2.32 0.00 -1.26 -4.45 107.32 102.11 3ha0 s GLY 406 Ca 0.29 0.31 -0.17 0.00 0.00 0.00 0.00 44.72 45.15 3ha0 s GLY 406 CO 0.13 0.66 0.59 -0.84 0.00 0.00 0.00 173.10 173.64 3ha0 h THR 407 N -0.94 0.81 0.00 0.90 2.02 -1.94 -3.36 112.91 110.40 3ha0 h THR 407 Ca -0.44 -1.38 -0.15 0.00 0.77 0.00 0.00 66.41 65.21 3ha0 h THR 407 Cb 1.23 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 69.08 3ha0 h THR 407 CO 0.52 0.25 -1.05 0.03 0.37 0.00 0.00 175.52 175.63 3ha0 h ARG 408 N -0.95 0.00 -0.27 6.66 2.47 -1.98 -3.36 114.38 116.96 3ha0 h ARG 408 Ca -0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 3ha0 h ARG 408 Cb 0.50 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.80 3ha0 h ARG 408 CO 0.02 0.41 0.17 -0.44 0.56 0.00 0.00 179.97 180.69 3ha0 h ASP 409 N 0.00 0.31 0.33 7.04 5.19 -1.98 -1.37 116.42 125.94 3ha0 h ASP 409 Ca -0.10 -0.01 -0.27 0.00 -0.62 0.00 0.00 57.03 56.03 3ha0 h ASP 409 Cb 1.53 -0.08 0.02 0.00 0.18 0.00 0.00 39.33 40.97 3ha0 h ASP 409 CO 0.06 0.24 -1.16 -0.25 -3.12 0.00 0.00 179.24 175.00 3ha0 h TRP 410 N 0.36 0.75 -0.14 4.55 2.91 -1.71 -3.01 115.95 119.67 3ha0 h TRP 410 Ca 0.10 -0.47 -0.09 0.00 1.13 0.00 0.00 58.89 59.55 3ha0 h TRP 410 Cb -0.02 -0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 28.56 3ha0 h TRP 410 CO 0.00 1.33 -0.33 0.82 -1.03 0.00 0.00 178.44 179.23 3ha0 h ILE 411 N 0.20 1.28 -0.00 2.65 2.04 -1.56 -2.70 117.51 119.42 3ha0 h ILE 411 Ca -0.14 -1.34 0.00 0.00 1.00 0.00 0.00 64.86 64.38 3ha0 h ILE 411 Cb 1.84 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 39.46 3ha0 h ILE 411 CO 0.21 0.40 -0.07 -0.62 0.00 0.00 0.00 178.15 178.07 3ha0 n GLU 412 N -4.09 0.63 -0.95 2.37 1.02 -0.57 -4.96 120.64 114.09 3ha0 n GLU 412 Ca -0.01 -0.15 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 3ha0 n GLU 412 Cb 0.43 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 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 1.26 -0.55 3.25 0.62 0.00 -1.02 -5.09 105.19 103.67 3ha0 n GLY 413 Ca 0.15 -0.34 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.78 1.40 -0.18 1.61 2.56 -1.14 -4.97 118.70 117.19 3ha0 s GLU 414 Ca 0.00 -0.93 -0.08 0.00 0.00 0.00 0.00 54.97 53.96 3ha0 s GLU 414 Cb 0.00 -1.50 -0.04 0.00 2.00 0.00 0.00 34.13 34.58 3ha0 s GLU 414 CO 0.00 0.38 0.07 0.99 -0.56 0.00 0.00 175.26 176.14 3ha0 s THR 415 N -0.79 4.84 -0.10 -1.70 2.01 -1.26 -4.34 115.64 114.30 3ha0 s THR 415 Ca 0.07 -0.02 0.04 0.00 0.31 0.00 0.00 61.69 62.10 3ha0 s THR 415 Cb -0.09 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 69.24 3ha0 s THR 415 CO 0.02 0.46 -0.23 -0.31 -0.69 0.00 0.00 174.62 173.87 3ha0 s TYR 416 N 0.34 2.47 0.04 4.92 1.51 -1.22 0.17 117.35 125.58 3ha0 s TYR 416 Ca 0.04 -1.01 0.06 0.00 -1.01 0.00 0.00 57.07 55.15 3ha0 s TYR 416 Cb -0.12 -1.66 -0.02 0.00 -0.11 0.00 0.00 41.96 40.05 3ha0 s TYR 416 CO -0.00 -0.41 -0.17 1.14 -1.11 0.00 0.00 175.55 175.01 3ha0 s GLN 417 N 0.36 1.14 0.35 -0.62 1.03 -1.23 -3.78 119.66 116.90 3ha0 s GLN 417 Ca -0.18 -0.81 0.08 0.00 0.04 0.00 0.00 55.36 54.48 3ha0 s GLN 417 Cb -0.18 -1.19 -0.03 0.00 0.03 0.00 0.00 33.01 31.64 3ha0 s GLN 417 CO 0.09 0.30 0.22 0.00 -2.54 0.00 0.00 175.29 173.36 3ha0 s ARG 419 N -3.93 0.30 0.25 0.00 3.52 -0.23 -4.13 118.95 114.73 3ha0 s ARG 419 Ca 0.40 0.03 -0.09 0.00 -0.13 0.00 0.00 55.73 55.94 3ha0 s ARG 419 Cb -0.04 -0.74 -0.07 0.00 -1.56 0.00 0.00 34.95 32.55 3ha0 s ARG 419 CO 0.25 -0.90 0.57 0.08 -0.81 0.00 0.00 175.30 174.49 3ha0 s VAL 420 N 2.39 4.92 -0.06 7.11 1.01 -1.26 -1.83 120.40 132.68 3ha0 s VAL 420 Ca 0.09 0.46 -0.02 0.00 0.00 0.00 0.00 61.98 62.51 3ha0 s VAL 420 Cb -0.14 -3.64 0.03 0.00 0.00 0.00 0.00 36.38 32.63 3ha0 s VAL 420 CO -0.26 -0.13 0.04 -0.89 0.00 0.00 0.00 175.10 173.86 3ha0 s THR 421 N -1.89 0.08 0.46 3.92 2.01 0.30 -4.54 115.64 115.98 3ha0 s THR 421 Ca 0.48 0.29 0.06 0.00 0.31 0.00 0.00 61.69 62.82 3ha0 s THR 421 Cb -0.11 -0.32 -0.03 0.00 0.01 0.00 0.00 72.50 72.06 3ha0 s THR 421 CO 0.22 0.19 0.20 -2.28 -0.69 0.00 0.00 174.62 172.26 3ha0 s HIS 422 N 2.09 2.27 -0.76 4.92 2.46 -1.26 -2.37 115.29 122.64 3ha0 s HIS 422 Ca 0.05 -0.71 -0.28 0.00 0.47 0.00 0.00 55.06 54.60 3ha0 s HIS 422 Cb -0.12 -1.89 -0.15 0.00 -0.13 0.00 0.00 32.58 30.28 3ha0 s HIS 422 CO -0.04 0.05 2.54 -2.30 -2.47 0.00 0.00 174.74 172.53 3ha0 n PRO 423 N -1.35 0.50 -4.00 2.88 -0.02 -1.26 -4.83 135.00 126.91 3ha0 n PRO 423 Ca -0.04 -0.03 -0.09 0.00 -2.02 0.00 0.00 63.50 61.31 3ha0 n PRO 423 Cb 0.65 -2.46 -0.06 0.00 -0.02 0.00 0.00 33.50 31.61 3ha0 n PRO 423 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 3ha0 s HIS 424 N 10.42 0.43 -0.01 6.00 3.76 -1.26 -5.14 115.29 129.49 3ha0 