#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3w n THR 341 N 0.00 -8.07 -0.24 3.34 -2.24 -1.26 -3.92 114.28 101.88 3h3w n THR 341 Ca 0.00 2.48 -0.00 0.00 -2.27 0.00 0.00 64.05 64.25 3h3w n THR 341 Cb 0.00 -3.92 0.21 0.00 -2.10 0.00 0.00 70.33 64.51 3h3w n THR 341 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h3w h ALA 342 N 2.98 1.39 -0.69 6.98 0.00 -1.99 -0.91 119.26 127.02 3h3w h ALA 342 Ca 0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3h3w h ALA 342 Cb 0.00 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 3h3w h ALA 342 CO 0.00 0.54 0.43 0.00 0.00 0.00 0.00 179.25 180.22 3h3w h THR 343 N 1.08 1.19 -0.61 0.00 1.03 -1.84 0.55 112.91 114.31 3h3w h THR 343 Ca 0.29 -0.41 -0.01 0.00 -0.01 0.00 0.00 66.41 66.27 3h3w h THR 343 Cb -0.08 0.22 -0.03 0.00 -1.07 0.00 0.00 68.15 67.19 3h3w h THR 343 CO -0.06 0.20 0.34 0.44 -0.01 0.00 0.00 175.52 176.43 3h3w h ASP 344 N 0.94 0.75 -0.48 0.00 3.32 -1.33 -1.87 116.42 117.76 3h3w h ASP 344 Ca 0.25 -0.09 -0.06 0.00 0.02 0.00 0.00 57.03 57.15 3h3w h ASP 344 Cb -0.05 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 3h3w h ASP 344 CO -0.05 0.62 0.09 1.88 -1.72 0.00 0.00 179.24 180.06 3h3w h TYR 345 N 0.82 0.89 -0.67 4.55 -1.99 -0.24 -1.72 116.97 118.62 3h3w h TYR 345 Ca 0.22 -0.10 0.03 0.00 2.00 0.00 0.00 58.73 60.87 3h3w h TYR 345 Cb 0.03 -0.25 -0.04 0.00 2.00 0.00 0.00 36.73 38.46 3h3w h TYR 345 CO -0.01 0.77 0.42 -0.44 -0.00 0.00 0.00 178.16 178.90 3h3w h ASP 346 N 0.81 0.69 0.27 3.88 5.19 0.87 -2.09 116.42 126.04 3h3w h ASP 346 Ca 0.17 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.57 3h3w h ASP 346 Cb 0.36 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 39.73 3h3w h ASP 346 CO 0.01 0.48 -0.16 0.71 -3.12 0.00 0.00 179.24 177.15 3h3w h THR 347 N 0.82 0.00 -0.23 0.35 1.35 -1.20 -1.42 112.91 112.59 3h3w h THR 347 Ca 0.27 0.00 0.08 0.00 -0.55 0.00 0.00 66.41 66.21 3h3w h THR 347 Cb 0.02 0.00 -0.02 0.00 -1.73 0.00 0.00 68.15 66.41 3h3w h THR 347 CO -0.10 0.00 0.14 0.33 -0.25 0.00 0.00 175.52 175.64 3h3w n PHE 348 N -3.21 0.13 -0.07 4.73 -0.00 -0.67 0.45 117.46 118.82 3h3w n PHE 348 Ca -0.05 0.13 -0.09 0.00 -0.00 0.00 0.00 57.45 57.44 3h3w n PHE 348 Cb 0.16 -0.47 -0.15 0.00 -0.00 0.00 0.00 39.48 39.02 3h3w n PHE 348 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 3h3w n VAL 349 N -3.02 1.41 0.76 -2.13 0.31 -1.03 -2.51 118.33 112.12 3h3w n VAL 349 Ca 0.07 -0.83 0.00 0.00 -0.01 0.00 0.00 64.34 63.57 3h3w n VAL 349 Cb 0.26 -0.63 0.00 0.00 -0.91 0.00 0.00 33.84 32.56 3h3w n VAL 349 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3h3w n SER 350 N -2.83 0.25 0.00 4.52 7.64 1.60 -1.80 113.62 123.00 3h3w n SER 350 Ca -0.27 -1.01 0.00 0.00 1.01 0.00 0.00 58.87 58.61 3h3w n SER 350 Cb 1.10 -0.12 0.00 0.00 -1.01 0.00 0.00 64.21 64.18 3h3w n SER 350 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3h3w n GLU 351 N -0.13 0.00 0.23 1.43 1.02 -0.98 -4.16 120.64 118.05 3h3w n GLU 351 Ca 0.00 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.24 3h3w n GLU 351 Cb 0.06 0.00 0.55 0.00 -0.02 0.00 0.00 31.44 32.03 3h3w n GLU 351 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h3w h ARG 352 N 0.00 0.00 0.00 3.49 2.47 -1.59 -2.69 114.38 116.06 3h3w h ARG 352 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3h3w h ARG 352 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 3h3w h ARG 352 CO 0.00 0.00 -0.50 1.19 0.56 0.00 0.00 179.97 181.22 3h3w n PHE 353 N -2.37 0.00 -0.16 3.04 3.72 -0.99 -4.94 117.46 115.76 3h3w n PHE 353 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 3h3w n PHE 353 Cb 0.31 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.85 3h3w n PHE 353 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h3w n GLY 354 N 1.60 0.00 2.01 1.37 0.00 -0.74 -2.36 105.19 107.07 3h3w n GLY 354 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3h3w n GLY 354 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h3w n SER 355 N 0.93 -0.25 -0.87 1.61 3.41 -1.26 -4.89 113.62 112.31 3h3w n SER 355 Ca 0.00 0.26 0.01 0.00 -0.26 0.00 0.00 58.87 58.88 3h3w n SER 355 Cb 0.00 0.36 0.20 0.00 -0.26 0.00 0.00 64.21 64.51 3h3w n SER 355 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3h3w n ILE 356 N -2.97 2.37 -4.18 -1.33 -0.00 -0.99 -4.97 119.36 107.28 3h3w n ILE 356 Ca 0.00 -2.80 -0.20 0.00 -0.00 0.00 0.00 62.75 59.75 3h3w n ILE 356 Cb 0.00 -0.28 -0.16 0.00 -0.00 0.00 0.00 39.64 39.20 3h3w n ILE 356 CO 0.00 0.00 0.00 -0.63 -0.00 0.00 0.00 176.55 175.92 3h3w s ILE 357 N -3.18 0.53 -0.19 7.28 1.01 -1.26 -4.45 121.20 120.94 3h3w s ILE 357 Ca 0.41 -0.14 -0.00 0.00 0.00 0.00 0.00 60.65 60.92 3h3w s ILE 357 Cb 0.38 -0.55 -0.21 0.00 0.01 0.00 0.00 42.46 42.09 3h3w s ILE 357 CO -0.01 0.22 0.07 1.67 0.00 0.00 0.00 174.94 176.88 3h3w n GLN 358 N 3.91 0.70 -3.85 2.79 7.27 0.34 -4.78 117.38 123.75 3h3w n GLN 358 Ca -0.24 0.19 -0.10 0.00 0.07 0.00 0.00 57.00 56.92 3h3w n GLN 358 Cb 0.51 -1.61 -0.08 0.00 2.41 0.00 0.00 30.24 31.48 3h3w n GLN 358 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3h3w s ALA 359 N -2.54 -0.30 -0.03 1.69 0.00 -1.24 -4.98 121.76 114.36 3h3w s ALA 359 Ca -0.27 -0.44 0.01 0.00 0.00 0.00 0.00 51.96 51.25 3h3w s ALA 359 Cb 0.08 0.38 0.02 0.00 0.00 0.00 0.00 23.12 23.60 3h3w s ALA 359 CO 0.69 -0.44 -0.02 0.08 0.00 0.00 0.00 175.76 176.08 3h3w s VAL 360 N -3.21 0.29 -0.32 0.00 1.01 -1.26 -2.54 120.40 114.36 3h3w s VAL 360 Ca -0.00 -0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.01 3h3w s VAL 360 Cb 0.02 -0.35 0.09 0.00 0.00 0.00 0.00 36.38 36.14 3h3w s VAL 360 CO -0.07 0.16 0.02 -1.10 0.00 0.00 0.00 175.10 174.11 3h3w s GLN 361 N 0.84 1.55 -0.61 2.72 -1.52 -0.94 -4.96 119.66 116.74 3h3w s GLN 361 Ca -0.09 -1.68 -0.20 0.00 -1.95 0.00 0.00 55.36 51.43 3h3w s GLN 361 Cb -0.12 -3.03 0.09 0.00 -0.22 0.00 0.00 33.01 29.73 3h3w s GLN 361 CO -0.01 -0.87 0.79 0.99 -0.25 0.00 0.00 175.29 175.94 3h3w s THR 362 N 1.02 4.65 0.29 -0.19 2.01 -1.26 -1.60 115.64 120.55 3h3w s THR 362 Ca 0.07 -0.78 0.11 0.00 0.31 0.00 0.00 61.69 61.40 3h3w s THR 362 Cb -0.19 -4.55 -0.05 0.00 0.01 0.00 0.00 72.50 67.72 3h3w s THR 362 CO -0.09 -1.24 -0.11 0.72 -0.69 0.00 0.00 174.62 173.22 3h3w s PHE 363 N 3.15 2.44 -0.05 4.92 -0.12 -0.94 -4.61 117.98 122.78 3h3w s PHE 363 Ca 0.15 -0.33 0.05 0.00 -0.05 0.00 0.00 56.93 56.76 3h3w s PHE 363 Cb -0.22 -1.14 -0.01 0.00 -0.63 0.00 0.00 43.02 41.02 3h3w s PHE 363 CO 0.08 0.65 -0.21 -0.08 -0.05 0.00 0.00 175.22 175.60 3h3w s THR 364 N -2.47 1.76 -0.13 -4.49 -1.32 -1.26 -1.69 115.64 106.04 3h3w s THR 364 Ca 0.31 -0.91 -0.20 0.00 -1.21 0.00 0.00 61.69 59.69 3h3w s THR 364 Cb -0.04 -1.50 -0.04 0.00 -1.51 0.00 0.00 72.50 69.41 3h3w s THR 364 CO 0.17 0.50 0.54 -0.62 -2.21 0.00 0.00 174.62 173.00 3h3w s ASP 365 N -0.12 6.73 0.18 8.08 2.15 -1.26 -4.95 116.67 127.47 3h3w s ASP 365 Ca -0.02 0.88 0.20 0.00 0.43 0.00 0.00 52.55 54.04 3h3w s ASP 365 Cb -0.12 -2.32 0.86 0.00 -0.30 0.00 0.00 42.92 41.04 3h3w s ASP 365 CO 0.03 -0.07 1.62 -1.54 -0.17 0.00 0.00 175.17 175.03 3h3w n SER 366 N 3.98 0.45 0.07 -0.34 3.41 -1.26 -1.70 113.62 118.22 3h3w n SER 366 Ca -0.05 0.61 0.03 0.00 -0.26 0.00 0.00 58.87 59.21 3h3w n SER 366 Cb 0.51 -0.71 -0.04 0.00 -0.26 0.00 0.00 64.21 63.71 3h3w n SER 366 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3h3w h THR 367 N 0.00 0.41 -2.90 6.66 2.02 -2.02 -3.42 112.91 113.66 3h3w h THR 367 Ca 0.00 -1.76 -0.61 0.00 0.77 0.00 0.00 66.41 64.80 3h3w h THR 367 Cb 0.31 1.95 -0.41 0.00 -1.74 0.00 0.00 68.15 68.26 3h3w h THR 367 CO 0.00 0.23 -0.63 0.29 0.37 0.00 0.00 175.52 175.78 3h3w n LYS 368 N -2.89 1.68 -0.63 6.66 5.02 -0.69 -5.11 118.16 122.21 3h3w n LYS 368 Ca -0.06 -4.33 -0.31 0.00 -2.02 0.00 0.00 58.31 51.60 3h3w n LYS 368 Cb 0.75 -2.19 0.19 0.00 -0.02 0.00 0.00 35.03 33.76 3h3w n LYS 368 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 3h3w n PRO 369 N 1.96 -1.20 -0.38 1.97 -0.02 -1.25 -3.24 135.00 132.83 3h3w n PRO 369 Ca 0.22 -0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.40 3h3w n PRO 369 Cb 0.37 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 3h3w n PRO 369 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h3w n GLY 370 N 0.88 0.00 3.41 -1.23 0.00 -1.26 -4.90 105.19 102.10 3h3w n GLY 370 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 3h3w n GLY 370 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h3w s TYR 371 N -0.85 3.01 -0.32 1.61 4.12 -1.20 -0.66 117.35 123.06 3h3w s TYR 371 Ca 0.00 -0.58 -0.09 0.00 0.02 0.00 0.00 57.07 56.42 3h3w s TYR 371 Cb 0.00 -2.08 0.01 0.00 -1.52 0.00 0.00 41.96 38.37 3h3w s TYR 371 CO 0.00 -0.32 0.14 0.00 0.02 0.00 0.00 175.55 175.40 3h3w s ALA 372 N 1.10 3.21 -0.01 3.71 0.00 -0.49 -4.35 121.76 124.93 3h3w s ALA 372 Ca 0.02 -1.49 -0.16 0.00 0.00 0.00 0.00 51.96 50.32 3h3w s ALA 372 Cb -0.14 -2.36 -0.06 0.00 0.00 0.00 0.00 23.12 20.56 3h3w s ALA 372 CO 0.01 -1.03 0.45 -0.06 0.00 0.00 0.00 175.76 175.12 3h3w s PHE 373 N 1.56 3.70 -0.34 0.00 0.40 -0.68 -1.35 117.98 121.27 3h3w s PHE 373 Ca 0.03 1.02 0.02 0.00 -0.60 0.00 0.00 56.93 57.41 3h3w s PHE 373 Cb -0.18 -2.38 0.10 0.00 0.51 0.00 0.00 43.02 41.08 3h3w s PHE 373 CO 0.05 0.54 0.08 0.42 0.70 0.00 0.00 175.22 177.02 3h3w s ILE 374 N -0.76 1.73 0.32 0.64 -1.09 -1.22 -2.21 121.20 118.61 3h3w s ILE 374 Ca 0.25 -2.02 -0.28 0.00 -2.23 0.00 0.00 60.65 56.37 3h3w s ILE 374 Cb -0.17 -2.29 -0.09 0.00 -1.58 0.00 0.00 42.46 38.33 3h3w s ILE 374 CO 0.14 -0.64 1.11 0.00 -1.23 0.00 0.00 174.94 174.31 3h3w s ALA 375 N 1.12 3.33 -0.17 9.38 0.00 -0.63 -1.74 121.76 133.04 3h3w s ALA 375 Ca 0.11 0.89 -0.04 0.00 0.00 0.00 0.00 51.96 52.92 3h3w s ALA 375 Cb -0.19 -3.33 0.08 0.00 0.00 0.00 0.00 23.12 19.68 3h3w s ALA 375 CO -0.14 -0.24 0.23 0.00 0.00 0.00 0.00 175.76 175.61 3h3w s ALA 376 N -1.28 -0.38 -0.06 0.00 0.00 -1.16 -2.21 121.76 116.67 3h3w s ALA 376 Ca 0.49 0.50 -0.24 0.00 0.00 0.00 0.00 51.96 52.71 3h3w s ALA 376 Cb -0.31 -1.