#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e9x s THR 343 N 0.00 0.90 0.66 2.97 -1.32 -1.26 -5.13 115.64 112.46 3e9x s THR 343 Ca 0.00 -2.00 -0.14 0.00 -1.21 0.00 0.00 61.69 58.34 3e9x s THR 343 Cb 0.00 -2.64 -0.00 0.00 -1.51 0.00 0.00 72.50 68.34 3e9x s THR 343 CO 0.00 0.00 1.08 -0.13 -2.21 0.00 0.00 174.62 173.36 3e9x s ARG 344 N -3.87 2.93 -0.14 7.08 0.52 -1.26 -4.98 118.95 119.23 3e9x s ARG 344 Ca 0.33 1.24 -0.01 0.00 -0.52 0.00 0.00 55.73 56.77 3e9x s ARG 344 Cb 0.07 -1.98 -0.02 0.00 0.52 0.00 0.00 34.95 33.54 3e9x s ARG 344 CO 0.15 -1.12 -0.10 0.08 0.02 0.00 0.00 175.30 174.33 3e9x s VAL 345 N -2.55 3.37 -0.40 3.52 1.01 -0.90 -4.99 120.40 119.46 3e9x s VAL 345 Ca 0.64 -0.55 -0.14 0.00 0.00 0.00 0.00 61.98 61.93 3e9x s VAL 345 Cb -0.18 -2.44 0.02 0.00 0.00 0.00 0.00 36.38 33.78 3e9x s VAL 345 CO 0.44 0.52 0.28 -0.69 0.00 0.00 0.00 175.10 175.64 3e9x s VAL 346 N 0.32 5.10 0.33 2.92 1.01 -1.26 -0.71 120.40 128.11 3e9x s VAL 346 Ca -0.08 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.02 3e9x s VAL 346 Cb -0.15 -3.83 -0.09 0.00 0.00 0.00 0.00 36.38 32.30 3e9x s VAL 346 CO 0.05 -0.28 0.82 0.86 0.00 0.00 0.00 175.10 176.55 3e9x s TRP 347 N 1.65 3.48 -0.27 5.22 -0.11 0.49 0.85 118.94 130.25 3e9x s TRP 347 Ca 0.04 1.45 -0.08 0.00 1.22 0.00 0.00 56.10 58.74 3e9x s TRP 347 Cb -0.19 -2.70 -0.02 0.00 -1.50 0.00 0.00 33.47 29.06 3e9x s TRP 347 CO 0.09 0.12 0.08 0.00 -4.62 0.00 0.00 176.95 172.63 3e9x s ALA 349 N 1.59 3.79 -0.47 0.00 0.00 0.07 -4.78 121.76 121.96 3e9x s ALA 349 Ca 0.05 -0.49 -0.12 0.00 0.00 0.00 0.00 51.96 51.41 3e9x s ALA 349 Cb -0.16 -2.15 0.10 0.00 0.00 0.00 0.00 23.12 20.92 3e9x s ALA 349 CO 0.04 0.52 0.36 0.08 0.00 0.00 0.00 175.76 176.75 3e9x s VAL 350 N -0.88 4.59 0.00 0.00 1.01 -1.26 -1.75 120.40 122.11 3e9x s VAL 350 Ca 0.18 -1.50 0.00 0.00 0.00 0.00 0.00 61.98 60.66 3e9x s VAL 350 Cb -0.14 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.35 3e9x s VAL 350 CO 0.07 -0.69 0.00 0.61 0.00 0.00 0.00 175.10 175.09 3e9x n GLY 351 N 5.03 1.09 0.36 4.51 0.00 -0.25 -4.37 105.19 111.57 3e9x n GLY 351 Ca -0.10 -1.89 0.01 0.00 0.00 0.00 0.00 46.02 44.03 3e9x n GLY 351 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3e9x h PRO 352 N 0.00 1.08 -0.08 1.61 0.11 -1.94 -2.46 132.00 130.32 3e9x h PRO 352 Ca 0.00 -0.06 -0.19 0.00 0.11 0.00 0.00 66.00 65.85 3e9x h PRO 352 Cb 0.00 -0.24 -0.00 0.00 0.11 0.00 0.00 31.00 30.86 3e9x h PRO 352 CO 0.00 0.71 -0.76 0.93 -0.21 0.00 0.00 178.00 178.68 3e9x h GLU 353 N 1.11 0.46 0.00 1.05 5.08 -1.95 -2.19 114.58 118.14 3e9x h GLU 353 Ca 0.33 -0.39 -0.15 0.00 -1.00 0.00 0.00 59.36 58.15 3e9x h GLU 353 Cb -0.06 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 3e9x h GLU 353 CO -0.08 1.03 -0.70 0.93 -1.00 0.00 0.00 179.01 179.18 3e9x h GLU 354 N 0.31 0.00 -0.01 2.33 5.08 -1.74 -2.44 114.58 118.11 3e9x h GLU 354 Ca -0.04 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.17 3e9x h GLU 354 Cb 1.35 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.58 3e9x h GLU 354 CO 0.13 0.70 -0.68 -0.56 -1.00 0.00 0.00 179.01 177.60 3e9x h GLN 355 N 0.00 0.08 0.07 2.33 3.07 -1.39 -0.70 115.11 118.57 3e9x h GLN 355 Ca -0.01 -0.06 -0.00 0.00 0.09 0.00 0.00 58.65 58.67 3e9x h GLN 355 Cb 1.32 0.01 0.00 0.00 0.08 0.00 0.00 27.48 28.89 3e9x h GLN 355 CO 0.09 0.73 -0.03 -0.22 0.09 0.00 0.00 178.83 179.49 3e9x h LYS 356 N 0.05 -0.09 -0.40 0.06 3.64 -1.21 -1.19 116.57 117.43 3e9x h LYS 356 Ca -0.01 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 3e9x h LYS 356 Cb 1.21 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.03 3e9x h LYS 356 CO 0.09 0.25 0.17 -0.22 -2.27 0.00 0.00 179.45 177.47 3e9x h LYS 357 N -0.44 0.56 -0.47 1.90 3.64 -1.40 -2.63 116.57 117.72 3e9x h LYS 357 Ca -0.01 -0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 59.20 3e9x h LYS 357 Cb 0.38 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 3e9x h LYS 357 CO 0.02 0.46 -0.09 0.00 -2.27 0.00 0.00 179.45 177.56 3e9x h GLN 359 N 0.74 0.28 -0.22 0.00 4.20 -0.87 0.16 115.11 119.41 3e9x h GLN 359 Ca 0.12 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.73 3e9x h GLN 359 Cb 0.63 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 3e9x h GLN 359 CO 0.04 0.37 -0.04 1.96 -0.67 0.00 0.00 178.83 180.49 3e9x h GLN 360 N 0.28 0.41 -0.97 1.46 4.20 -1.25 -0.28 115.11 118.95 3e9x h GLN 360 Ca 0.06 -0.15 0.01 0.00 0.06 0.00 0.00 58.65 58.63 3e9x h GLN 360 Cb 0.30 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.00 3e9x h GLN 360 CO 0.01 0.64 0.64 2.35 -0.67 0.00 0.00 178.83 181.81 3e9x h TRP 361 N 0.15 1.23 -0.08 2.96 7.01 -0.74 -0.63 115.95 125.85 3e9x h TRP 361 Ca 0.06 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.08 3e9x h TRP 361 Cb 0.48 -0.41 -0.00 0.00 -2.10 0.00 0.00 29.16 27.12 3e9x h TRP 361 CO 0.05 0.77 0.03 1.03 -2.79 0.00 0.00 178.44 177.53 3e9x h SER 362 N 1.32 0.11 -0.33 2.65 0.87 -0.54 -1.88 113.55 115.75 3e9x h SER 362 Ca 0.36 -0.19 0.07 0.00 -1.23 0.00 0.00 61.79 60.80 3e9x h SER 362 Cb -0.15 -0.03 -0.08 0.00 -0.44 0.00 0.00 62.40 61.70 3e9x h SER 362 CO -0.08 0.27 -0.29 -0.61 -0.53 0.00 0.00 176.83 175.59 3e9x h GLN 363 N -0.05 -0.24 0.00 2.24 4.15 -0.35 -1.85 115.11 119.01 3e9x h GLN 363 Ca 0.03 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.46 3e9x h GLN 363 Cb 0.19 0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.94 3e9x h GLN 363 CO -0.00 -0.16 0.00 1.96 -1.93 0.00 0.00 178.83 178.70 3e9x h GLN 364 N -0.25 0.00 -0.02 1.69 1.08 -1.08 -3.11 115.11 113.42 3e9x h GLN 364 Ca 0.16 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.36 3e9x h GLN 364 Cb 0.51 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 3e9x h GLN 364 CO -0.48 0.00 -0.06 -1.13 -0.95 0.00 0.00 178.83 176.22 3e9x n SER 365 N -2.77 1.63 -1.54 1.46 3.41 -0.71 -4.91 113.62 110.18 3e9x n SER 365 Ca 0.02 -1.46 -0.11 0.00 -0.26 0.00 0.00 58.87 57.06 3e9x n SER 365 Cb 0.31 0.04 0.01 0.00 -0.26 0.00 0.00 64.21 64.31 3e9x n SER 365 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3e9x n GLY 366 N 1.23 0.04 2.48 5.00 0.00 -1.11 -2.22 105.19 110.61 3e9x n GLY 366 Ca 0.17 -0.35 -0.18 0.00 0.00 0.00 0.00 46.02 45.65 3e9x n GLY 366 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3e9x n GLN 367 N -2.31 -1.34 0.21 1.61 1.13 -0.84 -4.82 117.38 111.01 3e9x n GLN 367 Ca -0.07 1.07 0.09 0.00 -1.94 0.00 0.00 57.00 56.15 3e9x n GLN 367 Cb 0.57 -5.43 0.37 0.00 0.11 0.00 0.00 30.24 25.86 3e9x n GLN 367 CO 0.00 0.00 0.00 -0.91 -1.44 0.00 0.00 177.06 174.71 3e9x h ASN 368 N 0.00 0.00 -3.53 1.08 2.35 -1.68 -3.41 115.58 110.39 3e9x h ASN 368 Ca -0.40 0.00 -0.50 0.00 -0.55 0.00 0.00 56.30 54.85 3e9x h ASN 368 Cb 1.24 0.00 -0.33 0.00 0.05 0.00 0.00 38.32 39.28 3e9x h ASN 368 CO 0.54 0.26 -0.81 -0.69 -1.65 0.00 0.00 177.43 175.08 3e9x s VAL 369 N -3.50 1.10 0.26 2.81 1.01 -1.26 -2.12 120.40 118.69 3e9x s VAL 369 Ca 0.02 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.55 3e9x s VAL 369 Cb 0.09 -1.00 -0.06 0.00 0.00 0.00 0.00 36.38 35.42 3e9x s VAL 369 CO 0.66 0.34 0.01 0.28 0.00 0.00 0.00 175.10 176.39 3e9x s THR 370 N 0.53 1.09 0.26 3.92 -1.32 0.11 -4.09 115.64 116.15 3e9x s THR 370 Ca -0.12 -2.03 0.10 0.00 -1.21 0.00 0.00 61.69 58.43 3e9x s THR 370 Cb -0.14 -2.48 -0.04 0.00 -1.51 0.00 0.00 72.50 68.32 3e9x s THR 370 CO 0.03 -0.22 -0.05 0.00 -2.21 0.00 0.00 174.62 172.17 3e9x s ALA 372 N -2.33 0.84 0.05 0.00 0.00 -0.09 -4.87 121.76 115.36 3e9x s ALA 372 Ca 0.31 -1.04 0.04 0.00 0.00 0.00 0.00 51.96 51.27 