s HIS 424 Ca 1.17 -0.77 -0.23 0.00 -0.15 0.00 0.00 55.06 55.07 3ha0 s HIS 424 Cb -0.71 0.09 -0.05 0.00 1.11 0.00 0.00 32.58 33.03 3ha0 s HIS 424 CO 0.37 -0.92 0.70 -0.51 -0.85 0.00 0.00 174.74 173.53 3ha0 s LEU 425 N -3.02 4.39 -0.77 0.89 1.43 -1.26 -4.94 118.68 115.40 3ha0 s LEU 425 Ca 0.23 1.28 -0.26 0.00 -1.03 0.00 0.00 54.13 54.35 3ha0 s LEU 425 Cb 0.01 -3.10 -0.16 0.00 0.03 0.00 0.00 46.19 42.96 3ha0 s LEU 425 CO 0.08 -0.01 2.49 -0.81 0.23 0.00 0.00 176.35 178.32 3ha0 n PRO 426 N 3.14 0.49 -3.71 1.29 -0.04 -1.26 -4.90 135.00 130.01 3ha0 n PRO 426 Ca -0.03 -0.12 -0.23 0.00 -0.04 0.00 0.00 63.50 63.08 3ha0 n PRO 426 Cb 0.51 -2.51 -0.18 0.00 -0.04 0.00 0.00 33.50 31.28 3ha0 n PRO 426 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3ha0 s ARG 427 N 8.48 0.31 0.31 0.54 1.81 -1.26 -5.13 118.95 124.00 3ha0 s ARG 427 Ca 1.15 0.12 -0.29 0.00 -1.72 0.00 0.00 55.73 54.98 3ha0 s ARG 427 Cb -0.63 -1.06 -0.11 0.00 -0.45 0.00 0.00 34.95 32.70 3ha0 s ARG 427 CO 0.35 -0.40 1.49 0.00 -0.68 0.00 0.00 175.30 176.07 3ha0 s ALA 428 N 2.05 3.64 0.62 2.13 0.00 -1.26 -5.02 121.76 123.92 3ha0 s ALA 428 Ca 0.04 1.47 -0.06 0.00 0.00 0.00 0.00 51.96 53.41 3ha0 s ALA 428 Cb -0.13 -3.59 0.02 0.00 0.00 0.00 0.00 23.12 19.42 3ha0 s ALA 428 CO -0.05 -0.90 0.93 -0.51 0.00 0.00 0.00 175.76 175.23 3ha0 s LEU 429 N -1.04 3.12 -0.06 0.00 1.43 -1.26 -5.09 118.68 115.77 3ha0 s LEU 429 Ca 0.58 0.65 0.05 0.00 -1.03 0.00 0.00 54.13 54.38 3ha0 s LEU 429 Cb -0.45 -3.43 -0.01 0.00 0.03 0.00 0.00 46.19 42.34 3ha0 s LEU 429 CO 0.51 -1.21 -0.24 -0.32 0.23 0.00 0.00 176.35 175.32 3ha0 s MET 430 N -5.06 2.56 -0.14 1.70 -2.45 -1.26 -4.81 119.30 109.84 3ha0 s MET 430 Ca 0.56 -0.86 -0.04 0.00 -1.25 0.00 0.00 55.69 54.09 3ha0 s MET 430 Cb -0.11 -2.12 0.07 0.00 1.25 0.00 0.00 34.83 33.92 3ha0 s MET 430 CO 0.45 0.32 0.19 1.03 1.05 0.00 0.00 175.02 178.06 3ha0 s ARG 431 N -0.03 0.10 -0.09 4.11 1.81 -1.26 -4.99 118.95 118.60 3ha0 s ARG 431 Ca -0.07 0.42 -0.01 0.00 -1.72 0.00 0.00 55.73 54.36 3ha0 s ARG 431 Cb -0.14 -0.67 -0.03 0.00 -0.45 0.00 0.00 34.95 33.66 3ha0 s ARG 431 CO 0.05 -0.45 -0.05 0.45 -0.68 0.00 0.00 175.30 174.62 3ha0 s SER 432 N 2.31 4.81 0.01 0.23 0.15 -1.26 -4.32 113.70 115.63 3ha0 s SER 432 Ca 0.04 -0.00 -0.22 0.00 0.70 0.00 0.00 55.95 56.47 3ha0 s SER 432 Cb -0.14 -1.37 0.05 0.00 -1.71 0.00 0.00 66.02 62.85 3ha0 s SER 432 CO -0.08 0.33 0.49 0.28 1.20 0.00 0.00 173.24 175.45 3ha0 s THR 433 N -0.58 0.03 -0.08 6.45 -1.32 -1.25 -4.97 115.64 113.92 3ha0 s THR 433 Ca 0.09 -0.28 -0.32 0.00 -1.21 0.00 0.00 61.69 59.97 3ha0 s THR 433 Cb -0.12 -0.89 0.13 0.00 -1.51 0.00 0.00 72.50 70.11 3ha0 s THR 433 CO 0.02 -0.15 1.39 0.28 -2.21 0.00 0.00 174.62 173.95 3ha0 s THR 434 N -1.84 0.00 0.35 5.08 -1.32 -1.26 -3.45 115.64 113.20 3ha0 s THR 434 Ca -0.09 -0.04 -0.29 0.00 -1.21 0.00 0.00 61.69 60.06 3ha0 s THR 434 Cb -0.02 -2.39 -0.11 0.00 -1.51 0.00 0.00 72.50 68.47 3ha0 s THR 434 CO 0.03 0.00 1.48 -0.75 -2.21 0.00 0.00 174.62 173.17 3ha0 s LYS 435 N -2.05 4.15 -0.94 7.08 2.47 -1.26 -4.91 119.74 124.27 3ha0 s LYS 435 Ca 0.22 2.52 -0.24 0.00 -1.56 0.00 0.00 55.97 56.90 3ha0 s LYS 435 Cb 0.04 -3.00 -0.00 0.00 -1.46 0.00 0.00 37.83 33.42 3ha0 s LYS 435 CO -0.05 -0.50 1.72 0.95 0.16 0.00 0.00 175.35 177.63 3ha0 s THR 436 N -0.89 3.66 0.23 3.43 -4.23 -1.26 -4.97 115.64 111.60 3ha0 s THR 436 Ca 0.54 -0.50 -0.27 0.00 -1.18 0.00 0.00 61.69 60.28 3ha0 s THR 436 Cb -0.46 -4.48 -0.09 0.00 1.34 0.00 0.00 72.50 68.82 3ha0 s THR 436 CO 0.59 -1.39 0.87 -0.44 -0.54 0.00 0.00 174.62 173.70 3ha0 s SER 437 N 6.62 7.45 0.00 3.99 0.01 -1.26 -4.92 113.70 125.58 3ha0 s SER 437 Ca 0.59 1.78 0.00 0.00 1.31 0.00 0.00 55.95 59.63 3ha0 s SER 437 Cb -0.04 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.64 3ha0 s SER 437 CO -0.04 0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.34 3ha0 n GLY 438 N 1.24 -0.09 3.53 3.44 0.00 -1.26 -5.13 105.19 106.92 3ha0 n GLY 438 Ca -0.02 -1.