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.57 3h3w s ALA 376 CO 0.39 -1.00 0.73 0.21 0.00 0.00 0.00 175.76 176.09 3h3w s LYS 377 N 2.36 4.45 0.00 0.00 2.20 -1.05 -4.28 119.74 123.41 3h3w s LYS 377 Ca 0.05 0.93 0.05 0.00 -0.36 0.00 0.00 55.97 56.65 3h3w s LYS 377 Cb -0.14 -3.45 0.24 0.00 -1.51 0.00 0.00 37.83 32.97 3h3w s LYS 377 CO -0.11 0.05 1.07 -2.30 -0.36 0.00 0.00 175.35 173.70 3h3w n PRO 378 N 3.80 0.04 -0.01 4.03 -0.02 -1.26 -0.50 135.00 141.08 3h3w n PRO 378 Ca -0.00 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 3h3w n PRO 378 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.49 3h3w n PRO 378 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3h3w n LYS 379 N -1.37 0.00 0.00 -0.52 4.81 -1.26 -4.25 118.16 115.56 3h3w n LYS 379 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 3h3w n LYS 379 Cb 0.05 -2.62 0.00 0.00 0.02 0.00 0.00 35.03 32.48 3h3w n LYS 379 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 3h3w n SER 380 N 0.00 0.00 -0.16 3.14 7.64 -1.26 -4.92 113.62 118.06 3h3w n SER 380 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3h3w n SER 380 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 3h3w n SER 380 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h3w n GLY 381 N 2.06 1.44 0.64 0.23 0.00 -1.26 -5.10 105.19 103.20 3h3w n GLY 381 Ca 0.00 -1.58 -0.02 0.00 0.00 0.00 0.00 46.02 44.42 3h3w n GLY 381 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h3w n LEU 382 N 0.00 0.99 -4.75 0.99 4.77 -1.26 -4.56 117.00 113.17 3h3w n LEU 382 Ca 0.00 0.15 -0.36 0.00 -0.03 0.00 0.00 56.01 55.77 3h3w n LEU 382 Cb 0.00 -0.41 -0.07 0.00 -2.33 0.00 0.00 43.42 40.61 3h3w n LEU 382 CO 0.00 -0.54 -0.11 -0.31 -1.33 0.00 0.00 177.39 175.10 3h3w s TYR 383 N -1.93 3.46 -0.01 -1.77 2.02 -1.26 -4.33 117.35 113.54 3h3w s TYR 383 Ca -0.08 0.47 -0.30 0.00 -0.37 0.00 0.00 57.07 56.79 3h3w s TYR 383 Cb 0.01 -2.20 -0.04 0.00 -0.40 0.00 0.00 41.96 39.33 3h3w s TYR 383 CO 0.12 0.35 1.15 -0.51 -1.57 0.00 0.00 175.55 175.08 3h3w s LEU 384 N 0.16 4.33 -0.56 -1.29 1.43 -1.26 -3.73 118.68 117.75 3h3w s LEU 384 Ca 0.12 1.84 -0.11 0.00 -1.03 0.00 0.00 54.13 54.95 3h3w s LEU 384 Cb -0.12 -3.57 0.02 0.00 0.03 0.00 0.00 46.19 42.55 3h3w s LEU 384 CO 0.01 -0.48 0.50 1.07 0.23 0.00 0.00 176.35 177.69 3h3w n THR 385 N 4.24 -2.77 0.31 5.49 5.66 -1.26 -4.44 114.28 121.51 3h3w n THR 385 Ca 0.09 0.01 0.05 0.00 -3.05 0.00 0.00 64.05 61.16 3h3w n THR 385 Cb 0.47 -2.49 0.24 0.00 -1.55 0.00 0.00 70.33 67.00 3h3w n THR 385 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 3h3w n THR 386 N -1.50 1.31 1.91 1.09 5.66 -1.24 0.34 114.28 121.84 3h3w n THR 386 Ca -0.20 0.36 0.09 0.00 -3.05 0.00 0.00 64.05 61.24 3h3w n THR 386 Cb 0.56 -1.22 0.51 0.00 -1.55 0.00 0.00 70.33 68.63 3h3w n THR 386 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 175.07 173.35 3h3w n VAL 387 N -1.61 0.00 -2.88 1.08 0.24 -1.26 -4.87 118.33 109.03 3h3w n VAL 387 Ca 0.02 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.21 3h3w n VAL 387 Cb 0.11 -0.30 0.05 0.00 -1.47 0.00 0.00 33.84 32.24 3h3w n VAL 387 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h3w n GLN 388 N -0.78 -1.75 0.00 7.34 3.00 1.02 -4.33 117.38 121.89 3h3w n GLN 388 Ca 0.13 0.71 0.00 0.00 -0.01 0.00 0.00 57.00 57.83 3h3w n GLN 388 Cb 0.06 -4.93 0.00 0.00 0.00 0.00 0.00 30.24 25.37 3h3w n GLN 388 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3h3w n ARG 389 N -2.81 0.00 0.00 -1.09 1.74 -0.86 -4.83 116.66 108.80 3h3w n ARG 389 Ca -0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 3h3w n ARG 389 Cb 0.59 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.03 3h3w n ARG 389 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3h3w n GLU 390 N 0.00 0.00 -0.02 5.56 1.02 -1.26 0.39 120.64 126.33 3h3w n GLU 390 Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.08 3h3w n GLU 390 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.40 3h3w n GLU 390 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3h3w n ASP 391 N 0.00 1.25 0.00 1.62 8.00 -1.26 -4.38 116.55 121.78 3h3w n ASP 391 Ca 0.00 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.70 3h3w n ASP 391 Cb 0.00 -0.45 0.03 0.00 -0.02 0.00 0.00 41.12 40.68 3h3w n ASP 391 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 3h3w n ILE 392 N -3.77 0.00 -0.06 0.53 -5.35 1.25 0.17 119.36 112.13 3h3w n ILE 392 Ca -0.10 0.00 -0.07 0.00 -0.27 0.00 0.00 62.75 62.31 3h3w n ILE 392 Cb 0.33 -0.61 -0.08 0.00 -1.74 0.00 0.00 39.64 37.54 3h3w n ILE 392 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 3h3w n LYS 393 N -0.66 1.64 -0.27 6.28 4.81 -1.10 -4.12 118.16 124.74 3h3w n LYS 393 Ca 0.01 0.02 -0.01 0.00 -0.87 0.00 0.00 58.31 57.46 3h3w n LYS 393 Cb 0.00 -1.27 0.19 0.00 0.02 0.00 0.00 35.03 33.97 3h3w n LYS 393 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 3h3w h ASN 394 N 0.00 0.97 0.08 3.14 4.21 -0.48 -1.62 115.58 121.87 3h3w h ASN 394 Ca -0.29 -0.04 -0.21 0.00 1.21 0.00 0.00 56.30 56.97 3h3w h ASN 394 Cb 1.59 -0.24 0.00 0.00 -1.12 0.00 0.00 38.32 38.55 3h3w h ASN 394 CO -0.00 0.72 -0.80 1.88 -1.29 0.00 0.00 177.43 177.93 3h3w h TYR 395 N 1.13 0.81 -0.75 1.19 -1.99 -1.75 -2.19 116.97 113.41 3h3w h TYR 395 Ca 0.30 -0.37 0.16 0.00 2.00 0.00 0.00 58.73 60.82 3h3w h TYR 395 Cb -0.10 -0.12 -0.14 0.00 2.00 0.00 0.00 36.73 38.38 3h3w h TYR 395 CO 0.00 1.18 -0.08 -0.07 -0.00 0.00 0.00 178.16 179.18 3h3w h LEU 396 N 0.39 -0.51 -4.54 3.88 -0.00 -1.63 -2.13 115.31 110.77 3h3w h LEU 396 Ca -0.05 0.21 -0.13 0.00 -0.00 0.00 0.00 57.88 57.91 3h3w h LEU 396 Cb 1.41 0.40 -0.03 0.00 -0.00 0.00 0.00 40.66 42.44 3h3w h LEU 396 CO 0.15 -0.21 0.23 0.29 -0.00 0.00 0.00 178.44 178.90 3h3w n LYS 397 N -5.42 1.17 -3.57 1.13 5.02 -0.64 -4.53 118.16 111.33 3h3w n LYS 397 Ca 0.12 -0.62 -0.25 0.00 -2.02 0.00 0.00 58.31 55.54 3h3w n LYS 397 Cb 0.43 -1.83 -0.16 0.00 -0.02 0.00 0.00 35.03 33.46 3h3w n LYS 397 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3h3w s ASP 398 N 2.54 2.39 -0.03 4.39 1.11 -0.80 -5.00 116.67 121.26 3h3w s ASP 398 Ca 0.37 -0.68 0.02 0.00 0.18 0.00 0.00 52.55 52.43 3h3w s ASP 398 Cb 0.17 -0.13 0.01 0.00 1.07 0.00 0.00 42.92 44.04 3h3w s ASP 398 CO -0.00 -0.36 -0.07 -0.31 1.18 0.00 0.00 175.17 175.60 3h3w s TYR 399 N 2.17 0.87 0.00 4.23 1.51 -1.26 -5.04 117.35 119.83 3h3w s TYR 399 Ca 0.04 -0.23 0.00 0.00 -1.01 0.00 0.00 57.07 55.87 3h3w s TYR 399 Cb -0.16 -0.66 0.00 0.00 -0.11 0.00 0.00 41.96 41.03 3h3w s TYR 399 CO -0.16 -0.13 0.00 0.09 -1.11 0.00 0.00 175.55 174.24 3h3w n ASN 400 N 3.53 0.00 -4.19 2.29 4.13 -1.26 -5.16 115.26 114.60 3h3w n ASN 400 Ca -0.20 0.00 -0.12 0.00 1.68 0.00 0.00 54.58 55.94 3h3w n ASN 400 Cb 0.53 0.00 -0.10 0.00 -1.54 0.00 0.00 39.78 38.67 3h3w n ASN 400 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 3h3w s LEU 401 N -0.95 1.39 0.00 3.41 0.20 -1.26 -5.14 118.68 116.33 3h3w s LEU 401 Ca 0.00 -1.33 0.00 0.00 0.69 0.00 0.00 54.13 53.49 3h3w s LEU 401 Cb 0.00 0.32 0.00 0.00 -0.43 0.00 0.00 46.19 46.08 3h3w s LEU 401 CO 0.00 -0.79 0.00 0.00 -0.29 0.00 0.00 176.35 175.27 3h3w n ALA 402 N -0.23 0.00 1.35 5.97 0.00 -1.26 -4.82 120.51 121.52 3h3w n ALA 402 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3h3w n ALA 402 Cb 0.65 0.00 0.41 0.00 0.00 0.00 0.00 19.45 20.51 3h3w n ALA 402 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3h3w n PRO 403 N 1.21 1.51 -3.58 0.00 -0.04 -1.26 -4.86 135.00 127.98 3h3w n PRO 403 Ca 0.00 -0.97 -0.29 0.00 -0.04 0.00 0.00 63.50 62.21 3h3w n PRO 403 Cb 0.00 -1.48 -0.03 0.00 -0.04 0.00 0.00 33.50 31.95 3h3w n PRO 403 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3h3w s ILE 404 N -2.15 5.14 -0.06 0.52 -4.36 -1.26 -5.01 121.20 114.02 3h3w s ILE 404 Ca 0.32 -0.15 0.05 0.00 -0.26 0.00 0.00 60.65 60.61 3h3w s ILE 404 Cb 0.20 -3.71 -0.02 0.00 1.25 0.00 0.00 42.46 40.19 3h3w s ILE 404 CO 0.39 -0.17 -0.21 0.28 0.24 0.00 0.00 174.94 175.47 3h3w s THR 405 N -1.89 2.48 0.64 8.37 -1.32 0.16 -4.95 115.64 119.13 3h3w s THR 405 Ca 0.41 -0.92 -0.17 0.00 -1.21 0.00 0.00 61.69 59.80 3h3w s THR 405 Cb -0.11 -1.93 -0.01 0.00 -1.51 0.00 0.00 72.50 68.93 3h3w s THR 405 CO 0.28 0.57 1.15 -2.84 -2.21 0.00 0.00 174.62 171.57 3h3w s PRO 406 N -0.38 2.83 -0.41 7.08 0.02 -1.26 -1.39 135.00 141.49 3h3w s PRO 406 Ca 0.03 1.58 0.06 0.00 0.02 0.00 0.00 61.00 62.69 3h3w s PRO 406 Cb -0.12 -1.94 0.21 0.00 0.02 0.00 0.00 34.50 32.67 3h3w s PRO 406 CO 0.02 -1.26 0.46 0.45 -0.33 0.00 0.00 177.00 176.34 3h3w n SER 407 N -2.09 -0.37 -4.57 2.53 2.88 -0.46 -4.82 113.62 106.71 3h3w n SER 407 Ca 0.12 -2.58 -0.40 0.00 -1.33 0.00 0.00 58.87 54.68 3h3w n SER 407 Cb 0.51 -0.42 -0.03 0.00 -0.75 0.00 0.00 64.21 63.52 3h3w n SER 407 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 3h3w s ILE 408 N -0.48 3.11 0.36 2.46 1.09 -1.26 -3.40 121.20 123.07 3h3w s ILE 408 Ca 0.34 0.09 0.08 0.00 -1.10 0.00 0.00 60.65 60.06 3h3w s ILE 408 Cb 0.11 -3.20 -0.04 0.00 -1.06 0.00 0.00 42.46 38.26 3h3w s ILE 408 CO -0.15 -0.17 0.17 0.27 -0.10 0.00 0.00 174.94 174.96 3h3w s ILE 409 N 9.88 2.83 0.21 2.92 -5.25 -0.71 -4.85 121.20 126.23 3h3w s ILE 409 Ca 0.93 -1.67 -0.14 0.00 -0.99 0.00 0.00 60.65 58.78 3h3w s ILE 409 Cb -0.23 -2.98 -0.08 0.00 2.95 0.00 0.00 42.46 42.13 3h3w s ILE 409 CO 0.29 -0.13 0.60 -0.44 -1.79 0.00 0.00 174.94 173.48 3h3w s SER 410 N -3.88 6.78 0.46 4.36 0.01 -1.26 -2.98 113.70 117.20 3h3w s SER 410 Ca 0.39 1.11 -0.25 0.00 1.31 0.00 0.00 55.95 58.51 3h3w s SER 410 Cb -0.01 -2.30 -0.08 0.00 0.21 0.00 0.00 66.02 63.84 3h3w s SER 410 CO 0.23 -0.01 1.40 -2.65 0.41 0.00 0.00 173.24 172.62 3h3w n PRO 411 N 0.30 2.12 -2.36 12.44 -0.02 -1.26 -4.84 135.00 141.38 3h3w n PRO 411 Ca -0.02 0.76 -0.40 0.00 -2.02 0.00 0.00 63.50 61.82 3h3w n PRO 411 Cb 0.52 -2.60 -0.03 0.00 -0.02 0.00 0.00 33.50 31.38 3h3w n PRO 411 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3h3w s ASN 412 N -0.55 5.86 0.09 2.55 3.84 0.22 -4.92 114.94 122.03 3h3w s ASN 412 Ca 0.63 -0.09 -0.28 0.00 0.21 0.00 0.00 52.86 53.33 3h3w s ASN 412 Cb -0.45 -2.55 -0.06 0.00 -0.55 0.00 0.00 41.25 37.64 3h3w s ASN 412 CO 0.56 -2.00 0.87 -0.31 -2.79 0.00 0.00 177.10 173.43 3h3w s TYR 413 N 6.88 3.80 -0.22 0.43 1.51 -1.26 -1.99 117.35 126.49 3h3w s TYR 413 Ca 0.48 1.66 -0.11 0.00 -1.01 0.00 0.00 57.07 58.09 3h3w s TYR 413 Cb -0.10 -2.93 -0.05 0.00 -0.11 0.00 0.00 41.96 38.77 3h3w s TYR 413 CO 0.18 0.27 0.16 -1.17 -1.11 0.00 0.00 175.55 173.88 3h3w s LEU 414 N -0.16 4.16 0.17 -1.29 0.20 -0.43 -4.51 118.68 116.83 3h3w s LEU 414 Ca 0.42 0.20 0.06 0.00 0.69 0.00 0.00 54.13 55.50 3h3w s LEU 414 Cb -0.22 -2.13 -0.04 0.00 -0.43 0.00 0.00 46.19 43.37 3h3w s LEU 414 CO 0.27 0.11 0.08 -0.36 -0.29 0.00 0.00 176.35 176.15 3h3w s PHE 415 N 0.76 3.02 -0.46 5.38 0.08 0.80 -3.07 117.98 124.48 3h3w s PHE 415 Ca 0.09 -0.07 -0.00 0.00 0.12 0.00 0.00 56.93 57.07 3h3w s PHE 415 Cb -0.13 -1.45 0.12 0.00 -0.57 0.00 0.00 43.02 41.00 3h3w s PHE 415 CO 0.02 0.52 0.23 0.42 -0.10 0.00 0.00 175.22 176.31 3h3w s ILE 416 N -1.76 3.01 -0.71 0.64 -1.09 -1.26 0.67 121.20 120.70 3h3w s ILE 416 Ca 0.30 -2.54 -0.26 0.00 -2.23 0.00 0.00 60.65 55.92 3h3w s ILE 416 Cb -0.10 -3.08 -0.03 0.00 -1.58 0.00 0.00 42.46 37.68 3h3w s ILE 416 CO 0.21 -0.73 1.89 -0.75 -1.23 0.00 0.00 174.94 174.33 3h3w s LYS 417 N 0.58 2.61 -0.19 2.79 2.36 0.44 -4.72 119.74 123.61 3h3w s LYS 417 Ca 0.12 0.29 -0.15 0.00 -2.55 0.00 0.00 55.97 53.68 3h3w s LYS 417 Cb -0.22 -4.62 -0.04 0.00 -1.05 0.00 0.00 37.83 31.90 3h3w s LYS 417 CO -0.04 -2.95 0.36 0.99 1.55 0.00 0.00 175.35 175.26 3h3w s THR 418 N 9.39 5.23 -1.04 3.43 2.01 -1.25 -2.16 115.64 131.24 3h3w s THR 418 Ca 0.68 0.64 -0.06 0.00 0.31 0.00 0.00 61.69 63.27 3h3w s THR 418 Cb -0.10 -3.70 0.27 0.00 0.01 0.00 0.00 72.50 68.98 3h3w s THR 418 CO 0.13 0.29 1.10 0.59 -0.69 0.00 0.00 174.62 176.04 3h3w n ASN 419 N 4.25 5.32 -4.77 3.53 3.02 -0.53 -1.95 115.26 124.13 3h3w n ASN 419 Ca -0.09 -3.15 -0.37 0.00 -0.03 0.00 0.00 54.58 50.93 3h3w n ASN 419 Cb 0.51 -1.25 0.00 0.00 -0.61 0.00 0.00 39.78 38.44 3h3w n ASN 419 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3h3w s LEU 420 N -1.67 3.94 -0.41 3.41 2.96 0.55 -3.40 118.68 124.06 3h3w s LEU 420 Ca 0.31 2.38 0.08 0.00 -0.22 0.00 0.00 54.13 56.68 3h3w s LEU 420 Cb -0.05 -4.30 0.27 0.00 0.50 0.00 0.00 46.19 42.61 3h3w s LEU 420 CO -0.05 -1.10 0.66 0.29 -1.32 0.00 0.00 176.35 174.82 3h3w n LYS 421 N -0.72 0.79 -2.09 1.98 4.76 -0.87 -1.86 118.16 120.15 3h3w n LYS 421 Ca 0.09 -2.94 -0.38 0.00 -2.87 0.00 0.00 58.31 52.21 3h3w n LYS 421 Cb 0.48 -1.34 0.00 0.00 -1.84 0.00 0.00 35.03 32.33 3h3w n LYS 421 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3h3w s VAL 422 N -1.05 2.74 -0.01 -0.18 1.01 -1.19 -2.72 120.40 119.00 3h3w s VAL 422 Ca 0.35 0.58 0.03 0.00 0.00 0.00 0.00 61.98 62.94 3h3w s VAL 422 Cb 0.22 -3.