3e9x s ALA 372 Cb -0.06 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 23.10 3e9x s ALA 372 CO 0.19 -0.07 -0.11 0.99 0.00 0.00 0.00 175.76 176.76 3e9x s THR 373 N -2.23 0.83 0.02 0.00 2.01 -1.26 -0.75 115.64 114.26 3e9x s THR 373 Ca -0.00 -1.14 -0.12 0.00 0.31 0.00 0.00 61.69 60.74 3e9x s THR 373 Cb -0.04 -0.83 0.01 0.00 0.01 0.00 0.00 72.50 71.65 3e9x s THR 373 CO -0.01 -0.27 0.26 0.00 -0.69 0.00 0.00 174.62 173.91 3e9x s ALA 374 N -1.25 -0.59 -2.12 7.40 0.00 -0.72 -4.95 121.76 119.54 3e9x s ALA 374 Ca -0.05 0.01 0.21 0.00 0.00 0.00 0.00 51.96 52.14 3e9x s ALA 374 Cb -0.10 0.21 1.09 0.00 0.00 0.00 0.00 23.12 24.32 3e9x s ALA 374 CO 0.01 -0.33 1.72 0.43 0.00 0.00 0.00 175.76 177.60 3e9x n SER 375 N 0.92 0.60 -3.64 0.00 7.64 -1.26 -1.09 113.62 116.79 3e9x n SER 375 Ca -0.20 -1.47 -0.15 0.00 1.01 0.00 0.00 58.87 58.06 3e9x n SER 375 Cb 0.58 -0.03 -0.07 0.00 -1.01 0.00 0.00 64.21 63.67 3e9x n SER 375 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3e9x s THR 376 N -1.94 0.03 0.16 0.44 2.01 -1.26 -4.61 115.64 110.47 3e9x s THR 376 Ca 0.32 -0.25 -0.12 0.00 0.31 0.00 0.00 61.69 61.94 3e9x s THR 376 Cb 0.16 -0.82 0.05 0.00 0.01 0.00 0.00 72.50 71.90 3e9x s THR 376 CO 0.25 -0.14 1.68 0.74 -0.69 0.00 0.00 174.62 176.47 3e9x h THR 377 N 3.38 1.24 -0.68 -0.82 2.02 -1.89 -1.38 112.91 114.78 3e9x h THR 377 Ca -0.29 -0.81 0.06 0.00 0.77 0.00 0.00 66.41 66.14 3e9x h THR 377 Cb 1.16 0.73 -0.06 0.00 -1.74 0.00 0.00 68.15 68.24 3e9x h THR 377 CO 0.40 0.30 0.37 0.44 0.37 0.00 0.00 175.52 177.40 3e9x h ASP 378 N 0.77 0.54 -0.32 4.18 3.32 -1.96 -0.37 116.42 122.58 3e9x h ASP 378 Ca 0.18 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.27 3e9x h ASP 378 Cb 0.29 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 3e9x h ASP 378 CO -0.00 0.34 0.20 0.44 -1.72 0.00 0.00 179.24 178.50 3e9x h ASP 379 N 0.68 0.34 -0.23 6.45 5.19 -1.87 -1.60 116.42 125.37 3e9x h ASP 379 Ca 0.31 -0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.71 3e9x h ASP 379 Cb 0.22 -0.08 -0.01 0.00 0.18 0.00 0.00 39.33 39.63 3e9x h ASP 379 CO -0.20 0.24 0.12 0.00 -3.12 0.00 0.00 179.24 176.29 3e9x h ILE 381 N 0.37 1.25 -0.42 0.00 1.08 -0.31 -2.56 117.51 116.92 3e9x h ILE 381 Ca 0.10 -0.91 -0.00 0.00 -0.39 0.00 0.00 64.86 63.65 3e9x h ILE 381 Cb 0.05 1.14 -0.02 0.00 -3.07 0.00 0.00 36.82 34.92 3e9x h ILE 381 CO -0.01 0.31 0.24 0.58 -0.69 0.00 0.00 178.15 178.57 3e9x h VAL 382 N 0.45 1.14 -0.54 1.67 2.07 -0.37 -2.12 116.25 118.55 3e9x h VAL 382 Ca 0.11 -0.35 0.09 0.00 0.82 0.00 0.00 66.70 67.36 3e9x h VAL 382 Cb 0.41 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 3e9x h VAL 382 CO 0.01 0.15 0.36 -0.07 0.02 0.00 0.00 177.57 178.04 3e9x h LEU 383 N 0.55 0.34 -0.59 2.57 3.38 -0.99 -0.01 115.31 120.56 3e9x h LEU 383 Ca 0.15 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 3e9x h LEU 383 Cb 0.02 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3e9x h LEU 383 CO -0.03 0.21 -0.49 0.58 0.09 0.00 0.00 178.44 178.80 3e9x h VAL 384 N 0.38 1.01 0.03 1.22 2.07 -0.98 0.96 116.25 120.94 3e9x h VAL 384 Ca 0.25 -1.94 -0.17 0.00 0.82 0.00 0.00 66.70 65.65 3e9x h VAL 384 Cb 0.48 2.17 0.02 0.00 -1.52 0.00 0.00 31.29 32.43 3e9x h VAL 384 CO -0.06 0.48 -0.69 -0.07 0.02 0.00 0.00 177.57 177.25 3e9x h LEU 385 N 0.00 0.56 -2.01 2.57 3.38 -0.56 -3.08 115.31 116.16 3e9x h LEU 385 Ca -0.00 -0.80 -0.01 0.00 0.09 0.00 0.00 57.88 57.16 3e9x h LEU 385 Cb 1.13 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 3e9x h LEU 385 CO 0.06 1.29 -0.06 0.11 0.09 0.00 0.00 178.44 179.93 3e9x h LYS 386 N -0.11 0.00 0.00 1.13 1.57 -1.13 -3.46 116.57 114.57 3e9x h LYS 386 Ca -0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3e9x h LYS 386 Cb 1.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.73 3e9x h LYS 386 CO 0.13 0.06 0.00 0.41 -0.57 0.00 0.00 179.45 179.48 3e9x n GLY 387 N -0.52 0.82 0.03 3.86 0.00 -0.82 -4.94 105.19 103.61 3e9x n GLY 387 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.15 3e9x n GLY 387 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3e9x n GLU 388 N -2.26 0.26 -3.94 1.61 1.02 0.27 -4.80 120.64 112.80 3e9x n GLU 388 Ca 0.00 -0.06 -0.08 0.00 -0.02 0.00 0.00 57.16 57.00 3e9x n GLU 388 Cb 0.00 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 29.84 3e9x n GLU 388 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3e9x s ALA 389 N -2.78 0.03 -0.23 0.62 0.00 -0.96 -4.94 121.76 113.49 3e9x s ALA 389 Ca 0.20 -0.77 -0.13 0.00 0.00 0.00 0.00 51.96 51.26 3e9x s ALA 389 Cb 0.19 0.36 -0.10 0.00 0.00 0.00 0.00 23.12 23.57 3e9x s ALA 389 CO 0.53 -0.42 -0.32 -0.25 0.00 0.00 0.00 175.76 175.30 3e9x n ASP 390 N 0.21 1.77 -3.72 0.00 8.00 0.25 -4.30 116.55 118.76 3e9x n ASP 390 Ca -0.16 0.30 -0.13 0.00 0.71 0.00 0.00 54.79 55.52 3e9x n ASP 390 Cb 0.61 -0.73 -0.07 0.00 -0.02 0.00 0.00 41.12 40.92 3e9x n ASP 390 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3e9x s ALA 391 N -2.51 0.78 -0.20 2.24 0.00 -1.11 -4.22 121.76 116.74 3e9x s ALA 391 Ca -0.33 -1.49 -0.30 0.00 0.00 0.00 0.00 51.96 49.84 3e9x s ALA 391 Cb 0.12 1.24 0.15 0.00 0.00 0.00 0.00 23.12 24.63 3e9x s ALA 391 CO 0.43 -0.73 1.10 -0.48 0.00 0.00 0.00 175.76 176.07 3e9x s LEU 392 N -3.18 -0.28 0.02 0.00 2.34 -1.15 -0.99 118.68 115.44 3e9x s LEU 392 Ca 0.32 0.31 -0.23 0.00 0.06 0.00 0.00 54.13 54.59 3e9x s LEU 392 Cb 0.02 1.65 -0.05 0.00 -0.56 0.00 0.00 46.19 47.25 3e9x s LEU 392 CO 0.16 -0.25 0.69 0.21 -1.06 0.00 0.00 176.35 176.10 3e9x s ASN 393 N -1.05 7.11 0.15 1.48 2.47 -1.26 -1.18 114.94 122.66 3e9x s ASN 393 Ca 0.01 1.32 0.05 0.00 0.42 0.00 0.00 52.86 54.66 3e9x s ASN 393 Cb -0.01 -2.42 -0.04 0.00 -1.45 0.00 0.00 41.25 37.32 3e9x s ASN 393 CO -0.01 0.05 -0.10 -0.76 -3.72 0.00 0.00 177.10 172.55 3e9x s LEU 394 N -0.08 2.53 0.38 3.21 1.43 0.25 -4.93 118.68 121.46 3e9x s LEU 394 Ca 0.35 -1.02 -0.12 0.00 -1.03 0.00 0.00 54.13 52.32 3e9x s LEU 394 Cb -0.19 -0.36 -0.07 0.00 0.03 0.00 0.00 46.19 45.59 3e9x s LEU 394 CO 0.20 -0.33 0.76 -0.62 0.23 0.00 0.00 176.35 176.60 3e9x s ASP 395 N -3.18 6.61 0.30 2.29 2.15 -1.26 -0.41 116.67 123.17 3e9x s ASP 395 Ca 0.17 1.19 0.05 0.00 0.43 0.00 0.00 52.55 54.39 3e9x s ASP 395 Cb 0.02 -2.34 0.78 0.00 -0.30 0.00 0.00 42.92 41.08 3e9x s ASP 395 CO 0.01 -0.33 1.66 1.23 -0.17 0.00 0.00 175.17 177.57 3e9x h GLY 396 N 1.61 1.53 0.96 2.66 0.00 -1.82 -0.32 103.07 107.70 3e9x h GLY 396 Ca -0.47 -0.11 0.09 0.00 0.00 0.00 0.00 47.33 46.84 3e9x h GLY 396 CO 0.64 -0.36 0.46 -1.33 0.00 0.00 0.00 176.54 175.96 3e9x h GLY 397 N 0.28 0.85 1.20 4.60 0.00 -1.89 -1.95 103.07 106.17 3e9x h GLY 397 Ca 0.59 -0.25 -0.31 0.00 0.00 0.00 0.00 47.33 47.35 3e9x h GLY 397 CO -0.61 0.16 -1.56 -0.97 0.00 0.00 0.00 176.54 173.56 3e9x h TYR 398 N 0.62 0.50 -0.61 5.60 0.05 -1.26 -3.22 116.97 118.65 3e9x h TYR 398 Ca 0.32 -0.36 0.18 0.00 0.05 0.00 0.00 58.73 58.91 3e9x h TYR 398 Cb 0.43 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.13 3e9x h TYR 398 CO -0.00 1.42 0.51 0.82 -1.05 0.00 0.00 178.16 179.86 3e9x h ILE 399 N 0.07 0.51 0.09 -2.88 1.08 -0.48 0.42 117.51 116.32 3e9x h ILE 399 Ca -0.26 0.00 -0.25 0.00 -0.39 0.00 0.00 64.86 63.96 3e9x h ILE 399 Cb 2.03 0.63 -0.00 0.00 -3.07 0.00 0.00 36.82 36.40 3e9x h ILE 399 CO 0.17 0.00 -1.16 0.22 -0.69 0.00 0.00 178.15 176.69 3e9x h TYR 400 N 0.00 0.39 0.07 1.37 3.20 -1.42 -1.60 116.97 118.97 3e9x h TYR 400 Ca 0.29 -0.27 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 3e9x h TYR 400 Cb 1.30 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.55 