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.03 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 -1.81 -1.35 -0.02 1.61 0.04 -1.26 -4.98 135.00 127.24 3ha0 s PRO 439 Ca 0.00 0.14 -0.29 0.00 0.04 0.00 0.00 61.00 60.90 3ha0 s PRO 439 Cb 0.00 -1.56 0.09 0.00 0.04 0.00 0.00 34.50 33.07 3ha0 s PRO 439 CO 0.00 -3.84 0.79 -0.98 0.04 0.00 0.00 177.00 173.01 3ha0 s ARG 440 N -5.17 0.93 0.13 4.56 1.70 -1.26 -4.09 118.95 115.75 3ha0 s ARG 440 Ca 0.69 -0.06 -0.08 0.00 -0.47 0.00 0.00 55.73 55.81 3ha0 s ARG 440 Cb -0.13 0.44 -0.01 0.00 -0.57 0.00 0.00 34.95 34.67 3ha0 s ARG 440 CO 0.58 -0.35 0.23 0.00 -1.08 0.00 0.00 175.30 174.67 3ha0 s ALA 441 N -2.20 0.00 0.25 7.88 0.00 -0.80 -4.90 121.76 121.99 3ha0 s ALA 441 Ca -0.02 -0.84 -0.21 0.00 0.00 0.00 0.00 51.96 50.89 3ha0 s ALA 441 Cb -0.01 0.72 -0.09 0.00 0.00 0.00 0.00 23.12 23.74 3ha0 s ALA 441 CO -0.02 -0.58 0.77 0.00 0.00 0.00 0.00 175.76 175.94 3ha0 s ALA 442 N -3.93 3.36 0.26 0.00 0.00 -1.25 -3.67 121.76 116.53 3ha0 s ALA 442 Ca 0.13 0.24 -0.17 0.00 0.00 0.00 0.00 51.96 52.16 3ha0 s ALA 442 Cb 0.04 -2.90 -0.08 0.00 0.00 0.00 0.00 23.12 20.18 3ha0 s ALA 442 CO -0.04 0.29 0.71 -1.25 0.00 0.00 0.00 175.76 175.48 3ha0 s PRO 443 N -2.02 4.12 0.05 0.00 0.04 -1.26 -4.43 135.00 131.50 3ha0 s PRO 443 Ca 0.45 0.75 -0.00 0.00 0.04 0.00 0.00 61.00 62.24 3ha0 s PRO 443 Cb -0.17 -2.69 -0.04 0.00 0.04 0.00 0.00 34.50 31.64 3ha0 s PRO 443 CO 0.21 0.30 0.20 -1.21 0.04 0.00 0.00 177.00 176.54 3ha0 s GLU 444 N -2.40 3.41 -0.02 4.56 2.02 -0.25 -4.95 118.70 121.06 3ha0 s GLU 444 Ca 0.47 -0.43 0.01 0.00 0.02 0.00 0.00 54.97 55.04 3ha0 s GLU 444 Cb -0.14 -3.03 0.02 0.00 0.10 0.00 0.00 34.13 31.08 3ha0 s GLU 444 CO 0.19 0.62 -0.01 0.08 0.02 0.00 0.00 175.26 176.17 3ha0 s VAL 445 N -1.46 0.20 -0.01 2.63 1.01 -1.26 -1.75 120.40 119.75 3ha0 s VAL 445 Ca 0.33 0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.36 3ha0 s VAL 445 Cb -0.13 -0.27 0.00 0.00 0.00 0.00 0.00 36.38 35.99 3ha0 s VAL 445 CO 0.26 0.13 -0.07 -0.31 0.00 0.00 0.00 175.10 175.11 3ha0 s TYR 446 N 0.76 0.68 0.15 5.22 1.51 -0.35 -4.82 117.35 120.50 3ha0 s TYR 446 Ca -0.08 -0.14 0.10 0.00 -1.01 0.00 0.00 57.07 55.94 3ha0 s TYR 446 Cb -0.11 -0.48 -0.04 0.00 -0.11 0.00 0.00 41.96 41.22 3ha0 s TYR 446 CO -0.01 -0.05 -0.18 0.00 -1.11 0.00 0.00 175.55 174.19 3ha0 s ALA 447 N 0.06 2.68 0.06 3.71 0.00 -1.26 -0.69 121.76 126.32 3ha0 s ALA 447 Ca -0.01 -1.46 -0.06 0.00 0.00 0.00 0.00 51.96 50.44 3ha0 s ALA 447 Cb -0.05 -0.57 -0.01 0.00 0.00 0.00 0.00 23.12 22.48 3ha0 s ALA 447 CO -0.00 0.52 0.11 -0.06 0.00 0.00 0.00 175.76 176.33 3ha0 s PHE 448 N -1.38 0.25 -0.04 0.00 0.40 0.19 -4.94 117.98 112.46 3ha0 s PHE 448 Ca 0.20 -0.65 0.00 0.00 -0.60 0.00 0.00 56.93 55.88 3ha0 s PHE 448 Cb -0.10 -0.16 0.03 0.00 0.51 0.00 0.00 43.02 43.30 3ha0 s PHE 448 CO 0.11 -0.44 -0.01 0.00 0.70 0.00 0.00 175.22 175.58 3ha0 s ALA 449 N -3.35 0.47 0.60 5.36 0.00 -1.26 -1.14 121.76 122.44 3ha0 s ALA 449 Ca 0.01 0.06 -0.16 0.00 0.00 0.00 0.00 51.96 51.88 3ha0 s ALA 449 Cb 0.03 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 3ha0 s ALA 449 CO -0.08 -0.11 1.06 0.95 0.00 0.00 0.00 175.76 177.59 3ha0 s THR 450 N 1.12 3.73 0.90 0.00 -4.23 -0.67 -5.01 115.64 111.49 3ha0 s THR 450 Ca -0.08 0.82 -0.14 0.00 -1.18 0.00 0.00 61.69 61.11 3ha0 s THR 450 Cb -0.14 -3.35 0.15 0.00 1.34 0.00 0.00 72.50 70.51 3ha0 s THR 450 CO -0.02 -0.48 1.26 -2.84 -0.54 0.00 0.00 174.62 172.00 3ha0 s PRO 451 N -4.07 1.16 -0.23 3.99 0.02 -1.26 -4.76 135.00 129.85 3ha0 s PRO 451 Ca 0.64 -0.17 -0.29 0.00 0.02 0.00 0.00 61.00 61.20 3ha0 s PRO 451 Cb -0.17 -1.88 -0.02 0.00 0.02 0.00 0.00 34.50 32.45 3ha0 s PRO 451 CO 0.37 -2.10 1.59 -2.00 -0.33 0.00 0.00 177.00 174.53 3ha0 s GLU 452 N -5.74 3.81 0.06 5.54 2.12 -1.26 -4.92 118.70 118.31 3ha0 s GLU 452 Ca 0.69 1.62 -0.30 0.00 0.36 0.00 0.00 54.97 57.34 3ha0 s GLU 452 Cb -0.07 -4.02 -0.05 0.00 0.26 0.00 0.00 34.13 30.25 3ha0 s GLU 452 CO 0.51 -1.28 1.05 -0.46 -0.54 0.00 0.00 175.26 174.55 3ha0 s TRP 453 N 5.12 3.63 0.14 5.30 -0.11 -1.26 -4.96 118.94 126.80 3ha0 s TRP 453 Ca 0.70 1.61 -0.34 0.00 1.22 0.00 0.00 56.10 59.28 3ha0 s TRP 453 Cb -0.24 -3.21 -0.16 0.00 -1.50 0.00 0.00 33.47 28.37 3ha0 s TRP 453 CO 0.29 -0.37 1.29 -0.35 -4.62 0.00 0.00 176.95 173.18 3ha0 n PRO 454 N 3.46 1.30 0.00 5.86 -0.04 -1.26 -2.21 135.00 142.11 3ha0 n PRO 454 Ca 0.06 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.98 3ha0 n PRO 454 Cb 0.49 -2.06 0.00 0.00 -0.04 0.00 0.00 33.50 31.89 3ha0 n PRO 454 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ha0 n GLY 455 N 2.36 2.68 3.05 0.55 0.00 -1.26 -4.91 105.19 107.67 3ha0 n GLY 455 Ca 0.16 -0.63 -0.43 0.00 0.00 0.00 0.00 46.02 45.13 3ha0 n GLY 455 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ha0 n SER 456 N 2.73 5.31 -0.34 1.61 7.64 -0.94 -4.75 113.62 124.89 3ha0 n SER 456 Ca 0.00 -3.11 0.14 0.00 1.01 0.00 0.00 58.87 56.90 3ha0 n SER 456 Cb 0.00 -1.47 0.50 0.00 -1.01 0.00 0.00 64.21 62.23 3ha0 n SER 456 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 3ha0 n ARG 457 N 3.92 1.26 -0.18 1.43 1.85 -1.26 -3.76 116.66 119.92 3ha0 n ARG 457 Ca 0.37 -0.69 0.11 0.00 -1.00 0.00 0.00 57.85 56.63 3ha0 n ARG 457 Cb 0.38 -1.49 0.20 0.00 -1.05 0.00 0.00 32.46 30.50 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 -0.27 3.35 -3.83 2.89 8.00 -1.26 -4.93 116.55 120.50 3ha0 n ASP 458 Ca 0.16 -1.96 -0.12 0.00 0.71 0.00 0.00 54.79 53.59 3ha0 n ASP 458 Cb 0.33 -0.24 -0.10 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 -1.40 0.47 0.04 -1.24 -2.85 -1.25 -1.54 119.74 111.98 3ha0 s LYS 459 Ca 0.36 -0.21 -0.02 0.00 -1.00 0.00 0.00 55.97 55.10 3ha0 s LYS 459 Cb 0.21 0.20 -0.03 0.00 -2.06 0.00 0.00 37.83 36.16 3ha0 s LYS 459 CO 0.29 -0.11 0.00 1.03 0.10 0.00 0.00 175.35 176.66 3ha0 s ARG 460 N -1.05 0.56 -0.15 1.78 0.52 -0.75 -4.85 118.95 115.01 3ha0 s ARG 460 Ca -0.11 -1.00 -0.04 0.00 -0.52 0.00 0.00 55.73 54.05 3ha0 s ARG 460 Cb -0.06 0.20 -0.03 0.00 0.52 0.00 0.00 34.95 35.58 3ha0 s ARG 460 CO 0.02 -0.11 0.00 0.99 0.02 0.00 0.00 175.30 176.22 3ha0 s THR 461 N -3.20 4.25 -0.09 0.02 2.01 -1.26 -0.55 115.64 116.82 3ha0 s THR 461 Ca 0.00 -0.24 -0.04 0.00 0.31 0.00 0.00 61.69 61.73 3ha0 s THR 461 Cb 0.03 -2.86 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 3ha0 s THR 461 CO -0.07 0.51 0.06 -0.76 -0.69 0.00 0.00 174.62 173.67 3ha0 s LEU 462 N 0.05 3.93 0.10 4.42 1.43 0.17 -1.68 118.68 127.10 3ha0 s LEU 462 Ca 0.02 0.27 0.10 0.00 -1.03 0.00 0.00 54.13 53.50 3ha0 s LEU 462 Cb -0.13 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 3ha0 s LEU 462 CO 0.02 0.38 -0.26 0.00 0.23 0.00 0.00 176.35 176.72 3ha0 s ALA 463 N -0.97 2.25 -0.04 4.21 0.00 -0.29 -1.59 121.76 125.33 3ha0 s ALA 463 Ca 0.15 -1.37 -0.02 0.00 0.00 0.00 0.00 51.96 50.72 3ha0 s ALA 463 Cb -0.12 -0.39 0.03 0.00 0.00 0.00 0.00 23.12 22.65 3ha0 s ALA 463 CO 0.04 0.51 0.07 0.00 0.00 0.00 0.00 175.76 176.38 3ha0 s LEU 465 N 2.02 4.13 -0.20 0.00 2.96 0.13 -1.30 118.68 126.42 3ha0 s LEU 465 Ca 0.03 0.17 0.01 0.00 -0.22 0.00 0.00 54.13 54.12 3ha0 s LEU 465 Cb -0.12 -2.16 0.04 0.00 0.50 0.00 0.00 46.19 44.45 3ha0 s LEU 465 CO -0.03 0.05 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.28 3ha0 s ILE 466 N 1.06 1.87 0.28 6.68 1.09 -0.61 -1.21 121.20 130.35 3ha0 s ILE 466 Ca 0.09 -1.11 0.02 0.00 -1.10 0.00 0.00 60.65 58.55 3ha0 s ILE 466 Cb -0.14 -1.87 -0.05 0.00 -1.06 0.00 0.00 42.46 39.35 3ha0 s ILE 466 CO 0.05 0.24 0.11 0.00 -0.10 0.00 0.00 174.94 175.24 3ha0 s GLN 467 N 1.30 1.49 -1.00 2.79 -2.07 -0.72 -0.69 119.66 120.77 3ha0 s GLN 467 Ca -0.01 -1.82 -0.10 0.00 -1.82 0.00 0.00 55.36 51.60 3ha0 s GLN 467 Cb -0.16 -0.30 -0.02 0.00 -1.09 0.00 0.00 33.01 31.44 3ha0 s GLN 467 CO -0.09 -0.32 0.79 0.09 -1.32 0.00 0.00 175.29 174.44 3ha0 n ASN 468 N -0.61 -6.20 -3.89 12.60 3.02 -0.95 -1.09 115.26 118.14 3ha0 n ASN 468 Ca -0.00 -0.73 -0.10 0.00 -0.03 0.00 0.00 54.58 53.72 3ha0 n ASN 468 Cb 0.66 -4.15 -0.09 0.00 -0.61 0.00 0.00 39.78 35.58 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 -3.30 0.12 -0.01 3.10 -0.12 -1.08 -4.13 117.98 112.56 3ha0 s PHE 469 Ca 0.33 -0.33 -0.23 0.00 -0.05 0.00 0.00 56.93 56.64 3ha0 s PHE 469 Cb -0.09 -0.09 0.05 0.00 -0.63 0.00 0.00 43.02 42.27 3ha0 s PHE 469 CO 0.81 -0.35 0.52 0.00 -0.05 0.00 0.00 175.22 176.14 3ha0 s MET 470 N -2.20 0.94 0.62 1.99 0.23 -1.24 -0.52 119.30 119.12 3ha0 s MET 470 Ca -0.08 -0.04 -0.10 0.00 -1.03 0.00 0.00 55.69 54.44 3ha0 s MET 470 Cb -0.03 0.43 0.16 0.00 -1.53 0.00 0.00 34.83 33.86 3ha0 s MET 470 CO -0.02 -0.30 0.49 -2.30 -2.03 0.00 0.00 175.02 170.85 3ha0 n PRO 471 N 0.84 -2.42 0.25 3.16 -0.02 -1.26 -1.91 135.00 133.64 3ha0 n PRO 471 Ca -0.19 -0.79 0.14 0.00 -2.02 0.00 0.00 63.50 60.63 3ha0 n PRO 471 Cb 0.58 -0.81 0.53 0.00 -0.02 0.00 0.00 33.50 33.78 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 -5.95 -0.52 4.11 -1.98 -3.44 114.58 106.81 3ha0 h GLU 472 Ca -0.19 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.69 3ha0 h GLU 472 Cb 0.61 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 3ha0 h GLU 472 CO 0.12 0.09 1.47 -0.51 0.07 0.00 0.00 179.01 180.26 3ha0 s ASP 473 N -5.95 5.26 -0.05 3.06 1.01 -1.26 -4.85 116.67 113.89 3ha0 s ASP 473 Ca 0.02 1.40 -0.06 0.00 0.71 0.00 0.00 52.55 54.61 3ha0 s ASP 473 Cb 0.09 -2.51 0.01 0.00 1.01 0.00 0.00 42.92 41.52 3ha0 s ASP 473 CO 0.60 -2.19 0.17 -0.51 0.21 0.00 0.00 175.17 173.44 3ha0 s ILE 474 N 9.09 0.02 -0.04 0.77 2.07 -1.26 -4.66 121.20 127.19 3ha0 s ILE 474 Ca 0.92 -0.17 0.03 0.00 -1.41 0.00 0.00 60.65 60.02 3ha0 s ILE 474 Cb -0.25 -0.30 -0.03 0.00 0.13 0.00 0.00 42.46 42.02 3ha0 s ILE 474 CO 0.31 -0.09 -0.12 -0.44 -1.91 0.00 0.00 174.94 172.69 3ha0 s SER 475 N -0.27 4.22 0.08 4.50 0.01 -0.78 -4.87 113.70 116.59 3ha0 s SER 475 Ca -0.04 -0.17 0.08 0.00 1.31 0.00 0.00 55.95 57.13 3ha0 s SER 475 Cb -0.03 -0.93 -0.03 0.00 0.21 0.00 0.00 66.02 65.24 3ha0 s SER 475 CO 0.01 0.34 -0.20 -0.69 0.41 0.00 0.00 