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.29 3h3w s VAL 422 CO -0.12 0.02 -0.11 0.42 0.00 0.00 0.00 175.10 175.30 3h3w s THR 423 N -1.41 0.88 0.33 3.92 -4.23 -1.12 -2.38 115.64 111.62 3h3w s THR 423 Ca 0.64 -0.46 0.03 0.00 -1.18 0.00 0.00 61.69 60.72 3h3w s THR 423 Cb -0.34 -0.75 -0.04 0.00 1.34 0.00 0.00 72.50 72.72 3h3w s THR 423 CO 0.41 0.25 0.13 -0.72 -0.54 0.00 0.00 174.62 174.16 3h3w s TYR 424 N -0.17 1.71 -0.24 3.99 1.13 -0.31 -1.08 117.35 122.38 3h3w s TYR 424 Ca 0.03 -1.26 -0.15 0.00 -1.41 0.00 0.00 57.07 54.27 3h3w s TYR 424 Cb -0.05 -1.02 -0.04 0.00 -1.10 0.00 0.00 41.96 39.75 3h3w s TYR 424 CO -0.00 -0.35 0.39 0.00 -2.51 0.00 0.00 175.55 173.08 3h3w s ALA 425 N -3.46 3.57 0.27 9.51 0.00 -1.25 -0.75 121.76 129.65 3h3w s ALA 425 Ca 0.33 -0.67 -0.05 0.00 0.00 0.00 0.00 51.96 51.56 3h3w s ALA 425 Cb 0.05 -2.68 0.52 0.00 0.00 0.00 0.00 23.12 21.02 3h3w s ALA 425 CO 0.16 -0.49 1.60 -0.07 0.00 0.00 0.00 175.76 176.96 3h3w h LEU 426 N 8.17 -0.52 0.01 0.00 3.38 -0.82 -2.29 115.31 123.24 3h3w h LEU 426 Ca -0.33 0.24 -0.24 0.00 0.09 0.00 0.00 57.88 57.64 3h3w h LEU 426 Cb 1.16 0.44 0.02 0.00 0.09 0.00 0.00 40.66 42.37 3h3w h LEU 426 CO 0.68 -0.26 -0.94 -0.55 0.09 0.00 0.00 178.44 177.46 3h3w h ASN 427 N 0.05 0.82 0.07 -0.43 7.08 -1.94 -3.20 115.58 118.03 3h3w h ASN 427 Ca 0.47 -0.75 0.00 0.00 -3.08 0.00 0.00 56.30 52.95 3h3w h ASN 427 Cb 0.86 -0.25 0.00 0.00 -2.08 0.00 0.00 38.32 36.85 3h3w h ASN 427 CO -0.81 1.46 0.00 0.11 -2.08 0.00 0.00 177.43 176.11 3h3w h LYS 428 N 0.26 0.00 -5.51 4.14 1.79 -1.72 -3.41 116.57 112.12 3h3w h LYS 428 Ca -0.12 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 57.75 3h3w h LYS 428 Cb 1.61 0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 32.16 3h3w h LYS 428 CO 0.19 0.00 -0.16 -1.17 -1.08 0.00 0.00 179.45 177.22 3h3w s LEU 429 N -4.59 4.18 -0.20 2.94 0.20 -1.17 -4.76 118.68 115.28 3h3w s LEU 429 Ca -0.02 0.60 0.12 0.00 0.69 0.00 0.00 54.13 55.53 3h3w s LEU 429 Cb 0.07 -2.58 -0.21 0.00 -0.43 0.00 0.00 46.19 43.04 3h3w s LEU 429 CO 0.23 -0.07 -0.02 0.00 -0.29 0.00 0.00 176.35 176.20 3h3w n GLN 430 N 4.34 0.87 -3.29 1.98 1.13 -1.26 -5.01 117.38 116.13 3h3w n GLN 430 Ca -0.08 0.03 -0.20 0.00 -1.94 0.00 0.00 57.00 54.81 3h3w n GLN 430 Cb 0.51 -1.48 0.02 0.00 0.11 0.00 0.00 30.24 29.40 3h3w n GLN 430 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3h3w s GLU 431 N -2.46 2.47 1.04 -1.09 8.01 -1.26 -5.11 118.70 120.30 3h3w s GLU 431 Ca -0.16 -1.60 -0.13 0.00 0.01 0.00 0.00 54.97 53.10 3h3w s GLU 431 Cb 0.06 -2.52 0.21 0.00 -4.31 0.00 0.00 34.13 27.58 3h3w s GLU 431 CO 0.70 -0.54 1.08 0.45 0.01 0.00 0.00 175.26 176.95 3h3w s SER 432 N -4.41 2.20 0.33 -0.19 0.15 -1.26 -4.84 113.70 105.69 3h3w s SER 432 Ca 0.52 1.24 0.03 0.00 0.70 0.00 0.00 55.95 58.44 3h3w s SER 432 Cb -0.06 -1.93 0.62 0.00 -1.71 0.00 0.00 66.02 62.94 3h3w s SER 432 CO 0.32 -3.40 1.95 -0.33 1.20 0.00 0.00 173.24 172.98 3h3w h GLU 433 N -2.08 0.88 -0.57 5.44 5.08 -1.99 -0.49 114.58 120.85 3h3w h GLU 433 Ca -0.56 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 57.74 3h3w h GLU 433 Cb 1.33 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 30.36 3h3w h GLU 433 CO 0.56 0.58 0.35 0.37 -1.00 0.00 0.00 179.01 179.88 3h3w h GLN 434 N 0.91 0.77 -0.03 2.33 5.75 -2.00 0.77 115.11 123.61 3h3w h GLN 434 Ca 0.32 -0.06 -0.15 0.00 -0.15 0.00 0.00 58.65 58.61 3h3w h GLN 434 Cb 0.13 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.50 3h3w h GLN 434 CO -0.10 0.55 -0.65 2.35 -2.65 0.00 0.00 178.83 178.32 3h3w h TRP 435 N 0.77 0.16 -0.09 3.99 7.01 -1.80 -2.84 115.95 123.16 3h3w h TRP 435 Ca 0.21 -0.07 -0.02 0.00 2.11 0.00 0.00 58.89 61.12 3h3w h TRP 435 Cb -0.03 -0.03 -0.00 0.00 -2.10 0.00 0.00 29.16 27.00 3h3w h TRP 435 CO -0.03 0.74 -0.02 1.25 -2.79 0.00 0.00 178.44 177.59 3h3w h LEU 436 N 0.09 0.18 -0.16 0.65 6.46 -0.63 -2.89 115.31 119.01 3h3w h LEU 436 Ca -0.01 -0.37 0.05 0.00 -0.12 0.00 0.00 57.88 57.43 3h3w h LEU 436 Cb 1.16 -0.05 -0.05 0.00 -0.73 0.00 0.00 40.66 40.99 3h3w h LEU 436 CO 0.09 0.51 -0.18 -0.33 -0.62 0.00 0.00 178.44 177.91 3h3w h GLU 437 N -0.15 -0.21 0.00 1.25 5.08 -0.87 0.44 114.58 120.13 3h3w h GLU 437 Ca 0.02 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3h3w h GLU 437 Cb 0.43 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.72 3h3w h GLU 437 CO 0.01 -0.14 0.00 0.41 -1.00 0.00 0.00 179.01 178.29 3h3w n GLY 438 N -1.33 -0.03 0.05 -3.84 0.00 -1.07 -1.47 105.19 97.49 3h3w n GLY 438 Ca -0.02 -0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 3h3w n GLY 438 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3h3w n GLN 439 N -0.75 1.19 -0.01 1.61 -0.06 0.14 -4.15 117.38 115.35 3h3w n GLN 439 Ca 0.00 0.03 -0.17 0.00 -2.00 0.00 0.00 57.00 54.87 3h3w n GLN 439 Cb 0.00 -1.20 -0.10 0.00 -4.06 0.00 0.00 30.24 24.88 3h3w n GLN 439 CO 0.00 0.00 0.00 -0.84 -0.20 0.00 0.00 177.06 176.02 3h3w h ILE 440 N 0.00 1.44 0.00 1.69 3.07 -0.05 -3.15 117.51 120.51 3h3w h ILE 440 Ca -0.22 -1.98 0.00 0.00 1.55 0.00 0.00 64.86 64.21 3h3w h ILE 440 Cb 1.39 2.53 0.00 0.00 -0.27 0.00 0.00 36.82 40.47 3h3w h ILE 440 CO -0.02 0.57 0.00 -0.29 -1.05 0.00 0.00 178.15 177.37 3h3w h ILE 441 N -0.13 0.00 0.00 0.16 2.10 -1.58 0.36 117.51 118.42 3h3w h ILE 441 Ca -0.06 -0.32 -0.07 0.00 1.08 0.00 0.00 64.86 65.50 3h3w h ILE 441 Cb 1.20 1.30 -0.01 0.00 -1.09 0.00 0.00 36.82 38.22 3h3w h ILE 441 CO 0.10 0.00 -0.32 0.44 -1.08 0.00 0.00 178.15 177.29 3h3w h ASP 442 N 0.00 0.00 0.00 2.19 3.32 -1.71 -1.98 116.42 118.25 3h3w h ASP 442 Ca 0.00 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 3h3w h ASP 442 Cb 0.32 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 3h3w h ASP 442 CO 0.00 0.32 -0.49 0.11 -1.72 0.00 0.00 179.24 177.46 3h3w h LYS 443 N 0.00 0.00 -1.44 3.56 1.79 -0.42 -2.80 116.57 117.26 3h3w h LYS 443 Ca -0.00 0.00 0.43 0.00 -2.18 0.00 0.00 60.65 58.90 3h3w h LYS 443 Cb 0.60 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.16 3h3w h LYS 443 CO 0.04 0.53 1.00 0.82 -1.08 0.00 0.00 179.45 180.76 3h3w h ILE 444 N -1.00 0.22 -0.05 1.86 2.04 -0.75 0.81 117.51 120.64 3h3w h ILE 444 Ca -0.10 -0.02 -0.12 0.00 1.00 0.00 0.00 64.86 65.61 3h3w h ILE 444 Cb 0.74 0.14 0.01 0.00 -0.74 0.00 0.00 36.82 36.97 3h3w h ILE 444 CO -0.06 0.01 -0.45 -0.78 0.00 0.00 0.00 178.15 176.87 3h3w h ASP 445 N 0.07 0.48 -0.87 1.72 1.82 -1.44 -3.07 116.42 115.13 3h3w h ASP 445 Ca 0.75 -0.69 0.10 0.00 -0.39 0.00 0.00 57.03 56.80 3h3w h ASP 445 Cb 2.71 -0.14 -0.08 0.00 0.68 0.00 0.00 39.33 42.50 3h3w h ASP 445 CO -0.16 1.10 0.51 -0.09 -1.61 0.00 0.00 179.24 178.98 3h3w h ARG 446 N -0.10 0.81 0.12 0.28 1.12 0.79 -0.81 114.38 116.59 3h3w h ARG 446 Ca -0.04 -0.05 -0.01 0.00 -1.11 0.00 0.00 59.98 58.77 3h3w h ARG 446 Cb 1.12 -0.18 0.00 0.00 -0.01 0.00 0.00 29.97 30.90 3h3w h ARG 446 CO 0.09 0.54 -0.06 -0.92 -3.11 0.00 0.00 179.97 176.51 3h3w h TYR 447 N 0.83 -0.15 -0.44 2.20 3.20 -0.95 -2.89 116.97 118.77 3h3w h TYR 447 Ca 0.42 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.33 3h3w h TYR 447 Cb 0.40 0.05 -0.05 0.00 1.54 0.00 0.00 36.73 38.66 3h3w h TYR 447 CO -0.05 -0.09 -0.26 0.66 -1.64 0.00 0.00 178.16 176.78 3h3w n TYR 448 N -2.45 -0.20 0.54 -3.82 4.01 -1.10 -1.08 117.16 113.06 3h3w n TYR 448 Ca -0.02 0.55 0.06 0.00 -0.16 0.00 0.00 57.90 58.33 3h3w n TYR 448 Cb 0.06 -0.49 0.29 0.00 -0.31 0.00 0.00 39.34 38.90 3h3w n TYR 448 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3h3w n THR 449 N -4.02 0.75 -0.09 -0.72 -2.24 -0.33 0.49 114.28 108.12 3h3w n THR 449 Ca 0.01 0.19 -0.13 0.00 -2.27 0.00 0.00 64.05 61.84 3h3w n THR 449 Cb 0.12 -0.99 -0.08 0.00 -2.10 0.00 0.00 70.33 67.27 3h3w n THR 449 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3h3w n GLU 450 N -1.31 0.44 -0.06 -0.78 1.02 -0.24 -4.73 120.64 114.97 3h3w n GLU 450 Ca 0.05 0.11 -0.08 0.00 -0.02 0.00 0.00 57.16 57.23 3h3w n GLU 450 Cb 0.10 -1.33 -0.07 0.00 -0.02 0.00 0.00 31.44 30.12 3h3w n GLU 450 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3h3w n ASP 451 N -3.13 2.81 -0.10 1.62 8.00 -0.26 -4.85 116.55 120.64 3h3w n ASP 451 Ca -0.32 -0.05 -0.15 0.00 0.71 0.00 0.00 54.79 54.97 3h3w n ASP 451 Cb 0.83 0.09 -0.14 0.00 -0.02 0.00 0.00 41.12 41.88 3h3w n ASP 451 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3h3w n VAL 452 N -2.73 1.50 -1.92 2.53 0.31 0.86 -4.44 118.33 114.44 3h3w n VAL 452 Ca -0.21 -0.69 -0.42 0.00 -0.01 0.00 0.00 64.34 63.01 3h3w n VAL 452 Cb 0.78 -1.13 0.00 0.00 -0.91 0.00 0.00 33.84 32.58 3h3w n VAL 452 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3h3w n GLU 453 N -3.11 2.95 -3.81 5.55 1.02 0.18 -4.46 120.64 118.96 3h3w n GLU 453 Ca -0.38 -2.77 -0.09 0.00 -0.02 0.00 0.00 57.16 53.89 3h3w n GLU 453 Cb 1.05 -3.31 -0.06 0.00 -0.02 0.00 0.00 31.44 29.10 3h3w n GLU 453 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3h3w s ILE 454 N 3.22 0.11 0.22 -3.67 1.01 -1.26 -4.92 121.20 115.92 3h3w s ILE 454 Ca 0.48 -1.04 -0.30 0.00 0.00 0.00 0.00 60.65 59.79 3h3w s ILE 454 Cb 0.12 -1.36 -0.09 0.00 0.01 0.00 0.00 42.46 41.14 3h3w s ILE 454 CO -0.06 -0.51 1.08 -0.36 0.00 0.00 0.00 174.94 175.09 3h3w s PHE 455 N -3.86 3.64 -0.89 3.97 0.08 -1.26 -3.53 117.98 116.13 3h3w s PHE 455 Ca 0.06 1.68 -0.06 0.00 0.12 0.00 0.00 56.93 58.73 3h3w s PHE 455 Cb 0.04 -3.24 0.00 0.00 -0.57 0.00 0.00 43.02 39.26 3h3w s PHE 455 CO -0.10 -0.43 0.65 0.09 -0.10 0.00 0.00 175.22 175.33 3h3w n ASN 456 N 1.81 -5.32 -4.00 1.36 3.02 -1.25 -4.97 115.26 105.91 3h3w n ASN 456 Ca 0.01 -0.86 -0.10 0.00 -0.03 0.00 0.00 54.58 53.59 3h3w n ASN 456 Cb 0.46 -2.47 -0.07 0.00 -0.61 0.00 0.00 39.78 37.09 3h3w n ASN 456 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3h3w s SER 457 N -3.11 0.07 0.21 6.41 0.15 -1.23 -4.97 113.70 111.24 3h3w s SER 457 Ca 0.11 -1.12 -0.04 0.00 0.70 0.00 0.00 55.95 55.60 3h3w s SER 457 Cb -0.05 0.53 -0.03 0.00 -1.71 0.00 0.00 66.02 64.76 3h3w s SER 457 CO 0.88 -1.06 0.23 -0.94 1.20 0.00 0.00 173.24 173.54 3h3w s SER 458 N -3.08 0.09 0.02 5.45 1.04 -1.26 -1.96 113.70 114.00 3h3w s SER 458 Ca 0.28 -1.26 0.07 0.00 0.48 0.00 0.00 55.95 55.51 3h3w s SER 458 Cb 0.02 0.44 -0.02 0.00 0.10 0.00 0.00 66.02 66.55 3h3w s SER 458 CO 0.11 -0.92 -0.20 0.12 0.98 0.00 0.00 173.24 173.33 3h3w s PHE 459 N -4.12 1.73 -0.06 5.02 5.36 -0.00 -4.28 117.98 121.62 3h3w s PHE 459 Ca 0.34 -0.36 -0.01 0.00 -0.96 0.00 0.00 56.93 55.95 3h3w s PHE 459 Cb 0.05 -1.05 0.03 0.00 -0.34 0.00 0.00 43.02 41.70 3h3w s PHE 459 CO 0.11 0.05 -0.01 0.00 -1.46 0.00 0.00 175.22 173.91 3h3w s ALA 460 N -0.69 0.69 0.19 11.12 0.00 -1.26 -0.05 121.76 131.76 3h3w s ALA 460 Ca 0.07 -0.11 -0.12 0.00 0.00 0.00 0.00 51.96 51.80 3h3w s ALA 460 Cb -0.08 -0.65 0.19 0.00 0.00 0.00 0.00 23.12 22.57 3h3w s ALA 460 CO 0.01 -0.34 1.74 -0.22 0.00 0.00 0.00 175.76 176.95 3h3w h LYS 461 N 8.01 0.33 -0.54 0.00 3.64 -1.95 -1.38 116.57 124.69 3h3w h LYS 461 Ca -0.25 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.18 3h3w h LYS 461 Cb 1.13 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.84 3h3w h LYS 461 CO 0.32 0.22 0.36 0.66 -2.27 0.00 0.00 179.45 178.75 3h3w h SER 462 N 0.34 0.39 0.77 4.20 4.64 -1.97 -1.47 113.55 120.46 3h3w h SER 462 Ca 0.25 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.37 3h3w h SER 462 Cb 0.28 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.27 3h3w h SER 462 CO -0.26 0.25 -0.92 0.50 -0.87 0.00 0.00 176.83 175.53 3h3w h LYS 463 N 0.44 0.09 0.21 4.77 3.64 -1.65 -2.78 116.57 121.29 3h3w h LYS 463 Ca 0.24 -0.11 -0.33 0.00 -1.27 0.00 0.00 60.65 59.18 3h3w h LYS 463 Cb 0.38 0.04 0.02 0.00 -0.41 0.00 0.00 32.23 32.26 3h3w h LYS 463 CO -0.06 0.94 -1.49 0.00 -2.27 0.00 0.00 179.45 176.57 3h3w h MET 464 N 0.04 0.45 0.00 1.90 -0.00 -0.98 -3.08 114.93 113.26 3h3w h MET 464 Ca -0.03 -0.77 0.00 0.00 -0.00 0.00 0.00 59.70 58.90 3h3w h MET 464 Cb 1.60 0.28 0.00 0.00 -0.00 0.00 0.00 31.60 33.48 3h3w h MET 464 CO 0.13 1.36 0.00 -0.07 -0.00 0.00 0.00 176.91 178.33 3h3w h LEU 465 N 0.12 0.00 -0.10 -0.10 3.38 -1.31 0.25 115.31 117.54 3h3w h LEU 465 Ca -0.25 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.69 3h3w h LEU 465 Cb 2.