3e9x h TYR 400 CO 0.00 1.20 -0.03 1.15 -1.64 0.00 0.00 178.16 178.84 3e9x h THR 401 N 0.07 1.22 -0.48 1.81 2.02 -0.34 -3.05 112.91 114.15 3e9x h THR 401 Ca -0.10 -1.14 -0.03 0.00 0.77 0.00 0.00 66.41 65.91 3e9x h THR 401 Cb 1.89 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 70.22 3e9x h THR 401 CO 0.18 0.28 0.18 0.00 0.37 0.00 0.00 175.52 176.53 3e9x h ALA 402 N 0.23 1.42 -0.86 6.16 0.00 -0.84 -2.70 119.26 122.67 3e9x h ALA 402 Ca -0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3e9x h ALA 402 Cb 0.52 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 3e9x h ALA 402 CO 0.02 0.44 0.43 0.78 0.00 0.00 0.00 179.25 180.91 3e9x h GLY 403 N 0.84 1.31 2.00 0.00 0.00 -1.31 -0.90 103.07 105.00 3e9x h GLY 403 Ca 0.16 -0.63 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 3e9x h GLY 403 CO -0.01 0.60 -0.00 0.50 0.00 0.00 0.00 176.54 177.63 3e9x h LYS 404 N 1.22 0.00 -0.42 4.80 1.79 -1.37 -0.44 116.57 122.15 3e9x h LYS 404 Ca 0.30 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.77 3e9x h LYS 404 Cb 0.09 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.74 3e9x h LYS 404 CO -0.04 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.33 3e9x n GLY 406 N 0.10 0.83 3.83 0.00 0.00 -0.17 -5.05 105.19 104.73 3e9x n GLY 406 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 3e9x n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3e9x s LEU 407 N 0.00 3.21 0.02 0.99 1.43 -0.55 -4.03 118.68 119.75 3e9x s LEU 407 Ca 0.00 1.57 0.03 0.00 -1.03 0.00 0.00 54.13 54.70 3e9x s LEU 407 Cb 0.00 -4.49 -0.01 0.00 0.03 0.00 0.00 46.19 41.71 3e9x s LEU 407 CO 0.00 -1.21 -0.10 0.68 0.23 0.00 0.00 176.35 175.95 3e9x s VAL 408 N -3.02 0.76 0.31 -1.59 -7.23 0.45 -4.29 120.40 105.79 3e9x s VAL 408 Ca 0.58 -0.67 -0.29 0.00 -1.81 0.00 0.00 61.98 59.78 3e9x s VAL 408 Cb -0.13 -0.69 -0.10 0.00 0.56 0.00 0.00 36.38 36.02 3e9x s VAL 408 CO 0.52 0.03 1.28 -2.16 -0.31 0.00 0.00 175.10 174.46 3e9x s PRO 409 N -0.73 4.40 -0.08 4.82 0.04 -1.26 -2.26 135.00 139.92 3e9x s PRO 409 Ca 0.00 2.14 -0.04 0.00 0.04 0.00 0.00 61.00 63.14 3e9x s PRO 409 Cb -0.06 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 31.34 3e9x s PRO 409 CO 0.00 -0.14 -0.11 0.28 0.04 0.00 0.00 177.00 177.07 3e9x n VAL 410 N 1.10 0.47 -3.86 -0.36 0.31 0.12 -4.95 118.33 111.17 3e9x n VAL 410 Ca 0.01 -0.11 -0.11 0.00 -0.01 0.00 0.00 64.34 64.11 3e9x n VAL 410 Cb 0.42 -1.62 -0.10 0.00 -0.91 0.00 0.00 33.84 31.64 3e9x n VAL 410 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3e9x s LEU 411 N -6.46 1.48 0.24 7.52 1.43 -1.23 -4.26 118.68 117.40 3e9x s LEU 411 Ca -0.12 -0.13 0.10 0.00 -1.03 0.00 0.00 54.13 52.96 3e9x s LEU 411 Cb 0.04 0.70 -0.04 0.00 0.03 0.00 0.00 46.19 46.93 3e9x s LEU 411 CO 0.15 -0.34 -0.08 0.00 0.23 0.00 0.00 176.35 176.31 3e9x s ALA 412 N -1.21 3.00 0.48 4.21 0.00 -0.85 0.30 121.76 127.68 3e9x s ALA 412 Ca -0.13 -1.63 -0.20 0.00 0.00 0.00 0.00 51.96 49.99 3e9x s ALA 412 Cb -0.07 -0.66 -0.09 0.00 0.00 0.00 0.00 23.12 22.31 3e9x s ALA 412 CO 0.02 0.34 1.01 -1.21 0.00 0.00 0.00 175.76 175.92 3e9x s GLU 413 N -3.34 3.91 -0.02 0.00 2.02 -0.29 0.27 118.70 121.24 3e9x s GLU 413 Ca 0.29 1.27 -0.00 0.00 0.02 0.00 0.00 54.97 56.55 3e9x s GLU 413 Cb -0.07 -2.12 0.03 0.00 0.10 0.00 0.00 34.13 32.07 3e9x s GLU 413 CO 0.17 -0.33 0.02 1.21 0.02 0.00 0.00 175.26 176.36 3e9x s ASN 414 N -2.11 0.27 0.17 -0.19 3.04 -0.26 -4.77 114.94 111.09 3e9x s ASN 414 Ca 0.65 0.02 0.02 0.00 0.04 0.00 0.00 52.86 53.59 3e9x s ASN 414 Cb -0.14 -0.12 0.02 0.00 -1.54 0.00 0.00 41.25 39.46 3e9x s ASN 414 CO 0.19 -0.13 0.14 -2.11 -3.04 0.00 0.00 177.10 172.15 3e9x n ARG 415 N 4.27 1.21 -1.96 0.43 1.85 -1.26 0.71 116.66 121.90 3e9x n ARG 415 Ca -0.25 -1.06 -0.41 0.00 -1.00 0.00 0.00 57.85 55.13 3e9x n ARG 415 Cb 0.50 0.10 -0.01 0.00 -1.05 0.00 0.00 32.46 32.00 3e9x n ARG 415 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3e9x s LYS 416 N -2.71 4.23 0.00 2.89 3.01 -1.26 -4.80 119.74 121.10 3e9x s LYS 416 Ca 0.11 2.39 0.00 0.00 -1.01 0.00 0.00 55.97 57.46 3e9x s LYS 416 Cb -0.01 -3.02 0.00 0.00 -1.01 0.00 0.00 37.83 33.79 3e9x s LYS 416 CO 0.07 -0.36 0.00 -1.13 0.51 0.00 0.00 175.35 174.44 3e9x n SER 417 N 0.70 0.02 0.00 2.83 3.41 -1.26 -5.10 113.62 114.22 3e9x n SER 417 Ca 0.01 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.28 3e9x n SER 417 Cb 0.40 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 3e9x n SER 417 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3e9x n SER 418 N -1.01 0.58 -4.77 4.04 2.88 -1.26 -5.07 113.62 109.02 3e9x n SER 418 Ca 0.00 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.20 3e9x n SER 418 Cb 0.00 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 63.50 3e9x n SER 418 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 3e9x s LYS 419 N -1.62 2.89 -1.10 -1.46 2.20 -1.26 -3.79 119.74 115.59 3e9x s LYS 419 Ca 0.00 1.50 -0.05 0.00 -0.36 0.00 0.00 55.97 57.05 3e9x s LYS 419 Cb 0.00 -1.95 -0.05 0.00 -1.51 0.00 0.00 37.83 34.32 3e9x s LYS 419 CO 0.00 -1.20 0.92 0.72 -0.36 0.00 0.00 175.35 175.43 3e9x n HIS 420 N -2.12 -2.33 0.13 4.03 8.25 -1.26 -4.95 115.22 116.96 3e9x n HIS 420 Ca 0.11 0.85 -0.14 0.00 -0.26 0.00 0.00 57.72 58.28 3e9x n HIS 420 Cb 0.51 -4.31 -0.08 0.00 1.12 0.00 0.00 29.99 27.23 3e9x n HIS 420 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 3e9x h SER 421 N -1.38 -0.23 0.83 0.41 0.02 -1.99 -3.07 113.55 108.15 3e9x h SER 421 Ca -0.61 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.27 3e9x h SER 421 Cb 1.32 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.92 3e9x h SER 421 CO 0.46 -0.07 0.00 0.77 -1.14 0.00 0.00 176.83 176.85 3e9x h SER 422 N -0.38 0.00 -3.57 3.07 4.64 -1.93 -3.44 113.55 111.94 3e9x h SER 422 Ca -0.03 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.77 3e9x h SER 422 Cb 0.29 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.43 3e9x h SER 422 CO 0.05 0.00 0.65 -0.76 -0.87 0.00 0.00 176.83 175.90 3e9x s LEU 423 N -6.10 4.43 0.87 5.97 1.02 -1.16 -5.00 118.68 118.70 3e9x s LEU 423 Ca 0.00 2.52 -0.11 0.00 0.02 0.00 0.00 54.13 56.56 3e9x s LEU 423 Cb 0.10 -3.63 0.11 0.00 0.02 0.00 0.00 46.19 42.80 3e9x s LEU 423 CO 0.51 -0.53 1.10 -0.62 0.02 0.00 0.00 176.35 176.83 3e9x s ASP 424 N -0.00 3.60 0.15 2.29 2.15 -1.26 -4.79 116.67 118.80 3e9x s ASP 424 Ca 0.54 1.74 -0.13 0.00 0.43 0.00 0.00 52.55 55.13 3e9x s ASP 424 Cb -0.38 -2.38 0.02 0.00 -0.30 0.00 0.00 42.92 39.88 3e9x s ASP 424 CO 0.44 -2.60 1.63 0.00 -0.17 0.00 0.00 175.17 174.47 3e9x h VAL 426 N 0.67 0.43 0.00 0.00 2.07 -1.93 -3.11 116.25 114.39 3e9x h VAL 426 Ca 0.15 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.92 3e9x h VAL 426 Cb 0.39 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3e9x h VAL 426 CO 0.01 0.14 -1.63 0.18 0.02 0.00 0.00 177.57 176.28 3e9x n LEU 427 N -3.41 0.26 -4.75 2.57 4.77 -1.16 -0.88 117.00 114.41 3e9x n LEU 427 Ca -0.01 -0.14 -0.41 0.00 -0.03 0.00 0.00 56.01 55.42 3e9x n LEU 427 Cb 0.32 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.38 3e9x n LEU 427 CO 0.30 0.06 0.97 -0.60 -1.33 0.00 0.00 177.39 176.80 3e9x s ARG 428 N -3.23 4.40 0.74 3.23 3.52 -0.25 -4.95 118.95 122.41 3e9x s ARG 428 Ca -0.03 2.09 -0.15 0.00 -0.13 0.00 0.00 55.73 57.51 3e9x s ARG 428 Cb 0.13 -3.16 0.05 0.00 -1.56 0.00 0.00 34.95 30.41 3e9x s ARG 428 CO 0.82 -0.20 1.20 -2.14 -0.81 0.00 0.00 175.30 174.17 3e9x s PRO 429 N -0.68 2.06 0.07 5.12 0.02 -1.26 -4.91 135.00 135.43 3e9x s PRO 429 Ca 0.54 