173.24 173.10 3ha0 s VAL 476 N -0.79 1.61 0.07 3.43 1.01 -1.26 0.12 120.40 124.58 3ha0 s VAL 476 Ca 0.13 -1.43 -0.20 0.00 0.00 0.00 0.00 61.98 60.47 3ha0 s VAL 476 Cb -0.11 -1.46 0.05 0.00 0.00 0.00 0.00 36.38 34.86 3ha0 s VAL 476 CO 0.02 -0.03 0.48 0.00 0.00 0.00 0.00 175.10 175.57 3ha0 s GLN 477 N -1.72 1.03 0.06 2.72 -2.07 0.12 -4.98 119.66 114.82 3ha0 s GLN 477 Ca 0.05 -0.35 0.07 0.00 -1.82 0.00 0.00 55.36 53.31 3ha0 s GLN 477 Cb -0.10 0.47 -0.03 0.00 -1.09 0.00 0.00 33.01 32.25 3ha0 s GLN 477 CO 0.03 -0.38 -0.15 -1.58 -1.32 0.00 0.00 175.29 171.90 3ha0 s TRP 478 N -2.75 2.64 0.21 9.60 0.52 -1.26 -0.27 118.94 127.63 3ha0 s TRP 478 Ca -0.04 -0.21 0.06 0.00 0.02 0.00 0.00 56.10 55.94 3ha0 s TRP 478 Cb -0.00 -1.47 -0.05 0.00 -1.15 0.00 0.00 33.47 30.80 3ha0 s TRP 478 CO -0.04 0.32 -0.10 -0.51 0.02 0.00 0.00 176.95 176.63 3ha0 s LEU 479 N -1.66 2.49 -0.27 2.99 1.02 -0.41 -1.43 118.68 121.41 3ha0 s LEU 479 Ca 0.17 -1.07 -0.09 0.00 0.02 0.00 0.00 54.13 53.16 3ha0 s LEU 479 Cb -0.11 -0.56 0.12 0.00 0.02 0.00 0.00 46.19 45.67 3ha0 s LEU 479 CO 0.08 -0.27 0.58 -2.28 0.02 0.00 0.00 176.35 174.47 3ha0 s HIS 480 N -3.10 -1.19 -1.42 0.29 2.46 -0.47 -2.48 115.29 109.38 3ha0 s HIS 480 Ca 0.23 2.05 -0.05 0.00 0.47 0.00 0.00 55.06 57.77 3ha0 s HIS 480 Cb 0.02 0.64 0.01 0.00 -0.13 0.00 0.00 32.58 33.11 3ha0 s HIS 480 CO 0.07 -0.62 0.61 0.09 -2.47 0.00 0.00 174.74 172.42 3ha0 n ASN 481 N 5.43 -5.82 -1.54 9.88 4.13 -1.26 -1.52 115.26 124.56 3ha0 n ASN 481 Ca -0.10 -0.29 -0.20 0.00 1.68 0.00 0.00 54.58 55.67 3ha0 n ASN 481 Cb 0.49 -4.62 -0.09 0.00 -1.54 0.00 0.00 39.78 34.03 3ha0 n ASN 481 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 3ha0 n GLU 482 N -3.85 -1.48 -3.88 3.52 4.07 -1.26 -4.95 120.64 112.80 3ha0 n GLU 482 Ca -0.09 1.20 -0.36 0.00 -0.06 0.00 0.00 57.16 57.85 3ha0 n GLU 482 Cb 0.61 -5.60 -0.14 0.00 -0.06 0.00 0.00 31.44 26.25 3ha0 n GLU 482 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 3ha0 s VAL 483 N -2.70 3.35 0.09 6.31 1.01 -0.58 -5.08 120.40 122.81 3ha0 s VAL 483 Ca 0.00 -0.82 -0.31 0.00 0.00 0.00 0.00 61.98 60.85 3ha0 s VAL 483 Cb 0.00 -2.69 -0.09 0.00 0.00 0.00 0.00 36.38 33.60 3ha0 s VAL 483 CO 0.00 0.19 1.76 -1.58 0.00 0.00 0.00 175.10 175.47 3ha0 s GLN 484 N 1.41 4.16 0.53 2.72 0.74 -1.26 -1.36 119.66 126.60 3ha0 s GLN 484 Ca 0.02 2.47 -0.18 0.00 0.05 0.00 0.00 55.36 57.73 3ha0 s GLN 484 Cb -0.16 -3.65 -0.07 0.00 1.10 0.00 0.00 33.01 30.23 3ha0 s GLN 484 CO -0.02 -0.81 1.02 -0.51 -0.55 0.00 0.00 175.29 174.43 3ha0 s LEU 485 N 2.86 3.66 0.66 3.68 1.43 -0.51 -4.96 118.68 125.50 3ha0 s LEU 485 Ca 0.78 1.76 -0.16 0.00 -1.03 0.00 0.00 54.13 55.48 3ha0 s LEU 485 Cb -0.43 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.26 3ha0 s LEU 485 CO 0.35 -0.83 1.17 -2.16 0.23 0.00 0.00 176.35 175.10 3ha0 s PRO 486 N -3.79 2.62 0.34 1.29 0.04 -1.26 -4.75 135.00 129.50 3ha0 s PRO 486 Ca 0.63 1.64 0.04 0.00 0.04 0.00 0.00 61.00 63.34 3ha0 s PRO 486 Cb -0.14 -1.91 0.62 0.00 0.04 0.00 0.00 34.50 33.11 3ha0 s PRO 486 CO 0.29 -1.44 1.92 -0.44 0.04 0.00 0.00 177.00 177.37 3ha0 h ASP 487 N 0.17 0.57 0.14 6.66 5.19 -1.95 -2.18 116.42 125.01 3ha0 h ASP 487 Ca -0.48 -0.08 0.00 0.00 -0.62 0.00 0.00 57.03 55.85 3ha0 h ASP 487 Cb 1.28 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 40.64 3ha0 h ASP 487 CO 0.53 0.55 0.00 0.00 -3.12 0.00 0.00 179.24 177.20 3ha0 h ALA 488 N 1.53 1.00 -0.11 3.45 0.00 -2.04 -2.52 119.26 120.57 3ha0 h ALA 488 Ca 0.15 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 3ha0 h ALA 488 Cb 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3ha0 h ALA 488 CO -0.01 0.00 -0.47 0.00 0.00 0.00 0.00 179.25 178.78 3ha0 h ARG 489 N 0.00 0.28 -6.46 0.00 2.47 -1.76 -3.45 114.38 105.46 3ha0 h ARG 489 Ca 0.00 -0.15 -0.64 0.00 -1.26 0.00 0.00 59.98 57.94 3ha0 h ARG 489 Cb 0.07 0.01 -0.17 0.00 -1.65 0.00 0.00 29.97 28.23 3ha0 h ARG 489 CO 0.00 0.69 -0.80 -3.38 0.56 0.00 0.00 179.97 177.04 3ha0 s HIS 490 N -4.04 2.28 -0.05 3.04 -3.43 -0.95 -4.22 115.29 107.92 3ha0 s HIS 490 Ca -0.05 -0.35 0.05 0.00 -0.80 0.00 0.00 55.06 53.91 3ha0 s HIS 490 Cb 0.13 -1.08 -0.01 0.00 -1.43 0.00 0.00 32.58 30.19 3ha0 s HIS 490 CO 0.78 0.57 -0.21 -1.54 -2.00 0.00 0.00 174.74 172.34 3ha0 s SER 491 N -2.96 2.62 -0.04 7.38 1.04 -0.79 -4.94 113.70 116.00 3ha0 s SER 491 Ca 0.24 -0.43 0.07 0.00 0.48 0.00 0.00 55.95 56.30 3ha0 s SER 491 Cb -0.07 -0.73 -0.01 0.00 0.10 0.00 0.00 66.02 65.31 3ha0 s SER 491 CO 0.11 0.20 -0.25 -0.89 0.98 0.00 0.00 173.24 173.39 3ha0 s THR 492 N -0.06 2.03 0.87 2.02 2.01 -1.26 -0.83 115.64 120.41 3ha0 s THR 492 Ca -0.04 -1.07 -0.12 0.00 0.31 0.00 0.00 