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.86 3h3w h LEU 465 CO 0.24 0.00 -0.05 0.71 0.09 0.00 0.00 178.44 179.43 3h3w h THR 466 N 0.00 1.32 -0.94 0.22 1.35 -1.40 -2.24 112.91 111.22 3h3w h THR 466 Ca 0.00 -1.07 0.05 0.00 -0.55 0.00 0.00 66.41 64.84 3h3w h THR 466 Cb 0.12 1.83 -0.06 0.00 -1.73 0.00 0.00 68.15 68.31 3h3w h THR 466 CO 0.00 0.30 0.61 1.88 -0.25 0.00 0.00 175.52 178.06 3h3w h TYR 467 N -0.16 1.14 0.19 4.73 0.05 -0.62 -2.36 116.97 119.93 3h3w h TYR 467 Ca 0.02 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.82 3h3w h TYR 467 Cb 0.50 -0.37 0.00 0.00 1.01 0.00 0.00 36.73 37.87 3h3w h TYR 467 CO 0.07 0.62 -0.09 0.28 -1.05 0.00 0.00 178.16 177.99 3h3w h VAL 468 N 1.15 0.83 -0.54 -2.88 2.07 -0.93 -2.38 116.25 113.57 3h3w h VAL 468 Ca 0.39 -0.07 0.16 0.00 0.82 0.00 0.00 66.70 68.00 3h3w h VAL 468 Cb 0.08 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 3h3w h VAL 468 CO -0.15 0.02 0.51 0.44 0.02 0.00 0.00 177.57 178.41 3h3w h ASP 469 N -0.29 0.00 -1.62 0.57 5.19 -1.02 -3.07 116.42 116.18 3h3w h ASP 469 Ca -0.03 0.00 -0.68 0.00 -0.62 0.00 0.00 57.03 55.71 3h3w h ASP 469 Cb 0.22 0.00 -0.22 0.00 0.18 0.00 0.00 39.33 39.51 3h3w h ASP 469 CO 0.04 0.00 0.97 -0.67 -3.12 0.00 0.00 179.24 176.46 3h3w n ASP 470 N -3.85 7.20 0.00 6.45 4.64 -0.89 -4.26 116.55 125.83 3h3w n ASP 470 Ca 0.10 -3.52 0.00 0.00 -1.38 0.00 0.00 54.79 49.99 3h3w n ASP 470 Cb 0.73 -1.17 0.00 0.00 -1.04 0.00 0.00 41.12 39.63 3h3w n ASP 470 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3h3w n ALA 471 N 0.26 1.51 -3.82 -1.67 0.00 -1.16 -4.99 120.51 110.64 3h3w n ALA 471 Ca 0.52 -0.43 -0.03 0.00 0.00 0.00 0.00 53.44 53.50 3h3w n ALA 471 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.80 3h3w n ALA 471 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3h3w s ASP 472 N -0.16 -0.07 0.00 0.00 2.15 -1.26 -4.93 116.67 112.40 3h3w s ASP 472 Ca 0.00 -0.58 0.28 0.00 0.43 0.00 0.00 52.55 52.68 3h3w s ASP 472 Cb 0.00 0.51 1.38 0.00 -0.30 0.00 0.00 42.92 44.51 3h3w s ASP 472 CO 0.00 -0.98 1.96 1.57 -0.17 0.00 0.00 175.17 177.55 3h3w n HIS 473 N -0.59 0.00 0.00 -5.34 -0.00 -1.26 -4.82 115.22 103.21 3h3w n HIS 473 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.67 3h3w n HIS 473 Cb 0.60 -0.32 0.00 0.00 -0.00 0.00 0.00 29.99 30.27 3h3w n HIS 473 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 3h3w n SER 474 N -1.32 0.00 -3.17 0.26 2.88 -1.26 -4.89 113.62 106.11 3h3w n SER 474 Ca 0.12 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.45 3h3w n SER 474 Cb 0.24 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.72 3h3w n SER 474 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 3h3w n VAL 475 N 0.00 -7.22 -0.05 2.46 0.31 -1.26 -3.89 118.33 108.67 3h3w n VAL 475 Ca 0.00 0.56 -0.09 0.00 -0.01 0.00 0.00 64.34 64.79 3h3w n VAL 475 Cb 0.00 -5.25 -0.08 0.00 -0.91 0.00 0.00 33.84 27.60 3h3w n VAL 475 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 3h3w h ILE 476 N 2.23 1.14 -1.31 2.52 2.04 -1.43 -3.47 117.51 119.22 3h3w h ILE 476 Ca -0.26 -1.81 0.00 0.00 1.00 0.00 0.00 64.86 63.79 3h3w h ILE 476 Cb 1.13 2.13 0.00 0.00 -0.74 0.00 0.00 36.82 39.34 3h3w h ILE 476 CO 0.19 0.38 0.00 0.61 0.00 0.00 0.00 178.15 179.33 3h3w n GLY 477 N 1.57 3.40 3.59 5.37 0.00 -1.19 -5.06 105.19 112.88 3h3w n GLY 477 Ca -0.07 -1.05 -0.10 0.00 0.00 0.00 0.00 46.02 44.80 3h3w n GLY 477 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h3w s SER 478 N 0.84 -0.37 0.39 1.61 1.04 -1.26 -2.81 113.70 113.14 3h3w s SER 478 Ca 0.00 0.49 0.06 0.00 0.48 0.00 0.00 55.95 56.99 3h3w s SER 478 Cb 0.00 0.42 -0.07 0.00 0.10 0.00 0.00 66.02 66.47 3h3w s SER 478 CO 0.00 -0.28 0.02 -0.44 0.98 0.00 0.00 173.24 173.52 3h3w s SER 479 N -0.77 3.54 0.05 7.02 0.01 -1.10 -4.97 113.70 117.49 3h3w s SER 479 Ca -0.00 -1.38 -0.27 0.00 1.31 0.00 0.00 55.95 55.61 3h3w s SER 479 Cb -0.02 -0.29 0.09 0.00 0.21 0.00 0.00 66.02 66.01 3h3w s SER 479 CO -0.01 -0.50 0.76 0.00 0.41 0.00 0.00 173.24 173.90 3h3w s ALA 480 N -2.85 -1.73 -0.26 1.44 0.00 -1.26 -2.05 121.76 115.05 3h3w s ALA 480 Ca 0.34 0.85 -0.01 0.00 0.00 0.00 0.00 51.96 53.14 3h3w s ALA 480 Cb 0.09 0.52 0.14 0.00 0.00 0.00 0.00 23.12 23.87 3h3w s ALA 480 CO 0.17 -0.68 0.35 0.99 0.00 0.00 0.00 175.76 176.59 3h3w s THR 481 N -3.14 -0.55 0.22 0.00 2.01 -1.22 -4.94 115.64 108.03 3h3w s THR 481 Ca 0.02 -0.19 0.10 0.00 0.31 0.00 0.00 61.69 61.92 3h3w s THR 481 Cb -0.01 -0.87 -0.04 0.00 0.01 0.00 0.00 72.50 71.59 3h3w s THR 481 CO -0.09 -0.22 -0.08 0.27 -0.69 0.00 0.00 174.62 173.81 3h3w s ILE 482 N 2.49 3.16 0.05 1.82 -4.36 -1.26 -1.45 121.20 121.65 3h3w s ILE 482 Ca 0.11 -1.85 0.02 0.00 -0.26 0.00 0.00 60.65 58.67 3h3w s ILE 482 Cb -0.15 -2.62 -0.03 0.00 1.25 0.00 0.00 42.46 40.92 3h3w s ILE 482 CO -0.21 -0.23 -0.08 -1.10 0.24 0.00 0.00 174.94 173.56 3h3w s GLN 483 N -3.18 0.56 0.18 0.37 -0.21 -0.92 -4.67 119.66 111.79 3h3w s GLN 483 Ca 0.27 -0.82 -0.23 0.00 0.02 0.00 0.00 55.36 54.60 3h3w s GLN 483 Cb -0.08 -0.29 -0.08 0.00 1.00 0.00 0.00 33.01 33.57 3h3w s GLN 483 CO 0.16 0.04 0.75 -1.64 -2.12 0.00 0.00 175.29 172.49 3h3w s MET 484 N -1.82 4.45 -0.07 2.91 -1.94 0.10 -0.42 119.30 122.51 3h3w s MET 484 Ca -0.08 1.05 0.05 0.00 -1.71 0.00 0.00 55.69 55.00 3h3w s MET 484 Cb -0.08 -3.12 -0.00 0.00 2.01 0.00 0.00 34.83 33.63 3h3w s MET 484 CO -0.00 0.51 -0.21 0.08 -0.01 0.00 0.00 175.02 175.39 3h3w s VAL 485 N -1.28 1.78 -0.17 -6.03 1.01 0.21 -2.10 120.40 113.82 3h3w s VAL 485 Ca 0.38 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.48 3h3w s VAL 485 Cb -0.21 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.65 3h3w s VAL 485 CO 0.24 0.50 -0.16 -0.60 0.00 0.00 0.00 175.10 175.08 3h3w s ARG 486 N 0.14 3.15 -0.05 2.72 6.06 -0.75 -0.14 118.95 130.08 3h3w s ARG 486 Ca -0.10 -0.77 -0.27 0.00 -2.50 0.00 0.00 55.73 52.10 3h3w s ARG 486 Cb -0.15 -2.63 -0.03 0.00 0.06 0.00 0.00 34.95 32.21 3h3w s ARG 486 CO 0.05 -0.06 0.84 -1.21 -2.50 0.00 0.00 175.30 172.42 3h3w s GLU 487 N 0.99 4.47 -0.31 5.12 2.02 -1.26 -1.42 118.70 128.32 3h3w s GLU 487 Ca -0.02 1.14 -0.05 0.00 0.02 0.00 0.00 54.97 56.06 3h3w s GLU 487 Cb -0.15 -3.47 0.03 0.00 0.10 0.00 0.00 34.13 30.65 3h3w s GLU 487 CO -0.04 -0.04 0.05 0.08 0.02 0.00 0.00 175.26 175.33 3h3w s VAL 488 N 1.07 3.48 0.52 2.63 1.01 0.38 -4.99 120.40 124.50 3h3w s VAL 488 Ca 0.44 -1.10 -0.17 0.00 0.00 0.00 0.00 61.98 61.15 3h3w s VAL 488 Cb -0.19 -2.92 -0.07 0.00 0.00 0.00 0.00 36.38 33.20 3h3w s VAL 488 CO 0.22 -0.06 1.00 0.00 0.00 0.00 0.00 175.10 176.26 3h3w s GLN 489 N 1.37 3.82 -0.09 2.72 0.00 -1.26 -0.70 119.66 125.52 3h3w s GLN 489 Ca -0.02 1.07 -0.03 0.00 -0.00 0.00 0.00 55.36 56.39 3h3w s GLN 489 Cb -0.19 -2.11 0.00 0.00 0.00 0.00 0.00 33.01 30.71 3h3w s GLN 489 CO 0.01 -0.38 0.05 -1.71 0.00 0.00 0.00 175.29 173.25 3h3w n ASN 490 N -1.51 -6.81 0.31 12.60 5.15 -0.97 -4.84 115.26 119.20 3h3w n ASN 490 Ca 0.07 0.57 0.18 0.00 -0.60 0.00 0.00 54.58 54.81 3h3w n ASN 490 Cb 0.54 -2.37 1.03 0.00 -0.53 0.00 0.00 39.78 38.45 3h3w n ASN 490 CO 0.00 0.00 0.00 2.19 1.40 0.00 0.00 177.26 180.85 3h3w h PHE 491 N 3.38 0.00 -0.60 1.20 -0.00 -1.05 -3.21 116.94 116.65 3h3w h PHE 491 Ca -0.03 0.00 0.03 0.00 -0.00 0.00 0.00 57.97 57.97 3h3w h PHE 491 Cb 0.83 0.00 -0.04 0.00 -0.00 0.00 0.00 35.95 36.74 3h3w h PHE 491 CO 0.00 0.00 0.36 -0.92 -0.00 0.00 0.00 178.31 177.75 3h3w h TYR 492 N 0.00 0.66 -2.35 6.09 3.20 -1.88 -3.44 116.97 119.24 3h3w h TYR 492 Ca -0.00 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.81 3h3w h TYR 492 Cb 0.02 -0.21 -0.21 0.00 1.54 0.00 0.00 36.73 37.86 3h3w h TYR 492 CO 0.00 0.36 -0.01 -1.59 -1.64 0.00 0.00 178.16 175.28 3h3w s LYS 493 N -6.12 0.78 1.07 1.82 -2.85 -1.21 -1.39 119.74 111.83 3h3w s LYS 493 Ca -0.13 0.50 -0.13 0.00 -1.00 0.00 0.00 55.97 55.22 3h3w s LYS 493 Cb 0.14 0.37 0.23 0.00 -2.06 0.00 0.00 37.83 36.51 3h3w s LYS 493 CO 0.75 -0.16 1.07 0.95 0.10 0.00 0.00 175.35 178.06 3h3w s THR 494 N -0.35 2.00 1.05 3.79 -4.23 -0.69 -4.88 115.64 112.33 3h3w s THR 494 Ca -0.05 0.00 -0.12 0.00 -1.18 0.00 0.00 61.69 60.34 3h3w s THR 494 Cb -0.03 -2.35 0.22 0.00 1.34 0.00 0.00 72.50 71.68 3h3w s THR 494 CO 0.04 -0.00 1.08 -2.84 -0.54 0.00 0.00 174.62 172.35 3h3w s PRO 495 N -4.80 -0.06 0.28 3.99 0.02 -1.26 -4.86 135.00 128.32 3h3w s PRO 495 Ca 0.67 1.13 -0.06 0.00 0.02 0.00 0.00 61.00 62.76 3h3w s PRO 495 Cb -0.21 -1.63 0.51 0.00 0.02 0.00 0.00 34.50 33.19 3h3w s PRO 495 CO 0.60 -3.23 1.56 1.05 -0.33 0.00 0.00 177.00 176.65 3h3w h GLU 496 N -2.28 0.00 -0.66 5.54 9.09 -1.98 -2.05 114.58 122.23 3h3w h GLU 496 Ca -0.54 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.87 3h3w h GLU 496 Cb 1.30 -0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.40 3h3w h GLU 496 CO 0.47 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.53 3h3w n ALA 497 N -3.52 3.09 -0.30 1.06 0.00 -1.26 -5.06 120.51 114.51 3h3w n ALA 497 Ca 0.17 -1.53 0.04 0.00 0.00 0.00 0.00 53.44 52.12 3h3w n ALA 497 Cb 0.55 -1.03 -0.02 0.00 0.00 0.00 0.00 19.45 18.95 3h3w n ALA 497 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h3w n GLY 498 N 1.13 -2.27 3.62 0.00 0.00 -0.77 -4.87 105.19 102.03 3h3w n GLY 498 Ca 0.25 -1.40 -0.32 0.00 0.00 0.00 0.00 46.02 44.55 3h3w n GLY 498 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3h3w s ILE 499 N -2.53 3.80 0.32 -0.61 -4.36 -0.39 -4.64 121.20 112.78 3h3w s ILE 499 Ca 0.00 -0.73 0.08 0.00 -0.26 0.00 0.00 60.65 59.74 3h3w s ILE 499 Cb 0.00 -2.67 -0.06 0.00 1.25 0.00 0.00 42.46 40.98 3h3w s ILE 499 CO 0.00 0.38 -0.06 -1.59 0.24 0.00 0.00 174.94 173.91 3h3w s LYS 500 N -1.48 1.69 -0.02 0.37 -2.85 -1.26 -0.84 119.74 115.36 3h3w s LYS 500 Ca 0.18 -1.88 0.19 0.00 -1.00 0.00 0.00 55.97 53.46 3h3w s LYS 500 Cb -0.11 -1.39 -0.27 0.00 -2.06 0.00 0.00 37.83 34.00 3h3w s LYS 500 CO 0.08 0.06 0.55 0.66 0.10 0.00 0.00 175.35 176.81 3h3w n TYR 501 N -0.70 0.00 -1.46 1.78 4.01 -1.26 -4.95 117.16 114.58 3h3w n TYR 501 Ca -0.05 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.53 3h3w n TYR 501 Cb 0.64 -0.29 -0.07 0.00 -0.31 0.00 0.00 39.34 39.31 3h3w n TYR 501 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3h3w n ASN 502 N -1.92 -5.16 -3.87 7.72 4.13 -1.26 -4.90 115.26 110.00 3h3w