1.73 -0.25 0.00 0.02 0.00 0.00 61.00 63.04 3e9x s PRO 429 Cb -0.37 -1.83 -0.06 0.00 0.02 0.00 0.00 34.50 32.26 3e9x s PRO 429 CO 0.42 -1.89 0.77 0.95 -0.33 0.00 0.00 177.00 176.93 3e9x s THR 430 N -2.05 4.66 -0.87 0.99 -4.23 -1.26 -4.97 115.64 107.90 3e9x s THR 430 Ca 0.73 1.65 0.26 0.00 -1.18 0.00 0.00 61.69 63.15 3e9x s THR 430 Cb -0.28 -4.12 0.08 0.00 1.34 0.00 0.00 72.50 69.51 3e9x s THR 430 CO 0.46 0.39 1.51 -0.62 -0.54 0.00 0.00 174.62 175.82 3e9x n GLU 431 N 2.57 0.11 -0.14 3.99 1.02 -1.26 -5.03 120.64 121.89 3e9x n GLU 431 Ca -0.03 0.04 0.02 0.00 -0.02 0.00 0.00 57.16 57.17 3e9x n GLU 431 Cb 0.50 -1.58 -0.01 0.00 -0.02 0.00 0.00 31.44 30.34 3e9x n GLU 431 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3e9x n GLY 432 N 1.44 -1.82 3.33 0.62 0.00 -1.26 -5.01 105.19 102.49 3e9x n GLY 432 Ca 0.05 -1.47 -0.18 0.00 0.00 0.00 0.00 46.02 44.42 3e9x n GLY 432 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3e9x s TYR 433 N -1.85 1.61 -0.29 1.61 -0.85 0.21 -4.88 117.35 112.91 3e9x s TYR 433 Ca 0.00 -0.68 -0.16 0.00 -0.52 0.00 0.00 57.07 55.71 3e9x s TYR 433 Cb 0.00 -0.82 -0.03 0.00 0.38 0.00 0.00 41.96 41.49 3e9x s TYR 433 CO 0.00 0.23 0.41 -0.51 -1.52 0.00 0.00 175.55 174.16 3e9x s LEU 434 N -3.30 4.12 -0.09 -3.49 1.43 -1.26 0.14 118.68 116.24 3e9x s LEU 434 Ca 0.23 0.22 -0.24 0.00 -1.03 0.00 0.00 54.13 53.31 3e9x s LEU 434 Cb 0.02 -2.47 -0.03 0.00 0.03 0.00 0.00 46.19 43.73 3e9x s LEU 434 CO 0.06 -0.26 0.75 0.00 0.23 0.00 0.00 176.35 177.13 3e9x s ALA 435 N 2.14 3.38 0.23 4.21 0.00 -0.11 -0.40 121.76 131.21 3e9x s ALA 435 Ca 0.16 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.25 3e9x s ALA 435 Cb -0.16 -3.05 -0.05 0.00 0.00 0.00 0.00 23.12 19.86 3e9x s ALA 435 CO 0.10 -0.27 0.06 0.14 0.00 0.00 0.00 175.76 175.80 3e9x s VAL 436 N 1.19 0.63 -0.15 0.00 -7.23 -0.66 -0.70 120.40 113.49 3e9x s VAL 436 Ca 0.38 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.58 3e9x s VAL 436 Cb -0.18 -2.48 0.01 0.00 0.56 0.00 0.00 36.38 34.30 3e9x s VAL 436 CO 0.17 -0.15 -0.21 0.00 -0.31 0.00 0.00 175.10 174.60 3e9x s ALA 437 N -3.70 2.23 0.14 1.32 0.00 -1.26 -2.82 121.76 117.67 3e9x s ALA 437 Ca 0.33 -1.10 0.09 0.00 0.00 0.00 0.00 51.96 51.28 3e9x s ALA 437 Cb 0.07 -1.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.12 3e9x s ALA 437 CO 0.11 -0.12 -0.14 0.08 0.00 0.00 0.00 175.76 175.69 3e9x s VAL 438 N 0.96 3.04 0.26 0.00 1.01 -0.63 -1.02 120.40 124.01 3e9x s VAL 438 Ca -0.04 -1.54 -0.07 0.00 0.00 0.00 0.00 61.98 60.34 3e9x s VAL 438 Cb -0.15 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 3e9x s VAL 438 CO -0.05 0.02 0.37 0.68 0.00 0.00 0.00 175.10 176.12 3e9x s VAL 439 N -1.37 0.00 0.24 2.92 -7.23 -0.41 -1.79 120.40 112.75 3e9x s VAL 439 Ca 0.21 -1.64 -0.24 0.00 -1.81 0.00 0.00 61.98 58.50 3e9x s VAL 439 Cb -0.10 -2.39 -0.09 0.00 0.56 0.00 0.00 36.38 34.36 3e9x s VAL 439 CO 0.13 0.00 0.82 -0.54 -0.31 0.00 0.00 175.10 175.20 3e9x s LYS 440 N -3.84 4.50 0.26 4.82 -0.14 -1.26 -1.41 119.74 122.66 3e9x s LYS 440 Ca 0.29 1.14 -0.03 0.00 -1.36 0.00 0.00 55.97 56.02 3e9x s LYS 440 Cb 0.02 -3.01 0.33 0.00 -1.68 0.00 0.00 37.83 33.49 3e9x s LYS 440 CO 0.13 0.43 1.78 -0.22 -0.76 0.00 0.00 175.35 176.70 3e9x h LYS 441 N 3.69 0.86 0.00 1.68 3.64 -1.14 -2.27 116.57 123.02 3e9x h LYS 441 Ca -0.47 -0.21 -0.00 0.00 -1.27 0.00 0.00 60.65 58.70 3e9x h LYS 441 Cb 1.20 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.90 3e9x h LYS 441 CO 0.66 0.81 -0.00 0.00 -2.27 0.00 0.00 179.45 178.64 3e9x h ALA 442 N 1.27 1.11 -0.27 5.00 0.00 -1.93 -3.21 119.26 121.23 3e9x h ALA 442 Ca 0.17 -0.00 -0.70 0.00 0.00 0.00 0.00 54.91 54.37 3e9x h ALA 442 Cb 0.38 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 3e9x h ALA 442 CO 0.01 0.00 3.17 -1.71 0.00 0.00 0.00 179.25 180.73 3e9x n ASN 443 N -3.24 7.49 -4.59 0.00 2.85 -0.85 -4.96 115.26 111.95 3e9x n ASN 443 Ca -0.03 -2.82 -0.36 0.00 -0.11 0.00 0.00 54.58 51.25 3e9x n ASN 443 Cb 0.09 -1.51 0.07 0.00 1.24 0.00 0.00 39.78 39.67 3e9x n ASN 443 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 3e9x n GLU 444 N 3.46 0.58 0.00 1.20 1.02 -1.21 -2.85 120.64 122.83 3e9x n GLU 444 Ca 0.66 0.25 0.00 0.00 -0.02 0.00 0.00 57.16 58.05 3e9x n GLU 444 Cb 0.27 -2.15 0.00 0.00 -0.02 0.00 0.00 31.44 29.54 3e9x n GLU 444 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3e9x n GLY 445 N 1.24 2.80 3.60 0.62 0.00 -1.26 -4.98 105.19 107.20 3e9x n GLY 445 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 3e9x n GLY 445 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3e9x s LEU 446 N 0.00 3.96 0.00 0.99 2.96 -1.13 -4.90 118.68 120.56 3e9x s LEU 446 Ca 0.00 0.50 0.02 0.00 -0.22 0.00 0.00 54.13 54.43 3e9x s LEU 446 Cb 0.00 -3.29 -0.01 0.00 0.50 0.00 0.00 46.19 43.40 3e9x s LEU 446 CO 0.00 -0.93 0.06 0.35 -1.32 0.00 0.00 176.35 174.51 3e9x n THR 447 N 6.13 0.00 0.03 3.68 -2.24 -1.26 -4.99 114.28 115.63 3e9x n THR 447 Ca 0.08 -1.98 0.04 0.00 -2.27 0.00 0.00 64.05 59.92 3e9x n THR 447 Cb 0.48 0.54 0.44 0.00 -2.10 0.00 0.00 70.33 69.70 3e9x n THR 447 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 3e9x h TRP 448 N 1.38 0.45 0.00 4.78 2.91 -1.79 -1.68 115.95 122.00 3e9x h TRP 448 Ca -0.31 0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.72 3e9x h TRP 448 Cb 1.03 -0.15 0.00 0.00 -0.51 0.00 0.00 29.16 29.53 3e9x h TRP 448 CO 0.00 0.30 0.00 0.09 -1.03 0.00 0.00 178.44 177.80 3e9x n ASN 449 N -4.47 0.00 -1.45 2.65 5.03 -1.26 -3.59 115.26 112.17 3e9x n ASN 449 Ca 0.02 0.33 -0.05 0.00 0.87 0.00 0.00 54.58 55.75 3e9x n ASN 449 Cb 0.08 -0.43 0.10 0.00 -1.02 0.00 0.00 39.78 38.51 3e9x n ASN 449 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 3e9x n SER 450 N -1.43 2.70 0.15 6.41 3.41 -0.64 -4.77 113.62 119.45 3e9x n SER 450 Ca 0.07 -3.39 0.08 0.00 -0.26 0.00 0.00 58.87 55.37 3e9x n SER 450 Cb 0.24 -0.43 0.06 0.00 -0.26 0.00 0.00 64.21 63.83 3e9x n SER 450 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3e9x h LEU 451 N 1.58 0.00 -9.72 1.04 3.38 -1.61 -3.44 115.31 106.54 3e9x h LEU 451 Ca 0.08 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.48 3e9x h LEU 451 Cb 1.34 0.00 0.10 0.00 0.09 0.00 0.00 40.66 42.19 3e9x h LEU 451 CO 0.29 0.22 0.58 1.17 0.09 0.00 0.00 178.44 180.80 3e9x n LYS 452 N -3.03 2.19 -1.33 1.13 4.81 -1.26 -1.59 118.16 119.08 3e9x n LYS 452 Ca 0.01 0.77 -0.11 0.00 -0.87 0.00 0.00 58.31 58.11 3e9x n LYS 452 Cb 0.63 -2.40 -0.05 0.00 0.02 0.00 0.00 35.03 33.24 3e9x n LYS 452 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3e9x n ASP 453 N 1.25 -5.04 -4.02 3.14 10.43 -0.19 -4.95 116.55 117.17 3e9x n ASP 453 Ca 0.07 0.28 -0.17 0.00 2.57 0.00 0.00 54.79 57.54 3e9x n ASP 453 Cb 0.35 -3.54 0.08 0.00 1.84 0.00 0.00 41.12 39.85 3e9x n ASP 453 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3e9x n LYS 454 N -1.77 0.20 -4.17 -1.24 4.76 -0.62 -4.04 118.16 111.28 3e9x n LYS 454 Ca -0.11 -2.15 -0.34 0.00 -2.87 0.00 0.00 58.31 52.83 3e9x n LYS 454 Cb 0.48 -0.44 -0.13 0.00 -1.84 0.00 0.00 35.03 33.11 3e9x n LYS 454 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3e9x s LYS 455 N -4.37 3.53 0.22 1.97 1.02 -1.26 -1.33 119.74 119.52 3e9x s LYS 455 Ca 0.50 -0.57 0.08 0.00 0.02 0.00 0.00 55.97 56.00 3e9x s LYS 455 Cb -0.03 -2.98 -0.04 0.00 -0.52 0.00 0.00 37.83 34.26 3e9x s LYS 455 CO 0.33 0.02 0.01 -1.54 -0.92 0.00 0.00 175.35 173.25 3e9x s SER 456 N 0.95 4.73 -0.22 2.83 1.04 -0.94 0.19 113.70 122.27 3e9x s SER 456 Ca 0.00 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 