61.69 60.78 3ha0 s THR 492 Cb -0.13 -1.70 0.11 0.00 0.01 0.00 0.00 72.50 70.79 3ha0 s THR 492 CO 0.03 0.57 1.11 0.42 -0.69 0.00 0.00 174.62 176.05 3ha0 s THR 493 N -0.30 2.59 0.20 -0.82 -4.23 0.58 -5.00 115.64 108.65 3ha0 s THR 493 Ca 0.01 0.19 -0.24 0.00 -1.18 0.00 0.00 61.69 60.47 3ha0 s THR 493 Cb -0.12 -2.86 -0.08 0.00 1.34 0.00 0.00 72.50 70.77 3ha0 s THR 493 CO 0.02 -0.25 0.79 -1.10 -0.54 0.00 0.00 174.62 173.54 3ha0 s GLN 494 N -5.12 4.51 -0.07 3.99 -1.52 -1.26 -4.66 119.66 115.53 3ha0 s GLN 494 Ca 0.63 1.12 -0.36 0.00 -1.95 0.00 0.00 55.36 54.80 3ha0 s GLN 494 Cb -0.16 -3.14 -0.14 0.00 -0.22 0.00 0.00 33.01 29.36 3ha0 s GLN 494 CO 0.55 0.51 1.69 -2.30 -0.25 0.00 0.00 175.29 175.48 3ha0 n PRO 495 N 1.30 1.69 -4.32 2.91 -0.02 -1.26 -4.82 135.00 130.48 3ha0 n PRO 495 Ca -0.04 0.62 -0.28 0.00 -2.02 0.00 0.00 63.50 61.78 3ha0 n PRO 495 Cb 0.49 -2.36 -0.11 0.00 -0.02 0.00 0.00 33.50 31.50 3ha0 n PRO 495 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3ha0 s ARG 496 N 2.67 1.84 0.06 -0.52 0.52 -0.47 -4.92 118.95 118.14 3ha0 s ARG 496 Ca 0.90 -1.29 -0.31 0.00 -0.52 0.00 0.00 55.73 54.52 3ha0 s ARG 496 Cb -0.85 -2.08 -0.06 0.00 0.52 0.00 0.00 34.95 32.48 3ha0 s ARG 496 CO 0.52 0.45 1.29 0.15 0.02 0.00 0.00 175.30 177.73 3ha0 s LYS 497 N -2.53 4.37 1.03 3.54 1.02 -1.26 -0.87 119.74 125.04 3ha0 s LYS 497 Ca 0.21 1.90 -0.16 0.00 0.02 0.00 0.00 55.97 57.94 3ha0 s LYS 497 Cb -0.09 -3.36 0.21 0.00 -0.52 0.00 0.00 37.83 34.06 3ha0 s LYS 497 CO 0.12 -0.38 1.18 0.95 -0.92 0.00 0.00 175.35 176.30 3ha0 s THR 498 N 1.37 1.86 0.33 2.17 -4.23 -0.30 -4.88 115.64 111.96 3ha0 s THR 498 Ca 0.61 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 61.14 3ha0 s THR 498 Cb -0.32 -2.71 0.27 0.00 1.34 0.00 0.00 72.50 71.08 3ha0 s THR 498 CO 0.29 0.00 1.98 0.07 -0.54 0.00 0.00 174.62 176.41 3ha0 h LYS 499 N -1.94 0.91 0.00 3.99 2.10 -1.96 -3.39 116.57 116.29 3ha0 h LYS 499 Ca -0.47 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.12 3ha0 h LYS 499 Cb 1.29 -0.21 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 3ha0 h LYS 499 CO 0.46 0.60 0.00 0.41 -2.00 0.00 0.00 179.45 178.92 3ha0 n GLY 500 N -1.43 1.61 2.00 0.07 0.00 -1.26 -5.05 105.19 101.12 3ha0 n GLY 500 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.01 -4.10 1.61 2.88 -1.26 -5.13 113.62 107.61 3ha0 n SER 501 Ca 0.00 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.25 3ha0 n SER 501 Cb 0.00 0.09 0.23 0.00 -0.75 0.00 0.00 64.21 63.79 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 -4.49 1.54 0.13 0.46 0.00 -1.26 -4.59 107.32 99.12 3ha0 s GLY 502 Ca 0.00 -0.65 0.04 0.00 0.00 0.00 0.00 44.72 44.10 3ha0 s GLY 502 CO 0.00 0.16 0.17 -1.36 0.00 0.00 0.00 173.10 172.07 3ha0 s PHE 503 N -2.80 3.28 0.23 1.90 0.40 0.32 -1.15 117.98 120.15 3ha0 s PHE 503 Ca 0.69 0.06 0.05 0.00 -0.60 0.00 0.00 56.93 57.12 3ha0 s PHE 503 Cb -0.15 -1.60 -0.05 0.00 0.51 0.00 0.00 43.02 41.73 3ha0 s PHE 503 CO 0.58 0.53 -0.04 -0.59 0.70 0.00 0.00 175.22 176.40 3ha0 s PHE 504 N -1.65 1.62 -0.19 0.36 -0.12 -0.05 -2.25 117.98 115.70 3ha0 s PHE 504 Ca 0.32 -0.82 -0.26 0.00 -0.05 0.00 0.00 56.93 56.12 3ha0 s PHE 504 Cb -0.11 -0.91 0.07 0.00 -0.63 0.00 0.00 43.02 41.44 3ha0 s PHE 504 CO 0.25 0.08 0.68 0.54 -0.05 0.00 0.00 175.22 176.72 3ha0 s VAL 505 N -3.28 0.00 0.11 -2.49 0.11 0.13 -1.37 120.40 113.62 3ha0 s VAL 505 Ca 0.26 -0.01 0.03 0.00 -2.93 0.00 0.00 61.98 59.33 3ha0 s VAL 505 Cb 0.04 -0.96 -0.04 0.00 -1.53 0.00 0.00 36.38 33.89 3ha0 s VAL 505 CO 0.08 -0.01 0.16 -0.36 -3.33 0.00 0.00 175.10 171.64 3ha0 s PHE 506 N -0.12 3.30 -0.03 1.54 0.40 -1.26 -1.58 117.98 120.23 3ha0 s PHE 506 Ca -0.03 0.09 0.01 0.00 -0.60 0.00 0.00 56.93 56.40 3ha0 s PHE 506 Cb -0.03 -1.62 0.01 0.00 0.51 0.00 0.00 43.02 41.88 3ha0 s PHE 506 CO 0.04 0.53 -0.05 0.45 0.70 0.00 0.00 175.22 176.88 3ha0 s SER 507 N -2.78 0.89 0.01 1.36 0.15 -0.42 -0.31 113.70 112.61 3ha0 s SER 507 Ca 0.32 -0.13 0.05 0.00 0.70 0.00 0.00 55.95 56.88 3ha0 s SER 507 Cb -0.11 -0.33 -0.03 0.00 -1.71 0.00 0.00 66.02 63.83 3ha0 s SER 507 CO 0.25 -0.00 -0.12 -0.60 1.20 0.00 0.00 173.24 173.97 3ha0 s ARG 508 N 0.52 2.38 -0.22 5.44 3.52 -0.01 -1.36 118.95 129.23 3ha0 s ARG 508 Ca -0.07 -0.81 -0.05 0.00 -0.13 0.00 0.00 55.73 54.67 3ha0 s ARG 508 Cb -0.11 -2.37 0.11 0.00 -1.56 0.00 0.00 34.95 31.02 3ha0 s ARG 508 CO 0.00 0.58 0.41 -1.17 -0.81 0.00 0.00 175.30 174.32 3ha0 s LEU 509 N -1.31 -0.67 0.06 -0.88 2.96 -0.62 -1.88 118.68 116.34 3ha0 s LEU 509 Ca 0.15 0.70 -0.30 0.00 -0.22 0.00 0.00 54.13 54.47 3ha0 s LEU 509 Cb -0.11 1.29 -0.05 0.00 0.50 0.00 0.00 46.19 47.83 3ha0 s LEU 509 CO 0.06 -0.26 0.95 -1.61 -1.32 0.00 0.00 176.35 174.17 3ha0 s GLU 510 N 2.60 4.63 0.21 1.98 2.02 -1.26 -0.65 118.70 128.22 3ha0 s GLU 510 Ca 0.05 1.41 0.09 0.00 0.02 0.00 0.00 54.97 56.53 3ha0 s GLU 510 Cb -0.13 -3.41 -0.05 0.00 0.10 0.00 0.00 34.13 30.64 3ha0 s GLU 510 CO -0.14 0.11 -0.16 0.14 0.02 0.00 0.00 175.26 175.22 3ha0 s VAL 511 N 0.41 1.92 0.26 2.63 -7.23 0.29 -4.98 120.40 113.69 3ha0 s VAL 511 Ca 0.48 -2.20 0.09 0.00 -1.81 0.00 0.00 61.98 58.54 3ha0 s VAL 511 Cb -0.22 -2.06 -0.04 0.00 0.56 0.00 0.00 36.38 34.62 3ha0 s VAL 511 CO 0.29 -0.50 0.06 0.42 -0.31 0.00 0.00 175.10 175.06 3ha0 s THR 512 N -2.68 3.79 0.28 5.32 -4.23 -1.26 -1.82 115.64 115.04 3ha0 s THR 512 Ca 0.23 -1.72 -0.03 0.00 -1.18 0.00 0.00 61.69 58.99 3ha0 s THR 512 Cb -0.03 -3.03 0.26 0.00 1.34 0.00 0.00 72.50 71.05 3ha0 s THR 512 CO 0.09 -0.35 1.95 -0.09 -0.54 0.00 0.00 174.62 175.68 3ha0 h ARG 513 N 1.81 1.17 -0.90 3.99 2.43 -1.64 -1.71 114.38 119.53 3ha0 h ARG 513 Ca -0.46 -0.07 0.18 0.00 -0.81 0.00 0.00 59.98 58.82 3ha0 h ARG 513 Cb 1.24 -0.26 -0.07 0.00 -0.42 0.00 0.00 29.97 30.46 3ha0 h ARG 513 CO 0.60 0.77 0.58 0.00 -1.51 0.00 0.00 179.97 180.42 3ha0 h ALA 514 N 1.45 2.01 0.12 2.80 0.00 -1.96 -2.64 119.26 121.04 3ha0 h ALA 514 Ca 0.33 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 55.08 3ha0 h ALA 514 Cb -0.12 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.62 3ha0 h ALA 514 CO -0.08 -0.28 -0.85 0.93 0.00 0.00 0.00 179.25 178.96 3ha0 h GLU 515 N 0.54 0.26 0.00 0.00 5.08 -1.70 -3.12 114.58 115.63 3ha0 h GLU 515 Ca 0.47 -0.44 -0.13 0.00 -1.00 0.00 0.00 59.36 58.26 3ha0 h GLU 515 Cb 0.96 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.35 3ha0 h GLU 515 CO -0.21 1.21 -0.61 0.11 -1.00 0.00 0.00 179.01 178.51 3ha0 h TRP 516 N -0.43 0.00 0.00 4.33 0.09 -1.47 -1.96 115.95 116.51 3ha0 h TRP 516 Ca -0.16 0.00 -0.12 0.00 0.09 0.00 0.00 58.89 58.70 3ha0 h TRP 516 Cb 1.60 0.00 -0.02 0.00 0.08 0.00 0.00 29.16 30.82 3ha0 h TRP 516 CO 0.19 0.61 -0.56 0.93 0.09 0.00 0.00 178.44 179.70 3ha0 h GLU 517 N 0.00 0.00 -0.08 0.12 5.08 -1.61 0.55 114.58 118.64 3ha0 h GLU 517 Ca -0.01 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3ha0 h GLU 517 Cb 1.37 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.62 3ha0 h GLU 517 CO 0.08 0.56 -0.10 0.37 -1.00 0.00 0.00 179.01 178.93 3ha0 h GLN 518 N 0.00 0.20 -1.19 2.33 -0.00 -1.45 -3.44 115.11 111.56 3ha0 h GLN 518 Ca -0.01 -0.11 0.01 0.00 -0.00 0.00 0.00 58.65 58.55 3ha0 h GLN 518 Cb 1.03 0.01 -0.23 0.00 0.00 0.00 0.00 27.48 28.29 3ha0 h GLN 518 CO 0.07 0.66 -0.36 0.21 0.00 0.00 0.00 178.83 179.41 3ha0 s LYS 519 N -4.17 0.52 -1.39 1.69 2.47 -0.75 -5.08 119.74 113.03 3ha0 s LYS 519 Ca -0.15 0.73 -0.12 0.00 -1.56 0.00 0.00 55.97 54.87 3ha0 s LYS 519 Cb 0.03 0.24 0.09 0.00 -1.46 0.00 0.00 37.83 36.74 3ha0 s LYS 519 CO 0.72 -0.79 2.10 -3.47 0.16 0.00 0.00 175.35 174.08 3ha0 n ASP 520 N 5.41 4.55 -3.58 1.43 4.64 0.16 -4.34 116.55 124.83 3ha0 n ASP 520 Ca 0.01 -2.95 -0.01 0.00 -1.38 0.00 0.00 54.79 50.45 3ha0 n ASP 520 Cb 0.52 -1.58 -0.04 0.00 -1.04 0.00 0.00 41.12 38.98 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 1.92 0.50 -0.10 -0.67 2.12 -1.26 -4.57 118.70 116.64 3ha0 s GLU 521 Ca 0.44 1.20 0.03 0.00 0.36 0.00 0.00 54.97 57.01 3ha0 s GLU 521 Cb 0.12 0.67 0.01 0.00 0.26 0.00 0.00 34.13 35.19 3ha0 s GLU 521 CO -0.05 -0.16 -0.20 -0.06 -0.54 0.00 0.00 175.26 174.24 3ha0 s PHE 522 N 2.61 2.29 -0.11 5.30 0.40 -0.02 -4.57 117.98 123.89 3ha0 s PHE 522 Ca -0.05 -0.97 -0.12 0.00 -0.60 0.00 0.00 56.93 55.19 3ha0 s PHE 522 Cb -0.09 -1.56 -0.05 0.00 0.51 0.00 0.00 43.02 41.82 3ha0 s PHE 522 CO -0.18 -0.42 0.27 0.42 0.70 0.00 0.00 175.22 176.00 3ha0 s ILE 523 N 0.54 5.30 -0.26 0.64 1.09 -1.03 -2.04 121.20 125.44 3ha0 s ILE 523 Ca -0.15 0.50 -0.08 0.00 -1.10 0.00 0.00 60.65 59.82 3ha0 s ILE 523 Cb -0.17 -3.57 -0.02 0.00 -1.06 0.00 0.00 42.46 37.64 3ha0 s ILE 523 CO 0.05 0.52 0.08 0.00 -0.10 0.00 0.00 174.94 175.49 3ha0 s ARG 525 N 1.61 1.57 -0.01 0.00 3.52 0.63 -1.63 118.95 124.64 3ha0 s ARG 525 Ca 0.06 -0.92 0.04 0.00 -0.13 0.00 0.00 55.73 54.78 3ha0 s ARG 525 Cb -0.15 -1.64 -0.01 0.00 -1.56 0.00 0.00 34.95 31.59 3ha0 s ARG 525 CO 0.04 0.43 -0.13 0.00 -0.81 0.00 0.00 175.30 174.83 3ha0 s ALA 526 N -0.71 1.06 -0.12 6.12 0.00 0.15 0.15 121.76 128.41 3ha0 s ALA 526 Ca 0.08 -0.53 -0.02 0.00 0.00 0.00 0.00 51.96 51.49 3ha0 s ALA 526 Cb -0.09 -0.29 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 3ha0 s ALA 526 CO 0.01 0.24 -0.04 0.08 0.00 0.00 0.00 175.76 176.06 3ha0 s VAL 527 N -0.21 3.94 -0.10 0.00 1.01 0.12 -1.42 120.40 123.73 3ha0 s VAL 527 Ca 0.03 -0.36 -0.24 0.00 