n ASN 502 Ca -0.01 0.39 -0.09 0.00 1.68 0.00 0.00 54.58 56.55 3h3w n ASN 502 Cb 0.43 -4.06 -0.06 0.00 -1.54 0.00 0.00 39.78 34.55 3h3w n ASN 502 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 3h3w s ASN 503 N -2.73 -0.03 -0.16 6.41 0.01 -1.26 -4.41 114.94 112.76 3h3w s ASN 503 Ca 0.00 -0.72 -0.10 0.00 -0.71 0.00 0.00 52.86 51.33 3h3w s ASN 503 Cb 0.00 0.45 -0.05 0.00 0.41 0.00 0.00 41.25 42.06 3h3w s ASN 503 CO 0.00 -0.89 0.18 -1.58 -1.51 0.00 0.00 177.10 173.29 3h3w s GLN 504 N -3.92 4.01 0.51 -0.60 2.00 -1.26 -4.92 119.66 115.48 3h3w s GLN 504 Ca 0.12 -0.11 0.05 0.00 -2.00 0.00 0.00 55.36 53.42 3h3w s GLN 504 Cb 0.03 -3.36 0.01 0.00 0.80 0.00 0.00 33.01 30.49 3h3w s GLN 504 CO -0.03 0.42 0.29 0.96 -0.50 0.00 0.00 175.29 176.43 3h3w s ILE 505 N -0.02 1.71 0.24 -2.34 -4.36 -1.26 -1.59 121.20 113.57 3h3w s ILE 505 Ca 0.12 -1.61 0.06 0.00 -0.26 0.00 0.00 60.65 58.96 3h3w s ILE 505 Cb -0.12 -2.32 -0.03 0.00 1.25 0.00 0.00 42.46 41.24 3h3w s ILE 505 CO 0.01 0.00 0.27 -0.54 0.24 0.00 0.00 174.94 174.93 3h3w s LYS 506 N -4.14 3.18 -0.06 0.37 1.02 -1.05 -4.71 119.74 114.34 3h3w s LYS 506 Ca 0.30 -0.90 -0.36 0.00 0.02 0.00 0.00 55.97 55.03 3h3w s LYS 506 Cb -0.01 -2.73 -0.14 0.00 -0.52 0.00 0.00 37.83 34.44 3h3w s LYS 506 CO 0.18 0.42 1.74 -0.25 -0.92 0.00 0.00 175.35 176.52 3h3w n ASP 507 N -1.27 2.96 0.00 2.83 9.92 -1.26 -0.95 116.55 128.79 3h3w n ASP 507 Ca -0.08 1.03 0.00 0.00 -0.53 0.00 0.00 54.79 55.21 3h3w n ASP 507 Cb 0.57 -1.31 0.00 0.00 -0.64 0.00 0.00 41.12 39.74 3h3w n ASP 507 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3h3w n ARG 508 N 5.30 0.00 -0.37 -1.24 1.74 -1.26 -4.85 116.66 115.98 3h3w n ARG 508 Ca 0.22 0.00 0.29 0.00 -0.77 0.00 0.00 57.85 57.59 3h3w n ARG 508 Cb 0.25 -1.20 0.58 0.00 -1.02 0.00 0.00 32.46 31.06 3h3w n ARG 508 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3h3w h SER 509 N 0.00 0.34 -3.16 0.55 0.87 -1.36 -3.41 113.55 107.38 3h3w h SER 509 Ca 0.00 0.10 -0.58 0.00 -1.23 0.00 0.00 61.79 60.08 3h3w h SER 509 Cb 0.00 0.05 -0.06 0.00 -0.44 0.00 0.00 62.40 61.95 3h3w h SER 509 CO 0.00 -0.02 0.82 -0.32 -0.53 0.00 0.00 176.83 176.78 3h3w s MET 510 N -5.38 4.18 -0.20 2.24 -2.45 -1.25 -3.85 119.30 112.59 3h3w s MET 510 Ca -0.08 1.27 -0.21 0.00 -1.25 0.00 0.00 55.69 55.42 3h3w s MET 510 Cb 0.27 -3.68 0.06 0.00 1.25 0.00 0.00 34.83 32.72 3h3w s MET 510 CO 0.81 -0.74 0.58 -1.83 1.05 0.00 0.00 175.02 174.89 3h3w s GLU 511 N 3.39 0.70 0.47 4.11 -1.05 0.34 -0.81 118.70 125.85 3h3w s GLU 511 Ca 0.45 0.75 0.01 0.00 -0.15 0.00 0.00 54.97 56.03 3h3w s GLU 511 Cb -0.14 0.34 0.01 0.00 -0.44 0.00 0.00 34.13 33.89 3h3w s GLU 511 CO 0.10 -0.10 0.69 -1.54 0.95 0.00 0.00 175.26 175.37 3h3w s SER 512 N 0.19 5.70 1.09 0.83 1.04 0.28 -0.21 113.70 122.62 3h3w s SER 512 Ca -0.01 0.21 -0.13 0.00 0.48 0.00 0.00 55.95 56.50 3h3w s SER 512 Cb -0.04 -1.37 0.24 0.00 0.10 0.00 0.00 66.02 64.95 3h3w s SER 512 CO 0.01 -0.80 1.07 0.54 0.98 0.00 0.00 173.24 175.04 3h3w s ASN 513 N -4.27 1.79 0.32 7.02 4.22 -1.06 -4.66 114.94 118.30 3h3w s ASN 513 Ca 0.50 1.21 -0.09 0.00 -2.14 0.00 0.00 52.86 52.35 3h3w s ASN 513 Cb -0.10 -1.89 -0.06 0.00 1.28 0.00 0.00 41.25 40.47 3h3w s ASN 513 CO 0.38 -3.66 0.65 0.42 -2.04 0.00 0.00 177.10 172.85 3h3w s THR 514 N -2.79 4.89 0.10 0.54 -4.23 -1.26 -4.61 115.64 108.27 3h3w s THR 514 Ca 0.67 0.43 -0.04 0.00 -1.18 0.00 0.00 61.69 61.56 3h3w s THR 514 Cb -0.20 -3.70 -0.03 0.00 1.34 0.00 0.00 72.50 69.92 3h3w s THR 514 CO 0.60 -0.32 0.09 0.72 -0.54 0.00 0.00 174.62 175.16 3h3w s PHE 515 N -2.12 0.51 0.02 3.99 -0.71 -0.32 -4.94 117.98 114.41 3h3w s PHE 515 Ca 0.48 -0.96 -0.21 0.00 -1.04 0.00 0.00 56.93 55.20 3h3w s PHE 515 Cb -0.11 -0.29 -0.06 0.00 -1.21 0.00 0.00 43.02 41.36 3h3w s PHE 515 CO 0.27 -0.50 0.62 -1.12 -1.34 0.00 0.00 175.22 173.15 3h3w s SER 516 N -2.95 7.04 -0.27 1.98 0.01 -1.26 -0.94 113.70 117.31 3h3w s SER 516 Ca 0.13 1.24 -0.02 0.00 1.31 0.00 0.00 55.95 58.61 3h3w s SER 516 Cb 0.06 -2.39 0.04 0.00 0.21 0.00 0.00 66.02 63.95 3h3w s SER 516 CO -0.06 0.12 -0.03 0.12 0.41 0.00 0.00 173.24 173.80 3h3w s PHE 517 N -0.36 3.17 -0.98 2.43 5.36 -0.94 -2.44 117.98 124.22 3h3w s PHE 517 Ca 0.32 -1.73 -0.24 0.00 -0.96 0.00 0.00 56.93 54.32 3h3w s PHE 517 Cb -0.19 -2.08 0.00 0.00 -0.34 0.00 0.00 43.02 40.41 3h3w s PHE 517 CO 0.19 -0.77 1.71 1.21 -1.46 0.00 0.00 175.22 176.09 3h3w s ASN 518 N 1.28 5.83 0.37 6.13 2.47 -0.24 -3.38 114.94 127.40 3h3w s ASN 518 Ca -0.03 -1.11 -0.28 0.00 0.42 0.00 0.00 52.86 51.86 3h3w s ASN 518 Cb -0.18 -2.57 -0.11 0.00 -1.45 0.00 0.00 41.25 36.94 3h3w s ASN 518 CO -0.03 -2.13 1.47 -1.54 -3.72 0.00 0.00 177.10 171.15 3h3w n SER 519 N 11.44 3.69 0.17 -4.21 3.41 -0.56 -4.84 113.62 122.72 3h3w n SER 519 Ca 0.37 1.23 0.13 0.00 -0.26 0.00 0.00 58.87 60.34 3h3w n SER 519 Cb 0.49 -1.61 0.70 0.00 -0.26 0.00 0.00 64.21 63.53 3h3w n SER 519 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3h3w h GLY 520 N 2.93 0.00 -0.99 5.00 0.00 -1.92 -3.30 103.07 104.79 3h3w h GLY 520 Ca -0.50 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 46.38 3h3w h GLY 520 CO 0.64 0.00 0.09 0.50 0.00 0.00 0.00 176.54 177.77 3h3w s ARG 521 N -4.97 -0.34 0.00 4.80 0.52 -1.26 -4.70 118.95 113.00 3h3w s ARG 521 Ca -0.05 0.66 0.01 0.00 -0.52 0.00 0.00 55.73 55.83 3h3w s ARG 521 Cb 0.17 -1.63 -0.01 0.00 0.52 0.00 0.00 34.95 34.00 3h3w s ARG 521 CO 0.66 -3.29 -0.04 -1.59 0.02 0.00 0.00 175.30 171.06 3h3w s LYS 522 N -4.71 0.32 0.15 3.54 0.00 -1.26 0.42 119.74 118.21 3h3w s LYS 522 Ca 0.67 -0.22 -0.09 0.00 0.00 0.00 0.00 55.97 56.33 3h3w s LYS 522 Cb -0.22 -0.27 -0.01 0.00 0.00 0.00 0.00 37.83 37.34 3h3w s LYS 522 CO 0.61 0.07 0.27 0.54 0.00 0.00 0.00 175.35 176.85 3h3w s VAL 523 N -0.30 0.08 0.04 1.79 0.11 -1.14 -4.91 120.40 116.06 3h3w s VAL 523 Ca -0.01 -1.34 0.04 0.00 -2.93 0.00 0.00 61.98 57.74 3h3w s VAL 523 Cb -0.03 -1.76 -0.02 0.00 -1.53 0.00 0.00 36.38 33.04 3h3w s VAL 523 CO -0.00 -0.34 -0.13 -0.69 -3.33 0.00 0.00 175.10 170.61 3h3w s VAL 524 N -3.95 0.98 0.23 2.04 1.01 -1.25 -4.01 120.40 115.45 3h3w s VAL 524 Ca 0.15 -0.99 -0.22 0.00 0.00 0.00 0.00 61.98 60.91 3h3w s VAL 524 Cb 0.03 -0.91 0.04 0.00 0.00 0.00 0.00 36.38 35.54 3h3w s VAL 524 CO -0.02 -0.07 0.79 0.21 0.00 0.00 0.00 175.10 176.01 3h3w s ASN 525 N -1.21 -0.26 -1.39 3.32 3.84 -1.26 -4.99 114.94 112.99 3h3w s ASN 525 Ca -0.01 -0.50 -0.01 0.00 0.21 0.00 0.00 52.86 52.55 3h3w s ASN 525 Cb -0.08 0.64 0.00 0.00 -0.55 0.00 0.00 41.25 41.26 3h3w s ASN 525 CO 0.01 -1.18 0.43 -2.65 -2.79 0.00 0.00 177.10 170.92 3h3w n PRO 526 N -0.45 -3.16 -3.79 0.43 -0.02 -1.26 -1.39 135.00 125.36 3h3w n PRO 526 Ca -0.05 0.40 -0.25 0.00 -2.02 0.00 0.00 63.50 61.57 3h3w n PRO 526 Cb 0.60 -4.48 0.03 0.00 -0.02 0.00 0.00 33.50 29.63 3h3w n PRO 526 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3h3w n ASP 527 N -2.97 -2.92 0.00 2.55 -0.08 -1.26 -4.84 116.55 107.02 3h3w n ASP 527 Ca -0.30 -0.79 0.00 0.00 -1.51 0.00 0.00 54.79 52.18 3h3w n ASP 527 Cb 0.68 -4.01 0.00 0.00 2.34 0.00 0.00 41.12 40.14 3h3w n ASP 527 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 3h3w n THR 528 N -4.48 0.00 0.00 5.18 -2.24 -0.48 -5.14 114.28 107.12 3h3w n THR 528 Ca -0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3h3w n THR 528 Cb 0.61 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 68.20 3h3w n THR 528 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h3w n GLY 529 N 3.29 0.94 0.34 3.38 0.00 -1.26 -4.87 105.19 107.01 3h3w n GLY 529 Ca 0.00 -1.87 -0.03 0.00 0.00 0.00 0.00 46.02 44.11 3h3w n GLY 529 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3h3w h LEU 530 N 0.00 0.99 -0.25 0.99 3.38 -1.99 -3.32 115.31 115.11 3h3w h LEU 530 Ca 0.00 -0.11 -0.40 0.00 0.09 0.00 0.00 57.88 57.45 3h3w h LEU 530 Cb 0.00 -0.25 0.11 0.00 0.09 0.00 0.00 40.66 40.61 3h3w h LEU 530 CO 0.00 0.84 -0.66 -0.62 0.09 0.00 0.00 178.44 178.09 3h3w n GLU 531 N -4.32 -7.01 0.00 1.13 -0.58 -1.26 -2.89 120.64 105.72 3h3w n GLU 531 Ca 0.07 0.86 0.00 0.00 -0.42 0.00 0.00 57.16 57.67 3h3w n GLU 531 Cb 0.14 -5.86 0.00 0.00 -0.57 0.00 0.00 31.44 25.15 3h3w n GLU 531 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3h3w n GLU 532 N -4.71 0.00 -4.69 3.49 4.71 -1.26 -4.63 120.64 113.56 3h3w n GLU 532 Ca -0.03 0.00 -0.33 0.00 -0.01 0.00 0.00 57.16 56.79 3h3w n GLU 532 Cb 0.58 0.00 -0.14 0.00 -1.01 0.00 0.00 31.44 30.87 3h3w n GLU 532 CO 0.00 0.00 0.00 0.16 0.09 0.00 0.00 177.13 177.38 3h3w s ASP 533 N -4.00 4.23 0.13 1.62 3.84 -1.25 -4.25 116.67 116.99 3h3w s ASP 533 Ca 0.00 -0.26 -0.35 0.00 -0.00 0.00 0.00 52.55 51.94 3h3w s ASP 533 Cb 0.00 -1.60 -0.16 0.00 -1.38 0.00 0.00 42.92 39.78 3h3w s ASP 533 CO 0.00 0.18 1.26 0.52 -0.00 0.00 0.00 175.17 177.13 3h3w n VAL 534 N 3.42 0.46 -5.09 2.11 0.31 0.17 -4.72 118.33 114.98 3h3w n VAL 534 Ca -0.18 -0.11 -0.29 0.00 -0.01 0.00 0.00 64.34 63.75 3h3w n VAL 534 Cb 0.53 -0.87 -0.16 0.00 -0.91 0.00 0.00 33.84 32.43 3h3w n VAL 534 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3h3w s LEU 535 N 0.57 2.02 0.14 7.52 1.43 -1.26 -1.50 118.68 127.60 3h3w s LEU 535 Ca 0.78 -0.43 0.05 0.00 -1.03 0.00 0.00 54.13 53.51 3h3w s LEU 535 Cb -0.89 -1.18 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 3h3w s LEU 535 CO 0.49 0.23 -0.11 -0.72 0.23 0.00 0.00 176.35 176.47 3h3w s TYR 536 N -0.26 1.29 -0.12 0.29 -0.00 -1.22 -4.98 117.35 112.36 3h3w s TYR 536 Ca 0.01 -0.68 -0.30 0.00 -0.00 0.00 0.00 57.07 56.11 3h3w s TYR 536 Cb -0.11 -0.66 -0.01 0.00 -0.00 0.00 0.00 41.96 41.17 3h3w s TYR 536 CO 0.01 0.10 1.08 -0.51 -0.00 0.00 0.00 175.55 176.24 3h3w s ASP 537 N -2.89 7.15 0.19 -0.18 1.11 -1.26 -2.22 116.67 118.57 3h3w s ASP 537 Ca 0.13 1.59 0.06 0.00 0.18 0.00 0.00 52.55 54.52 3h3w s ASP 537 Cb -0.00 -2.55 -0.05 0.00 1.07 0.00 0.00 42.92 41.39 3h3w s ASP 537 CO 0.01 -0.55 -0.11 0.54 1.18 0.00 0.00 175.17 176.25 3h3w s VAL 538 N 2.39 1.49 0.27 -1.27 0.11 -0.12 -4.56 120.40 118.70 3h3w s VAL 538 Ca 0.50 -2.14 -0.21 0.00 -2.93 0.00 0.00 61.98 57.20 3h3w s VAL 538 Cb -0.20 -2.04 0.04 0.00 -1.53 0.00 0.00 36.38 32.66 3h3w s VAL 538 CO 0.17 -0.60 0.81 0.00 -3.33 0.00 0.00 175.10 172.15 3h3w s ARG 539 N -3.70 1.73 -0.21 1.54 1.70 -0.58 -1.18 118.95 118.25 3h3w s ARG 539 Ca 0.22 -1.01 -0.05 0.00 -0.47 0.00 0.00 55.73 54.42 3h3w s ARG 539 Cb 0.01 0.55 -0.02 0.00 -0.57 0.00 0.00 34.95 34.92 3h3w s ARG 539 CO 0.05 -0.80 -0.00 0.42 -1.08 0.00 0.00 175.30 173.89 3h3w s ILE 540 N -3.28 3.82 0.13 4.99 1.01 -1.26 -2.33 121.20 124.28 3h3w s ILE 540 Ca 0.13 -0.35 0.05 0.00 0.00 0.00 0.00 60.65 60.48 3h3w s ILE 540 Cb -0.05 -2.74 -0.04 0.00 0.01 0.00 0.00 42.46 39.64 3h3w s ILE 540 CO 0.07 0.41 -0.12 -0.69 0.00 0.00 0.00 174.94 174.61 3h3w s VAL 541 N 1.23 1.24 0.30 2.92 1.01 -0.44 -0.56 120.40 126.11 3h3w s VAL 541 Ca 0.03 -1.87 0.06 0.00 0.00 0.00 0.00 61.98 60.21 3h3w s VAL 541 Cb -0.15 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.56 3h3w s VAL 541 CO 0.01 -0.57 0.38 -0.94 0.00 0.00 0.00 175.10 173.98 3h3w s SER 542 N -2.78 5.88 0.28 3.32 1.04 0.00 -0.46 113.70 120.98 3h3w s SER 542 Ca 0.12 -0.19 0.09 0.00 0.48 0.00 0.00 55.95 56.45 3h3w s SER 542 Cb -0.02 -1.35 -0.04 0.00 0.10 0.00 0.00 66.02 64.71 3h3w s SER 542 CO 0.02 -0.29 0.02 0.42 0.98 0.00 0.00 173.24 174.38 3h3w s THR 543 