55.94 3e9x s SER 456 Cb -0.15 -0.97 0.06 0.00 0.10 0.00 0.00 66.02 65.06 3e9x s SER 456 CO 0.01 0.04 -0.04 0.00 0.98 0.00 0.00 173.24 174.23 3e9x s HIS 458 N 1.47 3.00 0.12 0.00 3.76 -0.85 -0.97 115.29 121.83 3e9x s HIS 458 Ca -0.05 -0.01 -0.17 0.00 -0.15 0.00 0.00 55.06 54.69 3e9x s HIS 458 Cb -0.18 -1.57 -0.03 0.00 1.11 0.00 0.00 32.58 31.91 3e9x s HIS 458 CO -0.07 0.47 1.64 1.79 -0.85 0.00 0.00 174.74 177.72 3e9x h THR 459 N 3.06 1.21 0.00 1.30 1.35 -1.74 -3.42 112.91 114.67 3e9x h THR 459 Ca -0.48 -0.67 0.00 0.00 -0.55 0.00 0.00 66.41 64.71 3e9x h THR 459 Cb 1.17 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 3e9x h THR 459 CO 0.59 0.23 0.00 0.00 -0.25 0.00 0.00 175.52 176.09 3e9x n ALA 460 N -2.31 0.00 -1.64 6.62 0.00 -1.26 -1.20 120.51 120.72 3e9x n ALA 460 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.00 3e9x n ALA 460 Cb 0.17 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.62 3e9x n ALA 460 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3e9x n VAL 461 N -0.23 2.21 -0.98 0.00 0.31 0.26 -2.33 118.33 117.56 3e9x n VAL 461 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 3e9x n VAL 461 Cb 0.00 -1.28 0.00 0.00 -0.91 0.00 0.00 33.84 31.65 3e9x n VAL 461 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3e9x n ASP 462 N 0.73 -0.81 -4.93 4.52 8.00 -1.26 -4.96 116.55 117.85 3e9x n ASP 462 Ca 0.08 0.00 -0.25 0.00 0.71 0.00 0.00 54.79 55.32 3e9x n ASP 462 Cb 0.36 -0.27 -0.02 0.00 -0.02 0.00 0.00 41.12 41.18 3e9x n ASP 462 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3e9x s ARG 463 N -0.07 3.53 0.05 -1.24 0.52 -0.99 -4.06 118.95 116.69 3e9x s ARG 463 Ca 0.00 -0.19 -0.24 0.00 -0.52 0.00 0.00 55.73 54.78 3e9x s ARG 463 Cb 0.00 -2.63 -0.13 0.00 0.52 0.00 0.00 34.95 32.72 3e9x s ARG 463 CO 0.00 0.12 1.36 1.15 0.02 0.00 0.00 175.30 177.96 3e9x h THR 464 N 0.84 0.00 0.00 0.02 2.02 -1.92 0.25 112.91 114.12 3e9x h THR 464 Ca -0.49 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 66.55 3e9x h THR 464 Cb 1.21 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 3e9x h THR 464 CO 0.63 0.00 -0.81 0.00 0.37 0.00 0.00 175.52 175.70 3e9x h ALA 465 N -1.43 0.60 0.00 6.16 0.00 -1.91 -0.83 119.26 121.86 3e9x h ALA 465 Ca -0.07 -0.66 -0.19 0.00 0.00 0.00 0.00 54.91 53.99 3e9x h ALA 465 Cb 0.63 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 3e9x h ALA 465 CO 0.07 0.85 -1.20 0.78 0.00 0.00 0.00 179.25 179.75 3e9x h GLY 466 N 3.42 0.00 0.00 0.00 0.00 -1.68 -3.38 103.07 101.43 3e9x h GLY 466 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.29 3e9x h GLY 466 CO 0.08 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.49 3e9x n TRP 467 N -3.09 0.00 -0.31 5.60 -0.00 -0.72 -4.23 117.44 114.70 3e9x n TRP 467 Ca -0.07 0.00 -0.04 0.00 -0.00 0.00 0.00 57.50 57.39 3e9x n TRP 467 Cb 0.88 0.14 0.01 0.00 -0.00 0.00 0.00 31.31 32.34 3e9x n TRP 467 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 3e9x h ASN 468 N 0.00 -1.40 0.58 5.87 2.35 -1.06 -0.53 115.58 121.39 3e9x h ASN 468 Ca 0.00 0.28 -0.03 0.00 -0.55 0.00 0.00 56.30 56.00 3e9x h ASN 468 Cb 0.00 0.70 0.01 0.00 0.05 0.00 0.00 38.32 39.08 3e9x h ASN 468 CO 0.00 -0.30 -0.28 0.40 -1.65 0.00 0.00 177.43 175.60 3e9x h ILE 469 N -0.08 0.28 -0.17 2.81 5.03 -1.36 -1.87 117.51 122.16 3e9x h ILE 469 Ca 0.28 -0.33 0.02 0.00 -0.12 0.00 0.00 64.86 64.70 3e9x h ILE 469 Cb 0.57 0.38 -0.02 0.00 -3.03 0.00 0.00 36.82 34.72 3e9x h ILE 469 CO -0.85 0.04 0.06 1.55 -0.68 0.00 0.00 178.15 178.26 3e9x h PRO 470 N -1.04 0.13 0.00 2.37 0.13 -1.75 -1.53 132.00 130.32 3e9x h PRO 470 Ca -0.08 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.98 3e9x h PRO 470 Cb 0.66 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.75 3e9x h PRO 470 CO 0.13 0.09 -0.30 0.52 -0.23 0.00 0.00 178.00 178.21 3e9x h MET 471 N 0.14 0.00 -0.16 0.86 2.86 -1.21 -0.82 114.93 116.59 3e9x h MET 471 Ca 0.07 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.65 3e9x h MET 471 Cb 0.05 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.70 3e9x h MET 471 CO -0.08 0.30 -0.15 0.78 1.06 0.00 0.00 176.91 178.83 3e9x h GLY 472 N 1.61 0.43 0.94 8.32 0.00 -1.05 0.14 103.07 113.46 3e9x h GLY 472 Ca -0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 3e9x h GLY 472 CO 0.04 0.39 0.14 1.41 0.00 0.00 0.00 176.54 178.52 3e9x h LEU 473 N 0.04 0.35 -0.98 3.11 3.38 -1.05 -2.12 115.31 118.04 3e9x h LEU 473 Ca 0.03 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3e9x h LEU 473 Cb 0.68 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.29 3e9x h LEU 473 CO 0.04 0.36 0.63 0.40 0.09 0.00 0.00 178.44 179.96 3e9x h ILE 474 N 0.31 1.26 -0.09 1.22 2.04 -1.09 -0.26 117.51 120.91 3e9x h ILE 474 Ca 0.09 -0.50 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 3e9x h ILE 474 Cb 0.10 -0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.01 3e9x h ILE 474 CO -0.01 0.26 0.01 0.58 0.00 0.00 0.00 178.15 178.98 3e9x h VAL 475 N 1.34 1.23 -0.34 1.67 2.07 -0.82 -1.33 116.25 120.07 3e9x h VAL 475 Ca 0.36 -0.73 0.05 0.00 0.82 0.00 0.00 66.70 67.19 3e9x h VAL 475 Cb -0.12 1.55 -0.08 0.00 -1.52 0.00 0.00 31.29 31.12 3e9x h VAL 475 CO -0.07 0.21 -0.55 0.78 0.02 0.00 0.00 177.57 177.95 3e9x h ASN 476 N -0.11 -1.82 -0.64 0.57 4.21 -1.10 0.59 115.58 117.28 3e9x h ASN 476 Ca 0.03 0.23 0.06 0.00 1.21 0.00 0.00 56.30 57.83 3e9x h ASN 476 Cb 0.31 0.74 -0.04 0.00 -1.12 0.00 0.00 38.32 38.22 3e9x h ASN 476 CO 0.00 -0.42 0.42 1.56 -1.29 0.00 0.00 177.43 177.70 3e9x h GLN 477 N -0.44 0.63 -0.02 0.81 4.20 -0.99 -1.93 115.11 117.36 3e9x h GLN 477 Ca 0.06 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3e9x h GLN 477 Cb 0.62 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.26 3e9x h GLN 477 CO -0.56 0.42 -0.12 0.25 -0.67 0.00 0.00 178.83 178.15 3e9x n THR 478 N -4.47 0.00 -3.55 -0.54 -2.24 -0.51 -4.94 114.28 98.02 3e9x n THR 478 Ca 0.09 -0.41 -0.26 0.00 -2.27 0.00 0.00 64.05 61.20 3e9x n THR 478 Cb 0.22 1.32 0.00 0.00 -2.10 0.00 0.00 70.33 69.77 3e9x n THR 478 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3e9x n GLY 479 N 1.35 -0.49 3.06 3.38 0.00 0.20 -4.94 105.19 107.76 3e9x n GLY 479 Ca 0.13 0.12 -0.12 0.00 0.00 0.00 0.00 46.02 46.15 3e9x n GLY 479 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3e9x s SER 480 N -2.91 -0.10 0.00 1.61 0.15 -1.04 -5.03 113.70 106.38 3e9x s SER 480 Ca 0.49 0.14 0.28 0.00 0.70 0.00 0.00 55.95 57.55 3e9x s SER 480 Cb -0.25 0.29 1.00 0.00 -1.71 0.00 0.00 66.02 65.34 3e9x s SER 480 CO 0.60 -0.17 1.71 0.00 1.20 0.00 0.00 173.24 176.59 3e9x n ALA 482 N -0.36 4.51 0.33 0.00 0.00 -1.26 -4.47 120.51 119.26 3e9x n ALA 482 Ca 0.16 -0.84 0.03 0.00 0.00 0.00 0.00 53.44 52.79 3e9x n ALA 482 Cb 0.33 -1.85 0.17 0.00 0.00 0.00 0.00 19.45 18.10 3e9x n ALA 482 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 3e9x n PHE 483 N 2.19 0.00 1.26 0.00 -1.74 -1.26 -0.95 117.46 116.96 3e9x n PHE 483 Ca 0.20 0.00 0.14 0.00 -0.56 0.00 0.00 57.45 57.22 3e9x n PHE 483 Cb 0.59 -0.19 0.53 0.00 1.52 0.00 0.00 39.48 41.93 3e9x n PHE 483 CO 0.00 0.00 0.00 -0.40 -0.56 0.00 0.00 176.76 175.80 3e9x n ASP 484 N -1.19 0.45 0.00 5.98 5.75 -1.26 -3.70 116.55 122.58 3e9x n ASP 484 Ca 0.04 -0.38 0.00 0.00 -0.01 0.00 0.00 54.79 54.44 3e9x n ASP 484 Cb 0.04 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 3e9x n ASP 484 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3e9x n GLU 485 N -1.10 1.55 -0.01 0.11 1.02 -0.12 -4.78 120.64 117.30 3e9x n GLU 485 Ca 0.12 -1.10 -0.13 0.00 -0.02 0.00 0.00 