0.00 0.00 0.00 61.98 61.41 3ha0 s VAL 527 Cb -0.06 -2.69 0.05 0.00 0.00 0.00 0.00 36.38 33.69 3ha0 s VAL 527 CO -0.00 0.54 0.56 -2.28 0.00 0.00 0.00 175.10 173.92 3ha0 s HIS 528 N -0.13 -0.54 0.10 5.22 2.46 -1.18 -1.87 115.29 119.35 3ha0 s HIS 528 Ca 0.03 1.08 -0.27 0.00 0.47 0.00 0.00 55.06 56.37 3ha0 s HIS 528 Cb -0.13 0.27 -0.09 0.00 -0.13 0.00 0.00 32.58 32.50 3ha0 s HIS 528 CO 0.02 -0.46 1.44 0.93 -2.47 0.00 0.00 174.74 174.21 3ha0 h GLU 529 N 3.96 -0.34 -1.91 2.88 5.08 -1.87 -2.35 114.58 120.04 3ha0 h GLU 529 Ca -0.28 0.02 -0.48 0.00 -1.00 0.00 0.00 59.36 57.62 3ha0 h GLU 529 Cb 1.16 0.08 -0.17 0.00 0.50 0.00 0.00 28.75 30.31 3ha0 h GLU 529 CO 0.30 -0.22 0.41 0.00 -1.00 0.00 0.00 179.01 178.50 3ha0 n ALA 530 N -3.00 6.26 -2.21 3.43 0.00 -1.26 -4.88 120.51 118.84 3ha0 n ALA 530 Ca -0.03 -2.86 -0.18 0.00 0.00 0.00 0.00 53.44 50.37 3ha0 n ALA 530 Cb 0.28 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.71 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 -1.79 4.40 -0.06 0.00 0.00 -0.88 -3.77 121.76 119.66 3ha0 s ALA 531 Ca 0.55 -1.58 -0.14 0.00 0.00 0.00 0.00 51.96 50.79 3ha0 s ALA 531 Cb 0.37 -1.65 0.03 0.00 0.00 0.00 0.00 23.12 21.87 3ha0 s ALA 531 CO -0.19 -0.17 0.33 0.45 0.00 0.00 0.00 175.76 176.19 3ha0 s SER 532 N -4.27 -0.27 -0.02 0.00 0.15 -1.26 -3.75 113.70 104.28 3ha0 s SER 532 Ca 0.51 0.34 -0.04 0.00 0.70 0.00 0.00 55.95 57.46 3ha0 s SER 532 Cb -0.10 0.47 -0.28 0.00 -1.71 0.00 0.00 66.02 64.41 3ha0 s SER 532 CO 0.32 -0.33 0.76 1.55 1.20 0.00 0.00 173.24 176.74 3ha0 h PRO 533 N 4.51 0.26 -1.28 5.44 0.13 -2.01 -3.42 132.00 135.63 3ha0 h PRO 533 Ca -0.28 -0.44 -0.70 0.00 -0.87 0.00 0.00 66.00 63.71 3ha0 h PRO 533 Cb 1.18 0.16 -0.28 0.00 0.13 0.00 0.00 31.00 32.19 3ha0 h PRO 533 CO 0.36 1.11 0.92 -1.13 -0.23 0.00 0.00 178.00 179.03 3ha0 n SER 534 N -3.45 7.65 -2.84 1.44 3.41 -1.26 -4.84 113.62 113.72 3ha0 n SER 534 Ca -0.20 -3.79 -0.22 0.00 -0.26 0.00 0.00 58.87 54.41 3ha0 n SER 534 Cb 1.05 -1.01 0.02 0.00 -0.26 0.00 0.00 64.21 64.01 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 -0.79 -3.90 -3.57 4.33 6.02 -1.25 -4.97 117.38 113.25 3ha0 n GLN 535 Ca 0.60 0.93 -0.14 0.00 -0.01 0.00 0.00 57.00 58.38 3ha0 n GLN 535 Cb 0.55 -5.73 -0.05 0.00 1.02 0.00 0.00 30.24 26.02 3ha0 n GLN 535 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 3ha0 s THR 536 N -3.13 0.03 -0.03 5.09 -1.32 -1.26 -3.13 115.64 111.89 3ha0 s THR 536 Ca 0.21 -0.25 -0.02 0.00 -1.21 0.00 0.00 61.69 60.42 3ha0 s THR 536 Cb -0.10 -0.98 0.01 0.00 -1.51 0.00 0.00 72.50 69.93 3ha0 s THR 536 CO 0.26 -0.14 0.08 -0.69 -2.21 0.00 0.00 174.62 171.93 3ha0 s VAL 537 N -2.52 -0.01 0.02 5.08 1.01 -0.51 -4.13 120.40 119.33 3ha0 s VAL 537 Ca -0.05 0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.98 3ha0 s VAL 537 Cb -0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 36.38 36.22 3ha0 s VAL 537 CO -0.02 0.02 -0.03 0.00 0.00 0.00 0.00 175.10 175.06 3ha0 s GLN 538 N 0.32 0.33 0.02 2.72 -2.07 -1.26 -0.68 119.66 119.05 3ha0 s GLN 538 Ca -0.02 -0.64 0.02 0.00 -1.82 0.00 0.00 55.36 52.90 3ha0 s GLN 538 Cb -0.03 0.09 -0.02 0.00 -1.09 0.00 0.00 33.01 31.96 3ha0 s GLN 538 CO -0.01 -0.05 -0.06 0.50 -1.32 0.00 0.00 175.29 174.35 3ha0 s ARG 539 N -1.54 0.43 0.42 9.60 6.06 -0.64 -5.00 118.95 128.28 3ha0 s ARG 539 Ca -0.15 -0.54 0.08 0.00 -2.50 0.00 0.00 55.73 52.62 3ha0 s ARG 539 Cb -0.09 -0.24 0.01 0.00 0.06 0.00 0.00 34.95 34.69 3ha0 s ARG 539 CO -0.01 0.05 0.57 0.00 -2.50 0.00 0.00 175.30 173.41 3ha0 s ALA 540 N -0.98 4.53 -0.20 6.12 0.00 -1.26 -1.27 121.76 128.70 3ha0 s ALA 540 Ca -0.07 -1.68 -0.28 0.00 0.00 0.00 0.00 51.96 49.93 3ha0 s ALA 540 Cb -0.07 -1.62 0.12 0.00 0.00 0.00 0.00 23.12 21.54 3ha0 s ALA 540 CO 0.00 -0.29 0.98 0.54 0.00 0.00 0.00 175.76 176.99 3ha0 s VAL 541 N -2.36 0.00 0.28 0.00 0.11 -0.86 -4.65 120.40 112.92 3ha0 s VAL 541 Ca 0.55 0.00 0.09 0.00 -2.93 0.00 0.00 61.98 59.69 3ha0 s VAL 541 Cb -0.10 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.70 3ha0 s VAL 541 CO 0.33 0.00 -0.13 -0.44 -3.33 0.00 0.00 175.10 171.53 3ha0 s SER 542 N -0.56 3.21 -0.16 3.54 0.01 -1.26 -0.84 113.70 117.64 3ha0 s SER 542 Ca -0.01 -1.11 -0.04 0.00 1.31 0.00 0.00 55.95 56.11 3ha0 s SER 542 Cb -0.02 -0.25 -0.23 0.00 0.21 0.00 0.00 66.02 65.73 3ha0 s SER 542 CO -0.01 -0.16 0.18 0.52 0.41 0.00 0.00 173.24 174.18 3ha0 n VAL 543 N -0.61 1.69 -0.71 3.43 0.31 -1.26 -4.68 118.33 116.49 3ha0 n VAL 543 Ca -0.06 -0.63 0.00 0.00 -0.01 0.00 0.00 64.34 63.64 3ha0 n VAL 543 Cb 0.62 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 3ha0 n VAL 543 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10