N -2.15 3.41 0.38 2.02 -4.23 -0.98 -4.39 115.64 109.71 3h3w s THR 543 Ca 0.40 -1.88 -0.24 0.00 -1.18 0.00 0.00 61.69 58.80 3h3w s THR 543 Cb -0.09 -2.88 -0.13 0.00 1.34 0.00 0.00 72.50 70.75 3h3w s THR 543 CO 0.29 -0.35 0.70 0.47 -0.54 0.00 0.00 174.62 175.19 3h3w n ASP 544 N -0.93 -0.21 -4.77 3.99 10.43 -0.95 -4.24 116.55 119.88 3h3w n ASP 544 Ca -0.06 0.99 -0.39 0.00 2.57 0.00 0.00 54.79 57.90 3h3w n ASP 544 Cb 0.59 -1.17 -0.03 0.00 1.84 0.00 0.00 41.12 42.36 3h3w n ASP 544 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3h3w s ARG 545 N -1.61 4.25 0.75 -1.24 1.70 -1.26 -4.28 118.95 117.26 3h3w s ARG 545 Ca 0.63 1.85 -0.13 0.00 -0.47 0.00 0.00 55.73 57.61 3h3w s ARG 545 Cb -0.64 -2.84 0.18 0.00 -0.57 0.00 0.00 34.95 31.08 3h3w s ARG 545 CO 0.58 -0.15 0.88 -0.40 -1.08 0.00 0.00 175.30 175.12 3h3w n ASP 546 N 0.43 -0.60 0.00 -2.89 5.75 -0.90 -4.71 116.55 113.63 3h3w n ASP 546 Ca 0.02 -1.21 0.02 0.00 -0.01 0.00 0.00 54.79 53.62 3h3w n ASP 546 Cb 0.46 -0.72 0.14 0.00 -1.03 0.00 0.00 41.12 39.97 3h3w n ASP 546 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3h3w n SER 547 N -3.86 0.00 0.00 -1.12 3.41 -1.26 -1.25 113.62 109.53 3h3w n SER 547 Ca 0.11 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 3h3w n SER 547 Cb 0.41 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 3h3w n SER 547 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3h3w n LYS 548 N -1.04 1.18 -0.43 4.33 4.81 -1.26 -5.00 118.16 120.74 3h3w n LYS 548 Ca 0.03 -0.97 0.00 0.00 -0.87 0.00 0.00 58.31 56.50 3h3w n LYS 548 Cb 0.02 -0.92 0.00 0.00 0.02 0.00 0.00 35.03 34.15 3h3w n LYS 548 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3h3w n GLY 549 N -0.25 1.59 2.76 3.14 0.00 -0.38 -4.94 105.19 107.11 3h3w n GLY 549 Ca 0.00 -0.20 -0.17 0.00 0.00 0.00 0.00 46.02 45.65 3h3w n GLY 549 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3w s ILE 550 N -2.00 -0.36 0.52 -0.61 1.01 -1.25 -1.04 121.20 117.47 3h3w s ILE 550 Ca 0.00 -0.16 0.06 0.00 0.00 0.00 0.00 60.65 60.55 3h3w s ILE 550 Cb 0.00 -0.73 0.03 0.00 0.01 0.00 0.00 42.46 41.77 3h3w s ILE 550 CO 0.00 -0.24 0.41 -0.83 0.00 0.00 0.00 174.94 174.29 3h3w s GLY 551 N 2.35 2.30 0.51 6.18 0.00 -1.06 -2.11 107.32 115.48 3h3w s GLY 551 Ca 0.08 -1.45 -0.03 0.00 0.00 0.00 0.00 44.72 43.32 3h3w s GLY 551 CO -0.15 -1.89 0.77 0.54 0.00 0.00 0.00 173.10 172.37 3h3w s LYS 552 N -4.27 3.07 -0.33 2.90 -0.14 -1.26 -1.33 119.74 118.37 3h3w s LYS 552 Ca 0.38 -0.22 -0.04 0.00 -1.36 0.00 0.00 55.97 54.73 3h3w s LYS 552 Cb -0.02 -2.43 0.06 0.00 -1.68 0.00 0.00 37.83 33.76 3h3w s LYS 552 CO 0.23 -0.42 0.08 0.08 -0.76 0.00 0.00 175.35 174.56 3h3w s VAL 553 N -2.74 3.35 0.21 3.17 1.01 -1.11 -2.31 120.40 121.98 3h3w s VAL 553 Ca 0.50 -1.40 0.09 0.00 0.00 0.00 0.00 61.98 61.16 3h3w s VAL 553 Cb -0.10 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3h3w s VAL 553 CO 0.41 -0.24 -0.03 0.27 0.00 0.00 0.00 175.10 175.52 3h3w s ILE 554 N 1.29 3.47 -0.02 2.22 -4.36 0.39 -0.88 121.20 123.30 3h3w s ILE 554 Ca -0.02 -1.65 0.03 0.00 -0.26 0.00 0.00 60.65 58.75 3h3w s ILE 554 Cb -0.20 -2.77 -0.00 0.00 1.25 0.00 0.00 42.46 40.74 3h3w s ILE 554 CO -0.00 -0.19 -0.10 -0.51 0.24 0.00 0.00 174.94 174.37 3h3w s ILE 555 N -1.91 0.85 -2.31 8.37 2.07 -0.43 -1.33 121.20 126.51 3h3w s ILE 555 Ca 0.28 -0.42 0.00 0.00 -1.41 0.00 0.00 60.65 59.10 3h3w s ILE 555 Cb -0.08 -0.74 0.00 0.00 0.13 0.00 0.00 42.46 41.77 3h3w s ILE 555 CO 0.18 0.26 0.00 0.61 -1.91 0.00 0.00 174.94 174.07 3h3w n GLY 556 N 3.14 -1.37 2.97 1.50 0.00 -0.98 -1.14 105.19 109.30 3h3w n GLY 556 Ca -0.17 -1.01 -0.23 0.00 0.00 0.00 0.00 46.02 44.61 3h3w n GLY 556 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h3w n PRO 557 N -0.05 -1.29 -1.56 1.61 -0.02 -1.26 -1.52 135.00 130.91 3h3w n PRO 557 Ca 0.00 -1.57 0.00 0.00 -2.02 0.00 0.00 63.50 59.91 3h3w n PRO 557 Cb 0.00 -1.10 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 3h3w n PRO 557 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3h3w n PHE 558 N -3.59 -0.20 -3.51 6.00 3.01 -0.74 -4.81 117.46 113.63 3h3w n PHE 558 Ca 0.13 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.39 3h3w n PHE 558 Cb 0.45 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.91 3h3w n PHE 558 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3h3w s ALA 559 N -1.77 4.14 -1.71 4.37 0.00 -1.26 -3.08 121.76 122.45 3h3w s ALA 559 Ca 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 51.96 50.33 3h3w s ALA 559 Cb 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 21.73 3h3w s ALA 559 CO 0.00 -0.10 0.81 0.43 0.00 0.00 0.00 175.76 176.90 3h3w n SER 560 N -1.58 0.28 0.00 0.00 7.64 -1.26 -2.53 113.62 116.17 3h3w n SER 560 Ca 0.01 -1.89 0.00 0.00 1.01 0.00 0.00 58.87 58.01 3h3w n SER 560 Cb 0.59 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 3h3w n SER 560 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h3w n GLY 561 N 0.32 -0.71 0.44 0.23 0.00 -1.26 -4.98 105.19 99.24 3h3w n GLY 561 Ca 0.00 -0.37 0.14 0.00 0.00 0.00 0.00 46.02 45.79 3h3w n GLY 561 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h3w n ASP 562 N 0.00 1.42 -4.28 1.61 10.43 -1.05 -4.81 116.55 119.86 3h3w n ASP 562 Ca 0.00 -1.42 -0.32 0.00 2.57 0.00 0.00 54.79 55.62 3h3w n ASP 562 Cb 0.00 0.01 -0.16 0.00 1.84 0.00 0.00 41.12 42.81 3h3w n ASP 562 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3h3w s VAL 563 N -2.06 2.43 -0.27 2.53 1.01 -1.26 -4.95 120.40 117.83 3h3w s VAL 563 Ca 0.37 -0.89 -0.25 0.00 0.00 0.00 0.00 61.98 61.21 3h3w s VAL 563 Cb 0.21 -1.96 -0.00 0.00 0.00 0.00 0.00 36.38 34.63 3h3w s VAL 563 CO 0.36 0.55 0.84 0.42 0.00 0.00 0.00 175.10 177.26 3h3w s THR 564 N 0.26 4.80 -0.04 3.92 -4.23 -1.26 -5.02 115.64 114.07 3h3w s THR 564 Ca -0.14 1.47 -0.19 0.00 -1.18 0.00 0.00 61.69 61.65 3h3w s THR 564 Cb -0.17 -4.15 -0.05 0.00 1.34 0.00 0.00 72.50 69.47 3h3w s THR 564 CO 0.07 -0.16 0.52 -1.61 -0.54 0.00 0.00 174.62 172.90 3h3w s GLU 565 N 2.94 4.25 0.00 3.99 2.02 -1.26 -4.83 118.70 125.81 3h3w s GLU 565 Ca 0.35 0.58 0.00 0.00 0.02 0.00 0.00 54.97 55.92 3h3w s GLU 565 Cb -0.15 -3.35 0.00 0.00 0.10 0.00 0.00 34.13 30.73 3h3w s GLU 565 CO 0.09 0.36 0.00 0.09 0.02 0.00 0.00 175.26 175.82 3h3w n ASN 566 N 2.88 1.94 0.08 -0.19 3.02 0.19 -4.96 115.26 118.22 3h3w n ASN 566 Ca -0.08 -0.14 -0.05 0.00 -0.03 0.00 0.00 54.58 54.28 3h3w n ASN 566 Cb 0.51 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.80 3h3w n ASN 566 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 3h3w h GLU 567 N 0.00 0.28 0.00 3.52 4.81 -2.04 -3.37 114.58 117.78 3h3w h GLU 567 Ca 0.00 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.04 3h3w h GLU 567 Cb 0.00 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.41 3h3w h GLU 567 CO 0.00 0.79 -0.19 -0.91 -0.73 0.00 0.00 179.01 177.97 3h3w h ASN 568 N 0.21 0.00 -2.06 1.04 2.35 -1.99 -3.45 115.58 111.68 3h3w h ASN 568 Ca -0.00 0.00 -0.53 0.00 -0.55 0.00 0.00 56.30 55.21 3h3w h ASN 568 Cb 1.09 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.45 3h3w h ASN 568 CO 0.09 0.34 1.45 -0.63 -1.65 0.00 0.00 177.43 177.04 3h3w s ILE 569 N -1.53 3.19 -0.01 2.81 1.01 -1.26 -4.95 121.20 120.46 3h3w s ILE 569 Ca -0.05 0.17 -0.07 0.00 0.00 0.00 0.00 60.65 60.69 3h3w s ILE 569 Cb 0.01 -3.34 0.01 0.00 0.01 0.00 0.00 42.46 39.14 3h3w s ILE 569 CO 0.08 -0.28 0.15 -1.10 0.00 0.00 0.00 174.94 173.79 3h3w s GLN 570 N 6.84 0.41 0.42 2.79 -1.52 -1.26 0.54 119.66 127.88 3h3w s GLN 570 Ca 0.88 -0.23 -0.26 0.00 -1.95 0.00 0.00 55.36 53.80 3h3w s GLN 570 Cb -0.22 0.17 -0.10 0.00 -0.22 0.00 0.00 33.01 32.65 3h3w s GLN 570 CO 0.30 -0.09 1.34 -2.30 -0.25 0.00 0.00 175.29 174.28 3h3w n PRO 571 N 1.85 2.10 -1.69 2.91 -0.02 -1.26 -4.56 135.00 134.34 3h3w n PRO 571 Ca -0.20 0.75 -0.44 0.00 -2.02 0.00 0.00 63.50 61.59 3h3w n PRO 571 Cb 0.56 -2.47 -0.02 0.00 -0.02 0.00 0.00 33.50 31.55 3h3w n PRO 571 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 3h3w n TYR 572 N -0.11 2.32 -0.16 6.00 9.36 0.32 -4.87 117.16 130.03 3h3w n TYR 572 Ca 0.06 0.41 -0.08 0.00 3.32 0.00 0.00 57.90 61.60 3h3w n TYR 572 Cb 0.40 -2.48 0.01 0.00 -0.63 0.00 0.00 39.34 36.63 3h3w n TYR 572 CO 0.00 0.00 0.00 1.79 0.22 0.00 0.00 176.86 178.87 3h3w h THR 573 N 3.06 1.17 -3.65 2.97 1.35 -1.89 -3.45 112.91 112.47 3h3w h THR 573 Ca -0.45 -0.42 -0.10 0.00 -0.55 0.00 0.00 66.41 64.89 3h3w h THR 573 Cb 1.27 0.59 -0.16 0.00 -1.73 0.00 0.00 68.15 68.12 3h3w h THR 573 CO 0.75 0.18 -0.36 -0.83 -0.25 0.00 0.00 175.52 175.00 3h3w s GLY 574 N -2.81 0.04 0.34 5.82 0.00 -1.26 -5.12 107.32 104.33 3h3w s GLY 574 Ca -0.13 -0.40 -0.27 0.00 0.00 0.00 0.00 44.72 43.92 3h3w s GLY 574 CO 0.75 -0.59 1.04 -2.01 0.00 0.00 0.00 173.10 172.29 3h3w n ASN 575 N 0.31 1.48 0.00 1.64 2.85 -1.26 -4.77 115.26 115.51 3h3w n ASN 575 Ca -0.17 1.13 0.00 0.00 -0.11 0.00 0.00 54.58 55.43 3h3w n ASN 575 Cb 0.61 -1.34 0.00 0.00 1.24 0.00 0.00 39.78 40.29 3h3w n ASN 575 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 3h3w n ASP 576 N 0.94 0.00 -0.45 1.20 2.03 -1.26 -5.11 116.55 113.90 3h3w n ASP 576 Ca 0.09 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.40 3h3w n ASP 576 Cb 0.35 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.75 3h3w n ASP 576 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 3h3w n PHE 577 N 0.00 -0.11 -3.58 -0.67 -1.74 -1.26 -2.23 117.46 107.87 3h3w n PHE 577 Ca 0.00 0.00 -0.41 0.00 -0.56 0.00 0.00 57.45 56.48 3h3w n PHE 577 Cb 0.00 0.00 -0.11 0.00 1.52 0.00 0.00 39.48 40.89 3h3w n PHE 577 CO 0.00 0.00 0.00 -0.80 -0.56 0.00 0.00 176.76 175.40 3h3w s ASN 578 N 0.66 5.79 0.26 5.98 0.01 -1.26 -5.09 114.94 121.29 3h3w s ASN 578 Ca 0.00 -0.87 -0.08 0.00 -0.71 0.00 0.00 52.86 51.20 3h3w s ASN 578 Cb 0.00 -2.05 -0.06 0.00 0.41 0.00 0.00 41.25 39.55 3h3w s ASN 578 CO 0.00 -0.36 0.57 -0.54 -1.51 0.00 0.00 177.10 175.26 3h3w s LYS 579 N 1.59 3.73 0.37 -0.60 1.02 -1.26 -4.98 119.74 119.62 3h3w s LYS 579 Ca 0.03 0.19 0.07 0.00 0.02 0.00 0.00 55.97 56.28 3h3w s LYS 579 Cb -0.19 -2.63 -0.01 0.00 -0.52 0.00 0.00 37.83 34.48 3h3w s LYS 579 CO 0.07 0.25 0.43 -0.48 -0.92 0.00 0.00 175.35 174.71 3h3w s LEU 580 N -3.16 3.71 -0.22 3.17 0.05 -1.26 -5.02 118.68 115.95 3h3w s LEU 580 Ca 0.46 -0.41 -0.32 0.00 0.05 0.00 0.00 54.13 53.92 3h3w s LEU 580 Cb -0.11 -2.48 -0.08 0.00 -2.05 0.00 0.00 46.19 41.47 3h3w s LEU 580 CO 0.25 -0.52 2.13 0.00 -0.55 0.00 0.00 176.35 177.67 3h3w n ALA 581 N -1.60 1.39 -1.64 1.48 0.00 -1.26 -4.87 120.51 114.00 3h3w n ALA 581 Ca 0.02 -0.06 -0.36 0.00 0.00 0.00 0.00 53.44 53.03 3h3w n ALA 581 Cb 0.59 -2.71 -0.03 0.00 0.00 0.00 0.00 19.45 17.30 3h3w n ALA 581 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3h3w n ASN 582 N 9.93 7.92 0.01 0.00 6.94 -1.26 -4.52 115.26 134.29 3h3w n ASN 582 Ca 0.31 -2.91 0.02 0.00 -0.02 0.00 0.00 54.58 51.98 3h3w n ASN 582 Cb 0.35 -1.42 0.10 0.00 -2.36 0.00 0.00 39.78 36.45 3h3w n ASN 582 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 3h3w n SER 583 N 2.30 0.05 -0.54 0.53 3.41 -1.26 0.18 113.62 118.28 3h3w n SER 583 Ca 0.65 0.52 0.06 0.00 -0.26 0.00 0.00 58.87 59.84 3h3w n SER 583 Cb 0.32 -0.53 0.08 0.00 -0.26 0.00 0.00 64.21 63.83 3h3w n SER 583 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3h3w n ASP 584 N -1.56 2.28 0.00 4.04 8.00 -1.26 -5.01 116.55 