57.16 56.03 3e9x n GLU 485 Cb 0.30 -0.95 -0.10 0.00 -0.02 0.00 0.00 31.44 30.68 3e9x n GLU 485 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 3e9x h PHE 486 N 0.00 -0.00 -3.10 -0.32 3.57 -1.63 -3.45 116.94 112.01 3e9x h PHE 486 Ca 0.00 -0.00 -0.50 0.00 3.53 0.00 0.00 57.97 61.00 3e9x h PHE 486 Cb 0.40 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.14 3e9x h PHE 486 CO 0.00 0.48 -0.13 -0.06 -2.23 0.00 0.00 178.31 176.37 3e9x s PHE 487 N -4.25 3.50 -0.05 0.41 0.08 -1.26 -1.02 117.98 115.38 3e9x s PHE 487 Ca -0.16 0.55 -0.25 0.00 0.12 0.00 0.00 56.93 57.19 3e9x s PHE 487 Cb 0.02 -2.05 -0.23 0.00 -0.57 0.00 0.00 43.02 40.18 3e9x s PHE 487 CO 0.67 0.10 1.03 0.66 -0.10 0.00 0.00 175.22 177.58 3e9x h SER 488 N 1.18 0.20 -5.01 1.36 4.64 -1.35 -3.45 113.55 111.13 3e9x h SER 488 Ca -0.48 -0.77 -0.12 0.00 -0.47 0.00 0.00 61.79 59.94 3e9x h SER 488 Cb 1.20 -0.06 -0.20 0.00 -0.31 0.00 0.00 62.40 63.04 3e9x h SER 488 CO 0.64 0.94 -0.36 -1.10 -0.87 0.00 0.00 176.83 176.09 3e9x s GLN 489 N -3.14 0.63 0.37 4.77 -0.21 -1.25 -4.90 119.66 115.93 3e9x s GLN 489 Ca -0.16 -0.35 -0.03 0.00 0.02 0.00 0.00 55.36 54.84 3e9x s GLN 489 Cb 0.01 0.27 0.01 0.00 1.00 0.00 0.00 33.01 34.30 3e9x s GLN 489 CO 0.73 -0.17 0.52 -1.12 -2.12 0.00 0.00 175.29 173.13 3e9x s SER 490 N -1.52 0.99 -0.34 5.90 0.01 -0.99 -2.21 113.70 115.54 3e9x s SER 490 Ca -0.12 -1.52 -0.01 0.00 1.31 0.00 0.00 55.95 55.61 3e9x s SER 490 Cb -0.05 0.70 0.12 0.00 0.21 0.00 0.00 66.02 67.01 3e9x s SER 490 CO 0.02 -1.38 0.18 0.00 0.41 0.00 0.00 173.24 172.47 3e9x s ALA 492 N 1.34 3.25 -0.21 0.00 0.00 0.20 -2.00 121.76 124.34 3e9x s ALA 492 Ca 0.14 -3.42 -0.41 0.00 0.00 0.00 0.00 51.96 48.27 3e9x s ALA 492 Cb -0.21 -2.07 -0.18 0.00 0.00 0.00 0.00 23.12 20.66 3e9x s ALA 492 CO -0.13 -2.06 1.49 -2.30 0.00 0.00 0.00 175.76 172.76 3e9x n PRO 493 N 2.50 0.61 0.00 0.00 -0.02 -1.26 -2.15 135.00 134.69 3e9x n PRO 493 Ca 0.16 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 3e9x n PRO 493 Cb 0.36 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 3e9x n PRO 493 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3e9x n GLY 494 N 3.28 1.75 3.93 -1.23 0.00 0.01 -0.58 105.19 112.36 3e9x n GLY 494 Ca 0.25 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.01 3e9x n GLY 494 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3e9x s ALA 495 N -2.14 3.19 0.04 4.61 0.00 -0.91 -4.96 121.76 121.59 3e9x s ALA 495 Ca 0.00 -0.99 -0.33 0.00 0.00 0.00 0.00 51.96 50.64 3e9x s ALA 495 Cb 0.00 -2.55 -0.11 0.00 0.00 0.00 0.00 23.12 20.45 3e9x s ALA 495 CO 0.00 -1.32 1.83 -3.47 0.00 0.00 0.00 175.76 172.80 3e9x n ASP 496 N -2.92 3.69 -0.02 0.00 2.03 -1.26 -4.84 116.55 113.24 3e9x n ASP 496 Ca 0.09 0.98 0.22 0.00 0.52 0.00 0.00 54.79 56.60 3e9x n ASP 496 Cb 0.60 -1.46 0.71 0.00 -0.72 0.00 0.00 41.12 40.25 3e9x n ASP 496 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3e9x h PRO 497 N 8.67 0.00 -0.66 -0.67 0.11 -1.93 -1.20 132.00 136.32 3e9x h PRO 497 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3e9x h PRO 497 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3e9x h PRO 497 CO 0.94 0.00 0.00 0.36 -0.21 0.00 0.00 178.00 179.09 3e9x n LYS 498 N -4.28 3.69 -3.84 1.05 2.85 -1.26 -4.70 118.16 111.67 3e9x n LYS 498 Ca 0.11 -2.89 -0.21 0.00 -1.05 0.00 0.00 58.31 54.27 3e9x n LYS 498 Cb 0.66 -1.88 -0.03 0.00 -0.65 0.00 0.00 35.03 33.14 3e9x n LYS 498 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 3e9x s SER 499 N -0.93 5.47 0.26 -5.58 1.04 -0.45 -5.02 113.70 108.49 3e9x s SER 499 Ca 0.51 -0.38 -0.02 0.00 0.48 0.00 0.00 55.95 56.54 3e9x s SER 499 Cb 0.33 -1.13 0.54 0.00 0.10 0.00 0.00 66.02 65.85 3e9x s SER 499 CO 0.25 -0.29 1.70 0.03 0.98 0.00 0.00 173.24 175.92 3e9x h ARG 500 N 1.25 0.35 0.00 4.02 3.08 -1.90 -0.87 114.38 120.31 3e9x h ARG 500 Ca -0.46 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.57 3e9x h ARG 500 Cb 1.25 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.22 3e9x h ARG 500 CO 0.58 0.23 0.10 1.28 -1.07 0.00 0.00 179.97 181.10 3e9x n LEU 501 N -5.08 0.00 0.00 3.04 4.77 -1.26 -0.36 117.00 118.11 3e9x n LEU 501 Ca 0.17 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 3e9x n LEU 501 Cb 0.50 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 3e9x n LEU 501 CO 0.14 -0.28 0.06 0.00 -1.33 0.00 0.00 177.39 175.98 3e9x h ALA 503 N 0.00 1.91 -0.00 0.00 0.00 -0.39 -0.39 119.26 120.40 3e9x h ALA 503 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3e9x h ALA 503 Cb 0.02 0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3e9x h ALA 503 CO 0.00 -0.53 -0.47 1.28 0.00 0.00 0.00 179.25 179.53 3e9x n LEU 504 N -5.04 0.71 -4.74 0.00 4.77 0.11 -4.90 117.00 107.91 3e9x n LEU 504 Ca 0.31 -0.13 -0.41 0.00 -0.03 0.00 0.00 56.01 55.75 3e9x n LEU 504 Cb 0.94 -0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.81 3e9x n LEU 504 CO 0.10 0.16 0.93 0.00 -1.33 0.00 0.00 177.39 177.25 3e9x n ALA 506 N 2.19 2.48 -0.89 0.00 0.00 -1.26 -4.76 120.51 118.27 3e9x n ALA 506 Ca 0.04 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.81 3e9x n ALA 506 Cb 0.44 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.97 3e9x n ALA 506 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3e9x n GLY 507 N 1.32 -0.23 0.21 0.00 0.00 -1.26 -4.51 105.19 100.72 3e9x n GLY 507 Ca 0.16 -0.96 -0.01 0.00 0.00 0.00 0.00 46.02 45.20 3e9x n GLY 507 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3e9x n ASP 508 N -2.62 0.04 0.00 1.61 5.75 0.30 -2.36 116.55 119.27 3e9x n ASP 508 Ca 0.00 -1.04 0.00 0.00 -0.01 0.00 0.00 54.79 53.74 3e9x n ASP 508 Cb 0.00 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.05 3e9x n ASP 508 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 3e9x n ASP 509 N -3.02 0.00 0.00 -1.12 3.85 -1.26 -0.30 116.55 114.69 3e9x n ASP 509 Ca 0.01 0.16 0.00 0.00 -0.71 0.00 0.00 54.79 54.25 3e9x n ASP 509 Cb 0.03 -0.16 0.00 0.00 -1.35 0.00 0.00 41.12 39.64 3e9x n ASP 509 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3e9x n GLN 510 N -1.14 5.85 -0.15 0.11 6.02 -1.26 -4.98 117.38 121.82 3e9x n GLN 510 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3e9x n GLN 510 Cb 0.01 -0.52 0.00 0.00 1.02 0.00 0.00 30.24 30.75 3e9x n GLN 510 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3e9x n GLY 511 N 1.08 0.58 3.86 1.08 0.00 0.58 -5.06 105.19 107.31 3e9x n GLY 511 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3e9x n GLY 511 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3e9x s LEU 512 N 0.00 3.66 -1.23 0.99 1.43 -1.26 -4.13 118.68 118.13 3e9x s LEU 512 Ca 0.00 1.37 -0.03 0.00 -1.03 0.00 0.00 54.13 54.44 3e9x s LEU 512 Cb 0.00 -4.30 0.00 0.00 0.03 0.00 0.00 46.19 41.92 3e9x s LEU 512 CO 0.00 -0.55 0.43 0.47 0.23 0.00 0.00 176.35 176.93 3e9x n ASP 513 N -1.62 -5.09 -4.70 2.29 8.00 -1.26 -0.54 116.55 113.62 3e9x n ASP 513 Ca 0.05 -0.20 -0.42 0.00 0.71 0.00 0.00 54.79 54.92 3e9x n ASP 513 Cb 0.54 -3.97 -0.03 0.00 -0.02 0.00 0.00 41.12 37.64 3e9x n ASP 513 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3e9x s LYS 514 N -5.38 4.14 0.00 -1.24 2.20 -1.26 -2.43 119.74 115.78 3e9x s LYS 514 Ca 0.21 2.57 0.00 0.00 -0.36 0.00 0.00 55.97 58.39 3e9x s LYS 514 Cb -0.09 -3.37 0.00 0.00 -1.51 0.00 0.00 37.83 32.86 3e9x s LYS 514 CO 0.26 -0.79 0.00 0.00 -0.36 0.00 0.00 175.35 174.47 3e9x s VAL 516 N -1.80 3.07 -0.58 0.00 -7.23 -1.02 -0.81 120.40 112.04 3e9x s VAL 516 Ca 0.00 1.01 -0.06 0.00 -1.81 0.00 0.00 61.98 61.11 3e9x s VAL 516 Cb 0.00 -3.64 -0.16 0.00 0.56 0.00 0.00 36.38 33.13 3e9x s VAL 516 CO 0.00 0.21 2.93 -0.81 -0.31 0.00 0.00 175.10 177.12 3e9x n PRO 517 N 1.50 2.29 -3.73 4.82 -0.04 -1.26 -4.42 135.00 134.15 3e9x n PRO 517 Ca 0.02 -1.30 -0.11 0.00 -0.04 0.00 0.00 63.50 62.07 3e9x n PRO 517 Cb 0.43 -2.24 -0.06 0.00 -0.04 0.00 0.00 33.50 31.59 3e9x n PRO 517 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3e9x s ASN 518 N 2.35 -0.13 0.00 3.54 2.20 -1.26 -4.53 114.94 117.11 3e9x s ASN 518 Ca 0.57 -0.29 0.00 0.00 -0.94 0.00 0.00 52.86 52.21 3e9x s ASN 518 Cb 0.22 0.40 0.00 0.00 -2.00 0.00 0.00 41.25 39.87 3e9x s ASN 518 CO -0.02 -0.71 0.20 -1.54 -2.94 0.00 0.00 177.10 172.09 3e9x n SER 519 N 0.22 0.00 0.19 3.54 3.41 -1.26 -0.76 113.62 118.96 3e9x n SER 519 Ca -0.17 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.55 3e9x n SER 519 Cb 0.61 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.69 3e9x n SER 519 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 3e9x h LYS 520 N 0.00 0.00 -6.49 4.33 1.63 -1.93 -3.43 116.57 110.68 3e9x h LYS 520 Ca 0.00 0.00 -0.53 0.00 -0.85 0.00 0.00 60.65 59.27 3e9x h LYS 520 Cb 0.00 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.61 3e9x h LYS 520 CO 0.00 0.01 0.35 -2.00 -3.45 0.00 0.00 179.45 174.37 3e9x s GLU 521 N -3.23 4.63 0.24 1.90 2.56 0.06 -3.40 118.70 121.46 3e9x s GLU 521 Ca 0.05 1.41 -0.06 0.00 0.00 0.00 0.00 54.97 56.38 3e9x s GLU 521 Cb 0.06 -3.41 0.29 0.00 2.00 0.00 0.00 34.13 33.07 3e9x s GLU 521 CO 0.70 0.11 1.88 -0.22 -0.56 0.00 0.00 175.26 177.17 3e9x h LYS 522 N 6.08 1.07 -1.12 4.30 3.64 -1.75 -2.93 116.57 125.87 3e9x h LYS 522 Ca -0.42 -0.06 -0.67 0.00 -1.27 0.00 0.00 60.65 58.23 3e9x h LYS 522 Cb 1.21 -0.24 -0.32 0.00 -0.41 0.00 0.00 32.23 32.48 3e9x h LYS 522 CO 0.73 0.71 0.55 0.66 -2.27 0.00 0.00 179.45 179.84 3e9x n TYR 523 N -4.53 3.13 -3.82 1.91 4.01 -1.26 -4.49 117.16 112.10 3e9x n TYR 523 Ca 0.12 -2.80 -0.37 0.00 -0.16 0.00 0.00 57.90 54.69 3e9x n TYR 523 Cb 0.10 -1.17 -0.06 0.00 -0.31 0.00 0.00 39.34 37.90 3e9x n TYR 523 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 3e9x s TYR 524 N -3.82 3.62 0.01 -0.72 5.04 -1.11 -3.66 117.35 116.72 3e9x s TYR 524 Ca 0.60 0.60 0.00 0.00 -2.44 0.00 0.00 57.07 55.83 3e9x s TYR 524 Cb 0.48 -2.00 0.00 0.00 0.35 0.00 0.00 41.96 40.79 3e9x s TYR 524 CO -0.07 0.72 0.00 0.41 -1.34 0.00 0.00 175.55 175.27 3e9x n GLY 525 N 1.98 -2.20 0.25 8.97 0.00 -0.34 -2.33 105.19 111.51 3e9x n GLY 525 Ca -0.19 -1.49 -0.09 0.00 0.00 0.00 0.00 46.02 44.25 3e9x n GLY 525 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3e9x h TYR 526 N -0.04 -0.55 -0.62 1.61 0.05 -1.93 0.16 116.97 115.65 3e9x h TYR 526 Ca 0.00 0.03 -0.09 0.00 0.05 0.00 0.00 58.73 58.72 3e9x h TYR 526 Cb 0.04 0.27 -0.02 0.00 1.01 0.00 0.00 36.73 38.03 3e9x h TYR 526 CO 0.00 -0.29 0.03 1.15 -1.05 0.00 0.00 178.16 178.00 3e9x h THR 527 N -0.25 1.26 -0.20 -2.88 2.02 -1.89 -2.53 112.91 108.44 3e9x h THR 527 Ca 0.11 -1.12 -0.03 0.00 0.77 0.00 0.00 66.41 66.14 3e9x h THR 527 Cb 0.41 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 3e9x h THR 527 CO -0.31 0.41 0.00 1.23 0.37 0.00 0.00 175.52 177.23 3e9x h GLY 528 N 1.01 0.38 1.20 2.16 0.00 -1.09 -1.87 103.07 104.86 3e9x h GLY 528 Ca 0.18 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.24 3e9x h GLY 528 CO 0.03 0.26 0.52 0.00 0.00 0.00 0.00 176.54 177.34 3e9x h ALA 529 N 0.79 1.40 -0.13 3.60 0.00 -0.96 -0.78 119.26 123.19 3e9x h ALA 529 Ca 0.06 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 3e9x h ALA 529 Cb 0.39 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3e9x h ALA 529 CO 0.01 0.54 -0.59 0.35 0.00 0.00 0.00 179.25 179.56 3e9x h PHE 530 N 1.09 0.54 -0.16 0.00 3.57 -1.36 -2.77 116.94 117.85 3e9x h PHE 530 Ca 0.29 -0.20 -0.09 0.00 3.53 0.00 0.00 57.97 61.50 3e9x h PHE 530 Cb -0.10 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 3e9x h PHE 530 CO 0.00 0.91 -0.31 -0.09 -2.23 0.00 0.00 178.31 176.59 3e9x h ARG 531 N 0.32 0.32 -0.92 1.11 2.43 -0.77 0.23 114.38 117.10 3e9x h ARG 531 Ca -0.00 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 3e9x h ARG 531 Cb 1.12 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.61 3e9x h ARG 531 CO 0.10 0.60 0.58 0.00 -1.51 0.00 0.00 179.97 179.74 3e9x h LEU 533 N 1.25 0.75 -1.93 0.00 5.85 -1.18 -0.79 115.31 119.26 3e9x h LEU 533 Ca 0.33 -0.85 0.04 0.00 0.84 0.00 0.00 57.88 58.24 3e9x h LEU 533 Cb -0.10 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.68 3e9x h LEU 533 CO -0.07 1.53 0.13 0.00 -0.34 0.00 0.00 178.44 179.70 3e9x h ALA 534 N 0.23 2.07 -0.63 1.25 0.00 -0.06 0.37 119.26 122.49 3e9x h ALA 534 Ca -0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3e9x h ALA 534 Cb 1.81 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.59 3e9x h ALA 534 CO 0.21 -0.11 0.00 0.39 0.00 0.00 0.00 179.25 179.74 3e9x n GLU 535 N -4.50 2.69 -3.58 0.00 1.02 0.12 -4.94 120.64 111.46 3e9x n GLU 535 Ca 0.01 -2.36 -0.25 0.00 -0.02 0.00 0.00 57.16 54.55 3e9x n GLU 535 Cb 0.21 -1.57 0.06 0.00 -0.02 0.00 0.00 31.44 30.12 3e9x n GLU 535 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3e9x n ASP 536 N 1.29 -6.08 0.03 1.62 8.00 0.12 -4.88 116.55 116.66 3e9x n ASP 536 Ca 0.22 -0.55 -0.20 0.00 0.71 0.00 0.00 54.79 54.97 3e9x n ASP 536 Cb 0.60 -4.81 -0.14 0.00 -0.02 0.00 0.00 41.12 36.75 3e9x n ASP 536 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3e9x h VAL 537 N -2.42 0.78 -1.97 2.53 2.07 -1.36 -3.47 116.25 112.41 3e9x h VAL 537 Ca -0.56 -2.47 -0.60 0.00 0.82 0.00 0.00 66.70 63.89 3e9x h VAL 537 Cb 1.37 2.59 -0.12 0.00 -1.52 0.00 0.00 31.29 33.61 3e9x h VAL 537 CO 0.58 0.84 -0.65 -0.83 0.02 0.00 0.00 177.57 177.53 3e9x s GLY 538 N -5.35 2.07 0.02 2.17 0.00 -1.01 -4.92 107.32 100.29 3e9x s GLY 538 Ca -0.18 -1.98 0.15 0.00 0.00 0.00 0.00 44.72 42.72 3e9x s GLY 538 CO 0.81 -1.94 0.75 1.22 0.00 0.00 0.00 173.10 173.94 3e9x n ASP 539 N -0.87 0.86 -3.91 1.64 8.00 0.50 -4.60 116.55 118.17 3e9x n ASP 539 Ca -0.05 0.39 -0.10 0.00 0.71 0.00 0.00 54.79 55.75 3e9x n ASP 539 Cb 0.62 0.07 -0.09 0.00 -0.02 0.00 0.00 41.12 41.70 3e9x n ASP 539 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3e9x s VAL 540 N -2.79 0.12 -0.04 2.53 0.11 -0.96 -4.36 120.40 115.02 3e9x s VAL 540 Ca -0.04 -0.98 0.02 0.00 -2.93 0.00 0.00 61.98 58.05 3e9x s VAL 540 Cb 0.08 -0.78 0.01 0.00 -1.53 0.00 0.00 36.38 34.16 3e9x s VAL 540 CO 0.82 -0.54 -0.09 0.00 -3.33 0.00 0.00 175.10 171.96 3e9x s ALA 541 N -2.32 0.90 -0.45 1.54 0.00 -0.74 -0.51 121.76 120.18 3e9x s ALA 541 Ca -0.07 -0.28 -0.13 0.00 0.00 0.00 0.00 51.96 51.48 3e9x s ALA 541 Cb -0.03 -0.40 0.08 0.00 0.00 0.00 0.00 23.12 22.77 3e9x s ALA 541 CO -0.03 0.10 0.34 -0.06 0.00 0.00 0.00 175.76 176.11 3e9x s PHE 542 N 0.47 3.29 0.00 0.00 0.08 -0.14 -1.61 117.98 120.07 3e9x s PHE 542 Ca -0.08 -1.22 0.00 0.00 0.12 0.00 0.00 56.93 55.75 3e9x s PHE 542 Cb -0.12 -3.12 0.00 0.00 -0.57 0.00 0.00 43.02 39.21 3e9x s PHE 542 CO 0.01 -0.83 0.00 1.33 -0.10 0.00 0.00 175.22 175.63 3e9x n VAL 543 N 5.08 0.00 -4.37 -0.44 0.24 -1.13 -3.90 118.33 113.81 3e9x n VAL 543 Ca -0.11 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 61.94 3e9x n VAL 543 Cb 0.43 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.71 3e9x n VAL 543 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 3e9x s LYS 544 N 1.41 1.93 0.42 7.34 -2.85 -1.26 -1.65 119.74 125.08 3e9x s LYS 544 Ca 0.00 -1.51 0.15 0.00 -1.00 0.00 0.00 55.97 53.61 3e9x s LYS 544 Cb 0.00 -1.99 1.02 0.00 -2.06 0.00 0.00 37.83 34.80 3e9x s LYS 544 CO 0.00 0.38 1.91 -0.97 0.10 0.00 0.00 175.35 176.77 3e9x h ASN 545 N 2.44 0.43 0.03 0.03 -1.24 -1.07 -2.24 115.58 113.95 3e9x h ASN 545 Ca -0.44 0.02 -0.02 0.00 0.71 0.00 0.00 56.30 56.57 3e9x h ASN 545 Cb 1.24 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 40.22 3e9x h ASN 545 CO 0.57 0.22 -0.07 0.44 -1.29 0.00 0.00 177.43 177.30 3e9x h ASP 546 N 0.46 0.10 -0.45 1.15 5.19 -1.96 -2.59 116.42 118.32 3e9x h ASP 546 Ca 0.38 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.77 3e9x h ASP 546 Cb 0.83 -0.03 -0.02 0.00 0.18 0.00 0.00 39.33 40.29 3e9x h ASP 546 CO -0.13 0.19 0.24 0.74 -3.12 0.00 0.00 179.24 177.16 3e9x h THR 547 N 0.11 1.16 -0.29 0.35 2.02 -1.81 -0.56 112.91 113.90 3e9x h THR 547 Ca 0.03 -0.43 -0.18 0.00 0.77 0.00 0.00 66.41 66.60 3e9x h THR 547 Cb 0.20 0.53 -0.00 0.00 -1.74 0.00 0.00 68.15 67.14 3e9x h THR 547 CO 0.01 0.18 -0.52 0.58 0.37 0.00 0.00 175.52 176.15 3e9x h VAL 548 N 0.67 1.28 -0.19 3.16 2.07 -1.59 -2.99 116.25 118.66 3e9x h VAL 548 Ca 0.17 -1.71 -0.20 0.00 0.82 0.00 0.00 66.70 65.78 3e9x h VAL 548 Cb 0.06 1.