123.03 3h3w n ASP 584 Ca 0.00 -1.64 0.00 0.00 0.71 0.00 0.00 54.79 53.86 3h3w n ASP 584 Cb 0.03 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 3h3w n ASP 584 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h3w n GLY 585 N 0.66 2.60 3.74 0.44 0.00 0.47 -5.02 105.19 108.08 3h3w n GLY 585 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 3h3w n GLY 585 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h3w s ARG 586 N -0.29 1.85 0.00 1.61 0.52 -1.26 -4.93 118.95 116.45 3h3w s ARG 586 Ca 0.00 1.14 0.00 0.00 -0.52 0.00 0.00 55.73 56.35 3h3w s ARG 586 Cb 0.00 -1.85 0.00 0.00 0.52 0.00 0.00 34.95 33.62 3h3w s ARG 586 CO 0.00 -1.92 0.00 -3.47 0.02 0.00 0.00 175.30 169.93 3h3w n ASP 587 N -3.71 0.00 -3.54 0.23 4.64 -1.18 -4.70 116.55 108.30 3h3w n ASP 587 Ca 0.09 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.50 3h3w n ASP 587 Cb 0.53 0.00 -0.03 0.00 -1.04 0.00 0.00 41.12 40.58 3h3w n ASP 587 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 3h3w s LYS 588 N 0.00 0.56 0.23 -0.67 1.02 -1.26 -4.78 119.74 114.84 3h3w s LYS 588 Ca 0.00 1.32 0.08 0.00 0.02 0.00 0.00 55.97 57.39 3h3w s LYS 588 Cb 0.00 0.79 -0.04 0.00 -0.52 0.00 0.00 37.83 38.06 3h3w s LYS 588 CO 0.00 -0.27 0.06 0.71 -0.92 0.00 0.00 175.35 174.93 3h3w s TYR 589 N 2.86 2.86 -0.02 3.18 2.02 -1.26 -1.78 117.35 125.21 3h3w s TYR 589 Ca -0.01 -0.16 0.04 0.00 -0.37 0.00 0.00 57.07 56.57 3h3w s TYR 589 Cb -0.12 -1.31 -0.01 0.00 -0.40 0.00 0.00 41.96 40.12 3h3w s TYR 589 CO -0.19 0.56 -0.15 0.71 -1.57 0.00 0.00 175.55 174.91 3h3w s TYR 590 N -2.09 1.42 0.22 2.71 1.51 -0.29 0.12 117.35 120.94 3h3w s TYR 590 Ca 0.31 -0.33 -0.30 0.00 -1.01 0.00 0.00 57.07 55.74 3h3w s TYR 590 Cb -0.08 -0.94 -0.09 0.00 -0.11 0.00 0.00 41.96 40.74 3h3w s TYR 590 CO 0.21 -0.08 1.29 0.08 -1.11 0.00 0.00 175.55 175.94 3h3w s VAL 591 N -0.16 3.19 -0.00 0.71 1.01 -1.26 -1.31 120.40 122.57 3h3w s VAL 591 Ca 0.02 1.02 0.00 0.00 0.00 0.00 0.00 61.98 63.02 3h3w s VAL 591 Cb -0.08 -3.65 0.01 0.00 0.00 0.00 0.00 36.38 32.66 3h3w s VAL 591 CO 0.00 0.17 0.97 2.30 0.00 0.00 0.00 175.10 178.54 3h3w n ILE 592 N 2.26 0.05 0.00 2.22 -5.35 -0.06 -4.71 119.36 113.76 3h3w n ILE 592 Ca 0.05 -0.06 0.00 0.00 -0.27 0.00 0.00 62.75 62.47 3h3w n ILE 592 Cb 0.43 0.52 0.00 0.00 -1.74 0.00 0.00 39.64 38.85 3h3w n ILE 592 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h3w n GLY 593 N -0.03 -0.65 3.53 3.28 0.00 -1.18 -1.87 105.19 108.27 3h3w n GLY 593 Ca 0.00 -0.51 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 3h3w n GLY 593 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3h3w s GLU 594 N -1.07 0.76 -0.16 1.61 -1.05 -0.63 -2.74 118.70 115.42 3h3w s GLU 594 Ca 0.00 -0.09 -0.08 0.00 -0.15 0.00 0.00 54.97 54.65 3h3w s GLU 594 Cb 0.00 0.35 -0.04 0.00 -0.44 0.00 0.00 34.13 34.00 3h3w s GLU 594 CO 0.00 -0.29 0.11 0.42 0.95 0.00 0.00 175.26 176.45 3h3w s ILE 595 N -2.20 5.26 -0.58 1.83 1.09 -0.44 -2.46 121.20 123.70 3h3w s ILE 595 Ca 0.01 0.13 -0.19 0.00 -1.10 0.00 0.00 60.65 59.50 3h3w s ILE 595 Cb -0.01 -3.34 0.09 0.00 -1.06 0.00 0.00 42.46 38.14 3h3w s ILE 595 CO -0.03 0.52 0.69 0.21 -0.10 0.00 0.00 174.94 176.23 3h3w s ASN 596 N -0.23 6.19 0.05 3.58 3.04 0.36 -2.58 114.94 125.35 3h3w s ASN 596 Ca 0.10 -1.33 -0.25 0.00 0.04 0.00 0.00 52.86 51.42 3h3w s ASN 596 Cb -0.12 -2.30 -0.17 0.00 -1.54 0.00 0.00 41.25 37.12 3h3w s ASN 596 CO 0.01 -1.08 1.54 1.88 -3.04 0.00 0.00 177.10 176.41 3h3w h TYR 597 N 9.16 -0.06 0.11 0.43 0.05 -1.37 0.32 116.97 125.60 3h3w h TYR 597 Ca -0.29 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.48 3h3w h TYR 597 Cb 1.09 0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.85 3h3w h TYR 597 CO 0.82 0.13 -0.05 -1.35 -1.05 0.00 0.00 178.16 176.66 3h3w h PRO 598 N -0.25 -0.14 0.00 4.88 0.11 -1.93 -2.72 132.00 131.95 3h3w h PRO 598 Ca -0.01 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3h3w h PRO 598 Cb 0.23 0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.37 3h3w h PRO 598 CO 0.01 -0.06 0.00 0.00 -0.21 0.00 0.00 178.00 177.74 3h3w h ALA 599 N 0.72 1.00 -5.73 -0.75 0.00 -1.90 -3.47 119.26 109.12 3h3w h ALA 599 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.71 3h3w h ALA 599 Cb 0.14 0.00 0.04 0.00 0.00 0.00 0.00 17.79 17.98 3h3w h ALA 599 CO 0.02 0.00 -0.45 -3.47 0.00 0.00 0.00 179.25 175.35 3h3w n ASP 600 N -2.59 -6.78 -3.82 0.00 4.64 0.11 -5.04 116.55 103.06 3h3w n ASP 600 Ca 0.01 -0.46 -0.12 0.00 -1.38 0.00 0.00 54.79 52.84 3h3w n ASP 600 Cb 0.23 -4.42 -0.13 0.00 -1.04 0.00 0.00 41.12 35.76 3h3w n ASP 600 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 3h3w s VAL 601 N -3.12 -0.01 -0.10 5.18 -7.23 -0.87 -4.36 120.40 109.90 3h3w s VAL 601 Ca 0.14 0.02 0.00 0.00 -1.81 0.00 0.00 61.98 60.34 3h3w s VAL 601 Cb -0.03 -0.16 0.02 0.00 0.56 0.00 0.00 36.38 36.77 3h3w s VAL 601 CO 0.79 0.01 -0.08 -0.63 -0.31 0.00 0.00 175.10 174.88 3h3w s ILE 602 N 0.20 1.00 -0.03 -0.62 1.01 -0.02 -0.49 121.20 122.26 3h3w s ILE 602 Ca -0.01 -0.30 0.05 0.00 0.00 0.00 0.00 60.65 60.38 3h3w s ILE 602 Cb -0.02 -1.00 -0.01 0.00 0.01 0.00 0.00 42.46 41.44 3h3w s ILE 602 CO -0.01 0.36 -0.17 -0.47 0.00 0.00 0.00 174.94 174.65 3h3w s TYR 603 N 1.47 1.64 0.18 3.97 5.04 -1.03 -1.27 117.35 127.35 3h3w s TYR 603 Ca 0.00 -0.39 -0.09 0.00 -2.44 0.00 0.00 57.07 54.16 3h3w s TYR 603 Cb -0.13 -1.08 -0.01 0.00 0.35 0.00 0.00 41.96 41.09 3h3w s TYR 603 CO -0.05 -0.09 0.30 1.67 -1.34 0.00 0.00 175.55 176.03 3h3w s TRP 604 N -0.19 0.45 -0.28 4.97 -2.14 -1.26 -1.60 118.94 118.89 3h3w s TRP 604 Ca 0.02 -0.80 -0.01 0.00 2.66 0.00 0.00 56.10 57.97 3h3w s TRP 604 Cb -0.09 -0.06 0.17 0.00 -3.10 0.00 0.00 33.47 30.39 3h3w s TRP 604 CO 0.01 -0.75 0.53 1.21 -2.66 0.00 0.00 176.95 175.28 3h3w s ASN 605 N -2.99 -0.87 0.54 -2.66 3.84 -0.78 -1.71 114.94 110.30 3h3w s ASN 605 Ca 0.19 0.60 0.30 0.00 0.21 0.00 0.00 52.86 54.16 3h3w s ASN 605 Cb 0.03 1.82 1.52 0.00 -0.55 0.00 0.00 41.25 44.07 3h3w s ASN 605 CO 0.02 -0.28 2.08 0.40 -2.79 0.00 0.00 177.10 176.53 3h3w h ILE 606 N 6.06 0.42 0.00 -5.21 2.04 -1.52 0.39 117.51 119.69 3h3w h ILE 606 Ca -0.20 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.16 3h3w h ILE 606 Cb 1.16 1.35 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 3h3w h ILE 606 CO 0.26 0.09 0.09 0.00 0.00 0.00 0.00 178.15 178.59 3h3w n ALA 607 N -2.23 0.89 0.05 1.87 0.00 -1.26 -1.85 120.51 118.00 3h3w n ALA 607 Ca -0.01 0.13 -0.06 0.00 0.00 0.00 0.00 53.44 53.49 3h3w n ALA 607 Cb 0.24 -1.07 0.12 0.00 0.00 0.00 0.00 19.45 18.74 3h3w n ALA 607 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3h3w h LYS 608 N 0.00 0.36 0.00 0.00 1.57 -1.27 -3.39 116.57 113.85 3h3w h LYS 608 Ca 0.00 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 3h3w h LYS 608 Cb 0.18 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.51 3h3w h LYS 608 CO 0.00 0.80 0.00 0.44 -0.57 0.00 0.00 179.45 180.12 3h3w n ILE 609 N -3.94 0.00 -1.55 1.86 -5.35 -0.77 -4.80 119.36 104.81 3h3w n ILE 609 Ca -0.02 0.00 -0.08 0.00 -0.27 0.00 0.00 62.75 62.38 3h3w n ILE 609 Cb 0.58 -1.57 0.17 0.00 -1.74 0.00 0.00 39.64 37.07 3h3w n ILE 609 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3h3w n ASN 610 N -2.69 3.02 -4.75 7.28 3.02 -1.26 -4.93 115.26 114.97 3h3w n ASN 610 Ca 0.00 -3.81 -0.39 0.00 -0.03 0.00 0.00 54.58 50.35 3h3w n ASN 610 Cb 0.00 -0.61 -0.05 0.00 -0.61 0.00 0.00 39.78 38.51 3h3w n ASN 610 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3h3w s LEU 611 N -3.34 4.40 0.15 3.41 1.43 -1.26 -5.03 118.68 118.44 3h3w s LEU 611 Ca 0.46 1.25 -0.19 0.00 -1.03 0.00 0.00 54.13 54.62 3h3w s LEU 611 Cb 0.41 -3.05 -0.07 0.00 0.03 0.00 0.00 46.19 43.50 3h3w s LEU 611 CO -0.01 0.02 0.64 -0.89 0.23 0.00 0.00 176.35 176.34 3h3w s THR 612 N 0.10 4.67 0.64 5.49 2.01 -1.26 -4.44 115.64 122.85 3h3w s THR 612 Ca 0.35 1.19 0.26 0.00 0.31 0.00 0.00 61.69 63.80 3h3w s THR 612 Cb -0.19 -3.87 0.29 0.00 0.01 0.00 0.00 72.50 68.74 3h3w s THR 612 CO 0.19 0.35 1.79 0.77 -0.69 0.00 0.00 174.62 177.03 3h3w h SER 613 N 3.88 0.00 -0.62 3.53 4.64 -1.96 0.32 113.55 123.33 3h3w h SER 613 Ca -0.48 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 60.86 3h3w h SER 613 Cb 1.20 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.26 3h3w h SER 613 CO 0.65 0.00 0.41 -0.33 -0.87 0.00 0.00 176.83 176.69 3h3w h GLU 614 N 0.00 0.73 -0.01 4.77 3.07 -1.98 -1.14 114.58 120.01 3h3w h GLU 614 Ca 0.07 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 3h3w h GLU 614 Cb 1.01 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 3h3w h GLU 614 CO -0.00 0.48 0.00 1.63 -1.40 0.00 0.00 179.01 179.72 3h3w n LYS 615 N -4.46 0.75 -4.12 2.33 5.02 0.11 -4.65 118.16 113.13 3h3w n LYS 615 Ca 0.07 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.12 3h3w n LYS 615 Cb 0.12 -1.01 -0.17 0.00 -0.02 0.00 0.00 35.03 33.96 3h3w n LYS 615 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3h3w s PHE 616 N -1.98 1.26 0.41 2.13 0.40 -0.43 -1.08 117.98 118.68 3h3w s PHE 616 Ca 0.00 -0.53 0.12 0.00 -0.60 0.00 0.00 56.93 55.92 3h3w s PHE 616 Cb 0.00 -1.04 0.95 0.00 0.51 0.00 0.00 43.02 43.44 3h3w s PHE 616 CO 0.00 -0.37 1.96 1.05 0.70 0.00 0.00 175.22 178.56 3h3w h GLU 617 N 7.69 0.49 -7.23 0.44 4.11 -1.74 -3.46 114.58 114.88 3h3w h GLU 617 Ca -0.30 -0.03 -0.46 0.00 0.07 0.00 0.00 59.36 58.64 3h3w h GLU 617 Cb 1.15 -0.11 0.09 0.00 0.50 0.00 0.00 28.75 30.38 3h3w h GLU 617 CO 0.42 0.33 0.16 0.14 0.07 0.00 0.00 179.01 180.13 3h3w s VAL 618 N -5.48 2.21 0.15 -1.06 -7.23 -1.26 -5.05 120.40 102.69 3h3w s VAL 618 Ca -0.08 -0.44 0.00 0.00 -1.81 0.00 0.00 61.98 59.64 3h3w s VAL 618 Cb 0.20 -2.77 0.00 0.00 0.56 0.00 0.00 36.38 34.37 3h3w s VAL 618 CO 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 175.55 3h3w n GLN 619 N -2.94 0.00 -3.68 4.82 1.13 -1.26 -4.92 117.38 110.53 3h3w n GLN 619 Ca 0.13 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.83 3h3w n GLN 619 Cb 0.60 -0.28 -0.06 0.00 0.11 0.00 0.00 30.24 30.62 3h3w n GLN 619 CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 3h3w s THR 620 N -2.00 5.23 0.30 5.09 -1.32 -1.26 -0.60 115.64 121.07 3h3w s THR 620 Ca 0.00 0.38 0.03 0.00 -1.21 0.00 0.00 61.69 60.89 3h3w s THR 620 Cb 0.00 -3.59 -0.04 0.00 -1.51 0.00 0.00 72.50 67.36 3h3w s THR 620 CO 0.00 0.43 0.17 0.27 -2.21 0.00 0.00 174.62 173.28 3h3w s ILE 621 N -1.24 0.26 -0.08 5.08 -4.36 0.12 -4.90 121.20 116.09 3h3w s ILE 621 Ca 0.26 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.66 3h3w s ILE 621 Cb -0.14 -2.51 -0.03 0.00 1.25 0.00 0.00 42.46 41.04 3h3w s ILE 621 CO 0.14 0.00 -0.08 -1.61 0.24 0.00 0.00 174.94 173.63 3h3w s GLU 622 N -3.81 2.82 -0.29 0.37 0.41 -1.26 -0.47 118.70 116.48 3h3w s GLU 622 Ca 0.36 -0.57 0.03 0.00 -0.41 0.00 0.00 54.97 54.38 3h3w s GLU 622 Cb 0.05 -2.59 0.07 0.00 -1.78 0.00 0.00 34.13 29.88 3h3w s GLU 622 CO 0.18 0.60 -0.05 -1.17 -0.49 0.00 0.00 175.26 174.33 3h3w s LEU 623 N -0.65 3.86 -0.15 1.80 2.96 -0.51 -2.55 118.68 123.45 3h3w s LEU 623 Ca 0.10 -1.61 -0.08 0.00 -0.22 0.00 0.00 54.13 52.32 3h3w s LEU 623 Cb -0.11 -1.59 -0.04 0.00 0.50 0.00 0.00 46.19 44.95 3h3w s LEU 623 CO 0.02 -0.25 0.13 -0.31 -1.32 0.00 0.00 176.35 174.62 3h3w s TYR 624 N 1.06 3.51 0.04 5.38 1.51 0.71 -1.81 117.35 127.74 3h3w s TYR 624 Ca -0.03 0.43 -0.03 0.00 -1.01 0.00 0.00 57.07 56.43 3h3w s TYR 624 Cb -0.20 -2.03 -0.02 0.00 -0.11 0.00 0.00 41.96 39.61 3h3w s TYR 624 CO -0.06 0.54 0.04 -1.54 -1.11 0.00 0.00 175.55 173.42 3h3w s SER 625 N -0.45 0.26 -0.12 2.29 1.04 -0.89 0.13 113.70 115.96 3h3w s SER 625 Ca 0.12 -0.63 -0.02 0.00 0.48 0.00 0.00 55.95 55.90 3h3w s SER 625 Cb -0.12 0.19 -0.03 0.00 0.10 0.00 0.00 66.02 66.17 3h3w s SER 625 CO 0.02 -0.48 -0.07 1.51 0.98 0.00 0.00 173.24 175.20 3h3w s ASP 626 N -2.15 4.59 0.96 7.02 -4.77 -1.25 0.01 116.67 121.08 3h3w s ASP 626 Ca -0.05 -0.13 -0.12 0.00 -3.30 0.00 0.00 52.55 48.95 3h3w s ASP 626 Cb -0.01 -1.55 0.16 0.00 -1.09 0.00 0.00 42.92 40.43 3h3w s ASP 626 CO -0.05 0.23 1.11 -2.84 0.70 0.00 0.00 175.17 174.32 3h3w s PRO 627 N -0.02 0.78 0.00 2.11 0.02 -1.26 -2.55 135.00 134.08 3h3w s PRO 627 Ca -0.00 0.44 0.22 0.00 0.02 0.00 0.00 61.00 61.67 3h3w s PRO 627 Cb -0.13 -1.78 0.11 0.00 0.02 0.00 0.00 34.50 32.71 3h3w s PRO 627 CO 0.03 -2.48 1.13 2.41 -0.33 0.00 0.00 177.00 177.77 3h3w n THR 628 N -3.98 0.00 -2.89 0.99 -1.04 -0.62 -4.63 114.28 102.10 3h3w n THR 628 Ca 0.06 -0.42 -0.41 0.00 -2.04 0.00 0.00 64.05 61.23 3h3w n THR 628 Cb 0.58 1.38 -0.04 0.00 -1.82 0.00 0.00 70.33 70.43 3h3w n THR 628 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 3h3w s ASP 629 N -2.00 7.11 0.00 8.00 1.11 -1.26 -4.87 116.67 124.77 3h3w s ASP 629 Ca 0.23 1.35 0.30 0.00 0.18 0.00 0.00 52.55 54.60 3h3w s ASP 629 Cb 0.18 -2.48 1.40 0.00 1.07 0.00 0.00 42.92 43.09 3h3w s ASP 629 CO 0.36 -0.24 1.94 0.47 1.18 0.00 0.00 175.17 178.89 3h3w n ASP 630 N 4.18 0.85 -3.73 0.27 8.00 -1.26 -4.70 116.55 120.17 3h3w n ASP 630 Ca 0.03 -1.25 -0.16 0.00 0.71 0.00 0.00 54.79 54.12 3h3w n ASP 630 Cb 0.51 -0.00 -0.16 0.00 -0.02 0.00 0.00 41.12 41.44 3h3w n ASP 630 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3h3w s VAL 631 N -2.03 -0.10 -0.21 2.53 1.01 -1.26 -3.97 120.40 116.37 3h3w s VAL 631 Ca 0.41 0.27 -0.10 0.00 0.00 0.00 0.00 61.98 62.57 3h3w s VAL 631 Cb 0.21 -0.18 -0.05 0.00 0.00 0.00 0.00 36.38 36.37 3h3w s VAL 631 CO 0.36 0.11 0.13 -0.63 0.00 0.00 0.00 175.10 175.07 3h3w s ILE 632 N 1.53 5.29 -0.14 2.22 -1.09 0.93 -4.95 121.20 124.99 3h3w s ILE 632 Ca -0.04 0.15 -0.05 0.00 -2.23 0.00 0.00 60.65 58.47 3h3w s ILE 632 Cb -0.12 -3.42 -0.04 0.00 -1.58 0.00 0.00 42.46 37.30 3h3w s ILE 632 CO -0.04 0.42 0.04 -0.36 -1.23 0.00 0.00 174.94 173.77 3h3w s PHE 633 N 0.53 3.24 0.00 3.97 0.08 -1.26 -0.82 117.98 123.72 3h3w s PHE 633 Ca 0.07 0.12 0.00 0.00 0.12 0.00 0.00 56.93 57.24 3h3w s PHE 633 Cb -0.12 -1.97 0.00 0.00 -0.57 0.00 0.00 43.02 40.36 3h3w s PHE 633 CO -0.00 0.29 0.00 -2.37 -0.10 0.00 0.00 175.22 173.04 3h3w n THR 634 N 2.96 0.00 0.00 0.64 5.66 -0.83 -4.59 114.28 118.13 3h3w n THR 634 Ca -0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 3h3w n THR 634 Cb 0.53 -1.74 0.00 0.00 -1.55 0.00 0.00 70.33 67.57 3h3w n THR 634 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 3h3w n ARG 635 N -0.97 0.00 -2.82 1.09 0.63 -1.22 -4.70 116.66 108.68 3h3w n ARG 635 Ca 0.00 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.50 3h3w n ARG 635 Cb 0.00 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 32.88 3h3w n ARG 635 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 3h3w s ASP 636 N -4.00 6.31 0.00 6.15 -0.00 -1.26 -3.69 116.67 120.18 3h3w s ASP 636 Ca 0.00 -1.23 0.00 0.00 -0.00 0.00 0.00 52.55 51.32 3h3w s ASP 636 Cb 0.00 -2.44 0.00 0.00 -0.00 0.00 0.00 42.92 40.48 3h3w s ASP 636 CO 0.00 -1.40 0.00 0.61 -0.00 0.00 0.00 175.17 174.38 3h3w n GLY 637 N 5.51 2.21 3.85 0.21 0.00 -1.26 -4.94 105.19 110.77 3h3w n GLY 637 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3h3w n GLY 637 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h3w s SER 638 N -3.47 6.77 -0.27 1.61 0.01 -1.24 0.70 113.70 117.81 3h3w s SER 638 Ca 0.00 1.25 -0.12 0.00 1.31 0.00 0.00 55.95 58.40 3h3w s SER 638 Cb 0.00 -2.36 0.10 0.00 0.21 0.00 0.00 66.02 63.97 3h3w s SER 638 CO 0.00 -0.18 0.62 -0.22 0.41 0.00 0.00 173.24 173.87 3h3w s LEU 639 N -2.91 -0.95 -0.37 2.44 2.96 -0.84 -3.43 118.68 115.58 3h3w s LEU 639 Ca 0.53 1.44 -0.21 0.00 -0.22 0.00 0.00 54.13 55.67 3h3w s LEU 639 Cb -0.11 2.16 0.01 0.00 0.50 0.00 0.00 46.19 48.75 3h3w s LEU 639 CO 0.18 -0.23 0.69 -0.63 -1.32 0.00 0.00 176.35 175.04 3h3w s ILE 640 N 2.34 4.83 0.14 6.68 1.01 -1.26 -1.31 121.20 133.62 3h3w s ILE 640 Ca -0.07 0.66 0.08 0.00 0.00 0.00 0.00 60.65 61.32 3h3w s ILE 640 Cb -0.09 -4.13 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 3h3w s ILE 640 CO -0.18 -0.38 -0.18 0.54 0.00 0.00 0.00 174.94 174.74 3h3w s VAL 641 N 2.86 1.68 -0.30 2.92 0.11 -1.18 -3.83 120.40 122.67 3h3w s VAL 641 Ca 0.27 -1.79 0.01 0.00 -2.93 0.00 0.00 61.98 57.54 3h3w s VAL 641 Cb -0.14 -1.70 0.09 0.00 -1.53 0.00 0.00 36.38 33.10 3h3w s VAL 641 CO 0.16 -0.28 0.05 0.12 -3.33 0.00 0.00 175.10 171.81 3h3w s PHE 642 N -1.87 2.55 -0.64 1.54 2.19 -1.26 -4.61 117.98 115.88 3h3w s PHE 642 Ca 0.12 -2.16 0.06 0.00 0.33 0.00 0.00 56.93 55.28 3h3w s PHE 642 Cb -0.06 -2.08 0.22 0.00 -1.31 0.00 0.00 43.02 39.78 3h3w s PHE 642 CO 0.05 -0.87 0.64 0.39 1.83 0.00 0.00 175.22 177.26 3h3w n GLU 643 N 4.61 2.11 0.14 10.12 -0.58 -1.26 -4.98 120.64 130.80 3h3w n GLU 643 Ca -0.02 -4.47 -0.14 0.00 -0.42 0.00 0.00 57.16 52.11 3h3w n GLU 643 Cb 0.43 -2.18 -0.08 0.00 -0.57 0.00 0.00 31.44 29.04 3h3w n GLU 643 CO 0.00 0.00 0.00 -0.97 -0.48 0.00 0.00 177.13 175.68 3h3w h ASN 644 N 4.59 -0.25 -0.90 1.62 -1.24 -1.96 0.34 115.58 117.78 3h3w h ASN 644 Ca 0.18 -0.04 0.21 0.00 0.71 0.00 0.00 56.30 57.35 3h3w h ASN 644 Cb 0.71 0.07 -0.17 0.00 0.73 0.00 0.00 38.32 39.66 3h3w h ASN 644 CO 0.76 -0.12 -0.12 -0.90 -1.29 0.00 0.00 177.43 175.76 3h3w n ASP 645 N -5.19 -0.23 -0.97 1.15 5.68 -1.26 0.37 116.55 116.11 3h3w n ASP 645 Ca -0.09 1.53 0.11 0.00 -0.50 0.00 0.00 54.79 55.84 3h3w n ASP 645 Cb 0.16 -0.51 0.13 0.00 -1.14 0.00 0.00 41.12 39.77 3h3w n ASP 645 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 3h3w n LEU 646 N -5.39 3.05 -2.76 -2.12 0.00 -0.99 -4.47 117.00 104.31 3h3w n LEU 646 Ca 0.17 -1.19 -0.09 0.00 0.00 0.00 0.00 56.01 54.90 3h3w n LEU 646 Cb 0.56 -0.09 0.08 0.00 0.00 0.00 0.00 43.42 43.97 3h3w n LEU 646 CO -0.09 0.57 0.31 -1.14 0.00 0.00 0.00 177.39 177.04 3h3w n ARG 647 N 1.31 1.07 0.06 1.96 3.00 0.12 -4.98 116.66 119.19 3h3w n ARG 647 Ca 0.15 -2.10 -0.08 0.00 -0.00 0.00 0.00 57.85 55.82 3h3w n ARG 647 Cb 0.57 -0.84 0.07 0.00 0.00 0.00 0.00 32.46 32.25 3h3w n ARG 647 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 3h3w h PRO 648 N 2.73 0.33 -0.40 -0.14 0.11 -0.27 -2.92 132.00 131.44 3h3w h PRO 648 Ca -0.13 -0.25 0.12 0.00 0.11 0.00 0.00 66.00 65.85 3h3w h PRO 648 Cb 1.14 0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3h3w h PRO 648 CO 0.13 0.88 0.78 -0.56 -0.21 0.00 0.00 178.00 179.02 3h3w h GLN 649 N 0.23 0.00 -2.06 1.05 3.07 -1.94 -2.68 115.11 112.79 3h3w h GLN 649 Ca -0.02 0.00 -0.77 0.00 0.09 0.00 0.00 58.65 57.95 3h3w h GLN 649 Cb 1.21 0.00 -0.28 0.00 0.08 0.00 0.00 27.48 28.49 3h3w h GLN 649 CO 0.11 0.00 0.99 0.66 0.09 0.00 0.00 178.83 180.68 3h3w n TYR 650 N -3.09 2.95 0.00 0.06 0.53 -1.10 -4.78 117.16 111.72 3h3w n TYR 650 Ca 0.08 -2.43 0.00 0.00 -1.02 0.00 0.00 57.90 54.53 3h3w n TYR 650 Cb 0.93 -1.15 0.00 0.00 -1.03 0.00 0.00 39.34 38.08 3h3w n TYR 650 CO 0.00 0.00 0.00 -0.11 -1.02 0.00 0.00 176.86 175.73 3h3w n LEU 651 N -0.41 0.00 -4.14 7.72 0.00 -1.01 -3.94 117.00 115.22 3h3w n LEU 651 Ca 0.51 0.00 -0.31 0.00 0.00 0.00 0.00 56.01 56.22 3h3w n LEU 651 Cb 0.25 0.00 -0.17 0.00 0.00 0.00 0.00 43.42 43.51 3h3w n LEU 651 CO 0.51 0.00 -0.53 0.42 0.00 0.00 0.00 177.39 177.78 3h3w s THR 652 N 0.00 1.86 -0.32 1.96 -4.23 -0.82 -5.00 115.64 109.08 3h3w s THR 652 Ca 0.00 -0.87 -0.07 0.00 -1.18 0.00 0.00 61.69 59.56 3h3w s THR 652 Cb 0.00 -1.65 0.02 0.00 1.34 0.00 0.00 72.50 72.21 3h3w s THR 652 CO 0.00 0.51 0.11 -0.63 -0.54 0.00 0.00 174.62 174.07 3h3w s ILE 653 N 0.74 4.02 -0.40 2.99 1.01 -1.26 -0.33 121.20 127.96 3h3w s ILE 653 Ca -0.10 -0.86 -0.11 0.00 0.00 0.00 0.00 60.65 59.58 3h3w s ILE 653 Cb -0.16 -3.17 0.05 0.00 0.01 0.00 0.00 42.46 39.19 3h3w s ILE 653 CO 0.01 -0.06 0.25 -1.81 0.00 0.00 0.00 174.94 173.34 3h3w s ASP 654 N 1.48 5.78 0.76 3.58 1.01 -0.78 -5.00 116.67 123.50 3h3w s ASP 654 Ca 0.01 -1.18 -0.11 0.00 0.71 0.00 0.00 52.55 51.97 3h3w s ASP 654 Cb -0.18 -2.04 0.06 0.00 1.01 0.00 0.00 42.92 41.76 3h3w s ASP 654 CO 0.03 -0.47 1.13 -0.76 0.21 0.00 0.00 175.17 175.32 3h3w s LEU 655 N 1.53 2.67 -0.20 1.23 1.02 -1.26 -3.17 118.68 120.49 3h3w s LEU 655 Ca 0.03 0.86 -0.08 0.00 0.02 0.00 0.00 54.13 54.95 3h3w s LEU 655 Cb -0.21 -3.46 0.09 0.00 0.02 0.00 0.00 46.19 42.63 3h3w s LEU 655 CO 0.05 -1.69 0.44 -0.70 0.02 0.00 0.00 176.35 174.48 3h3w s GLU 656 N -5.47 0.36 0.27 1.70 2.12 -1.00 -4.96 118.70 111.72 3h3w s GLU 656 Ca 0.60 1.02 -0.10 0.00 0.36 0.00 0.00 54.97 56.86 3h3w s GLU 656 Cb -0.11 0.29 -0.07 0.00 0.26 0.00 0.00 34.13 34.50 3h3w s GLU 656 CO 0.49 -0.23 0.61 -2.14 -0.54 0.00 0.00 175.26 173.45 3h3w s PRO 657 N 2.36 3.81 -0.02 4.30 0.02 -1.26 -1.16 135.00 143.04 3h3w s PRO 657 Ca -0.04 0.32 0.05 0.00 0.02 0.00 0.00 61.00 61.35 3h3w s PRO 657 Cb -0.11 -2.58 -0.01 0.00 0.02 0.00 0.00 34.50 31.82 3h3w s PRO 657 CO -0.13 0.23 -0.16 0.42 -0.33 0.00 0.00 177.00 177.03 3h3w s ILE 658 N -1.95 1.32 0.58 2.83 -1.09 0.07 -4.87 121.20 118.09 3h3w s ILE 658 Ca 0.48 -0.70 -0.20 0.00 -2.23 0.00 0.00 60.65 58.01 3h3w s ILE 658 Cb -0.11 -1.10 -0.04 0.00 -1.58 0.00 0.00 42.46 39.63 3h3w s ILE 658 CO 0.23 0.37 1.27 -0.94 -1.23 0.00 0.00 174.94 174.64 3h3w s SER 659 N -0.28 5.13 0.84 3.58 1.04 -1.26 -0.10 113.70 122.64 3h3w s SER 659 Ca 0.04 2.55 -0.11 0.00 0.48 0.00 0.00 55.95 58.91 3h3w s SER 659 Cb -0.07 -2.61 0.10 0.00 0.10 0.00 0.00 66.02 63.53 3h3w s SER 659 CO -0.00 -1.65 1.09 -1.58 0.98 0.00 0.00 173.24 172.09 3h3w s GLN 660 N -3.17 1.72 0.12 4.02 0.74 -1.26 -4.79 119.66 117.03 3h3w s GLN 660 Ca 0.76 0.79 0.09 0.00 0.05 0.00 0.00 55.36 57.05 3h3w s GLN 660 Cb -0.35 -1.86 -0.04 0.00 1.10 0.00 0.00 33.01 31.86 3h3w s GLN 660 CO 0.39 -1.91 -0.19 -1.17 -0.55 0.00 0.00 175.29 171.86 3h3w s LEU 661 N -6.00 2.67 0.00 3.68 1.98 -1.26 -4.96 118.68 114.78 3h3w s LEU 661 Ca 0.62 -0.57 0.00 0.00 -2.89 0.00 0.00 54.13 51.29 3h3w s LEU 661 Cb -0.16 -1.52 0.00 0.00 0.66 0.00 0.00 46.19 45.17 3h3w s LEU 661 CO 0.56 0.18 0.00 -0.62 -1.89 0.00 0.00 176.35 174.58 3h3w n GLU 662 N 0.83 0.00 -3.62 1.98 1.02 -1.26 -4.88 120.64 114.71 3h3w n GLU 662 Ca -0.16 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.70 3h3w n GLU 662 Cb 0.53 -0.03 -0.12 0.00 -0.02 0.00 0.00 31.44 31.79 3h3w n GLU 662 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3h3w s HIS 663 N 0.00 1.85 0.00 -0.32 2.46 -1.26 -5.03 115.29 112.99 3h3w s HIS 663 Ca 0.00 -2.45 0.00 0.00 0.47 0.00 0.00 55.06 53.08 3h3w s HIS 663 Cb 0.00 -1.63 0.00 0.00 -0.13 0.00 0.00 32.58 30.82 3h3w s HIS 663 CO 0.00 -0.76 0.00 1.58 -2.47 0.00 0.00 174.74 173.09 3h3w n HIS 664 N 3.13 0.00 0.00 3.88 -0.00 -1.26 -5.27 115.22 115.70 3h3w n HIS 664 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.89 3h3w n HIS 664 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.38 3h3w n HIS 664 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06