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3e9x h VAL 548 CO -0.02 0.55 -0.67 -0.50 0.02 0.00 0.00 177.57 176.95 3e9x h TRP 549 N 0.64 0.98 0.00 1.57 4.06 -1.45 -3.24 115.95 118.50 3e9x h TRP 549 Ca 0.02 -0.39 0.00 0.00 2.06 0.00 0.00 58.89 60.58 3e9x h TRP 549 Cb 1.11 -0.17 0.00 0.00 -1.00 0.00 0.00 29.16 29.10 3e9x h TRP 549 CO 0.06 1.20 0.00 0.93 -3.56 0.00 0.00 178.44 177.08 3e9x h GLU 550 N 0.54 0.00 -0.02 0.49 5.08 -1.15 -3.28 114.58 116.24 3e9x h GLU 550 Ca -0.02 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3e9x h GLU 550 Cb 1.28 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.52 3e9x h GLU 550 CO 0.14 0.00 -0.10 0.09 -1.00 0.00 0.00 179.01 178.14 3e9x n ASN 551 N -2.80 2.33 -4.24 1.42 3.02 -1.13 -3.59 115.26 110.27 3e9x n ASN 551 Ca 0.01 -3.26 -0.13 0.00 -0.03 0.00 0.00 54.58 51.17 3e9x n ASN 551 Cb 0.30 -0.46 -0.10 0.00 -0.61 0.00 0.00 39.78 38.91 3e9x n ASN 551 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3e9x s THR 552 N -2.96 0.43 -1.47 3.41 -4.23 -1.22 -4.74 115.64 104.86 3e9x s THR 552 Ca 0.34 -1.97 -0.11 0.00 -1.18 0.00 0.00 61.69 58.77 3e9x s THR 552 Cb 0.30 -2.30 0.06 0.00 1.34 0.00 0.00 72.50 71.90 3e9x s THR 552 CO 0.01 -0.27 0.86 0.59 -0.54 0.00 0.00 174.62 175.28 3e9x n ASN 553 N -0.28 -5.15 0.00 3.99 4.13 0.25 -2.16 115.26 116.04 3e9x n ASN 553 Ca -0.03 -0.58 0.00 0.00 1.68 0.00 0.00 54.58 55.65 3e9x n ASN 553 Cb 0.65 -4.13 0.00 0.00 -1.54 0.00 0.00 39.78 34.76 3e9x n ASN 553 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3e9x n GLY 554 N -1.63 0.89 0.20 7.41 0.00 -1.26 -4.91 105.19 105.89 3e9x n GLY 554 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 3e9x n GLY 554 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3e9x h GLU 555 N 2.55 0.00 -5.20 1.61 4.39 -1.69 -3.41 114.58 112.83 3e9x h GLU 555 Ca 0.00 0.00 -0.67 0.00 0.34 0.00 0.00 59.36 59.03 3e9x h GLU 555 Cb 0.00 0.00 -0.34 0.00 -0.10 0.00 0.00 28.75 28.31 3e9x h GLU 555 CO 0.00 0.34 -0.87 0.45 -1.16 0.00 0.00 179.01 177.77 3e9x s SER 556 N -6.76 3.13 -0.09 1.42 0.15 -1.24 -4.91 113.70 105.42 3e9x s SER 556 Ca -0.02 -0.60 0.04 0.00 0.70 0.00 0.00 55.95 56.07 3e9x s SER 556 Cb 0.14 -1.45 0.26 0.00 -1.71 0.00 0.00 66.02 63.25 3e9x s SER 556 CO 0.70 0.08 0.96 0.35 1.20 0.00 0.00 173.24 176.53 3e9x n THR 557 N 4.07 1.01 -2.82 6.45 -2.24 -1.26 -3.71 114.28 115.78 3e9x n THR 557 Ca -0.20 -0.47 -0.41 0.00 -2.27 0.00 0.00 64.05 60.70 3e9x n THR 557 Cb 0.51 -0.49 -0.04 0.00 -2.10 0.00 0.00 70.33 68.22 3e9x n THR 557 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3e9x s ALA 558 N -1.50 3.23 0.30 6.98 0.00 -1.26 -4.85 121.76 124.67 3e9x s ALA 558 Ca 0.18 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.56 3e9x s ALA 558 Cb 0.14 -3.21 0.71 0.00 0.00 0.00 0.00 23.12 20.76 3e9x s ALA 558 CO 0.05 -0.15 1.57 0.38 0.00 0.00 0.00 175.76 177.61 3e9x h ASP 559 N 6.53 -0.56 0.83 0.00 2.03 -2.01 0.40 116.42 123.65 3e9x h ASP 559 Ca -0.41 0.29 -0.02 0.00 -0.73 0.00 0.00 57.03 56.15 3e9x h ASP 559 Cb 1.21 0.51 -0.00 0.00 -0.83 0.00 0.00 39.33 40.22 3e9x h ASP 559 CO 0.74 -0.36 -0.11 4.11 -1.03 0.00 0.00 179.24 182.60 3e9x h TRP 560 N 0.00 0.00 -0.00 4.15 5.08 -1.96 -3.31 115.95 119.91 3e9x h TRP 560 Ca 0.58 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.55 3e9x h TRP 560 Cb 1.16 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.32 3e9x h TRP 560 CO -0.54 0.11 -0.37 0.00 -1.28 0.00 0.00 178.44 176.35 3e9x n ALA 561 N -2.17 3.06 -0.16 0.11 0.00 0.12 -4.73 120.51 116.74 3e9x n ALA 561 Ca -0.00 -0.25 0.10 0.00 0.00 0.00 0.00 53.44 53.29 3e9x n ALA 561 Cb 0.33 -0.30 0.43 0.00 0.00 0.00 0.00 19.45 19.91 3e9x n ALA 561 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 3e9x h LYS 562 N 0.09 0.57 -0.64 0.00 2.10 -0.98 -1.68 116.57 116.03 3e9x h LYS 562 Ca 0.00 -0.03 -0.24 0.00 -2.00 0.00 0.00 60.65 58.37 3e9x h LYS 562 Cb 0.21 -0.13 -0.14 0.00 -0.90 0.00 0.00 32.23 31.26 3e9x h LYS 562 CO 0.00 0.38 0.24 0.09 -2.00 0.00 0.00 179.45 178.15 3e9x n ASN 563 N -4.49 3.97 -4.74 7.07 3.02 -1.26 -4.31 115.26 114.53 3e9x n ASN 563 Ca 0.12 -3.40 -0.40 0.00 -0.03 0.00 0.00 54.58 50.87 3e9x n ASN 563 Cb 0.34 -0.71 -0.05 0.00 -0.61 0.00 0.00 39.78 38.75 3e9x n ASN 563 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3e9x s LEU 564 N -3.09 4.38 -0.11 3.41 1.43 -0.63 -5.01 118.68 119.05 3e9x s LEU 564 Ca 0.52 1.26 0.01 0.00 -1.03 0.00 0.00 54.13 54.89 3e9x s LEU 564 Cb 0.43 -3.09 -0.02 0.00 0.03 0.00 0.00 46.19 43.54 3e9x s LEU 564 CO 0.09 -0.03 -0.14 -0.75 0.23 0.00 0.00 176.35 175.75 3e9x s LYS 565 N 0.32 3.18 0.26 1.70 2.36 -1.26 -0.58 119.74 125.72 3e9x s LYS 565 Ca 0.36 -0.70 -0.01 0.00 -2.55 0.00 0.00 55.97 53.07 3e9x s LYS 565 Cb -0.19 -2.55 0.51 0.00 -1.05 0.00 0.00 37.83 34.55 3e9x s LYS 565 CO 0.19 0.30 1.78 -0.09 1.55 0.00 0.00 175.35 179.08 3e9x h ARG 566 N 6.42 0.69 0.00 4.03 2.43 -1.93 -1.51 114.38 124.51 3e9x h ARG 566 Ca -0.29 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 3e9x h ARG 566 Cb 1.20 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 3e9x h ARG 566 CO 0.54 0.45 0.00 -1.91 -1.51 0.00 0.00 179.97 177.54 3e9x n GLU 567 N -4.81 0.06 -0.24 0.20 0.00 -1.26 -2.40 120.64 112.20 3e9x n GLU 567 Ca 0.17 0.24 0.07 0.00 0.00 0.00 0.00 57.16 57.63 3e9x n GLU 567 Cb 0.39 -1.50 0.20 0.00 0.00 0.00 0.00 31.44 30.53 3e9x n GLU 567 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3e9x n ASP 568 N -1.43 2.41 -4.35 4.31 8.00 -0.57 -4.84 116.55 120.08 3e9x n ASP 568 Ca 0.04 -2.03 -0.19 0.00 0.71 0.00 0.00 54.79 53.33 3e9x n ASP 568 Cb 0.13 -0.31 -0.10 0.00 -0.02 0.00 0.00 41.12 40.83 3e9x n ASP 568 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3e9x s PHE 569 N -1.45 1.73 0.01 1.24 0.08 -1.01 -0.62 117.98 117.97 3e9x s PHE 569 Ca 0.29 -0.57 -0.07 0.00 0.12 0.00 0.00 56.93 56.70 3e9x s PHE 569 Cb 0.16 -0.81 -0.00 0.00 -0.57 0.00 0.00 43.02 41.80 3e9x s PHE 569 CO 0.19 0.37 0.13 1.03 -0.10 0.00 0.00 175.22 176.84 3e9x s ARG 570 N -3.64 0.51 -0.12 0.44 1.81 -0.50 -4.40 118.95 113.04 3e9x s ARG 570 Ca 0.23 -0.47 -0.07 0.00 -1.72 0.00 0.00 55.73 53.70 3e9x s ARG 570 Cb -0.01 0.21 -0.04 0.00 -0.45 0.00 0.00 34.95 34.66 3e9x s ARG 570 CO 0.07 -0.12 0.12 -0.51 -0.68 0.00 0.00 175.30 174.18 3e9x s LEU 571 N -1.54 4.27 -0.28 2.53 1.43 -0.36 -1.29 118.68 123.45 3e9x s LEU 571 Ca -0.13 0.41 -0.16 0.00 -1.03 0.00 0.00 54.13 53.22 3e9x s LEU 571 Cb -0.06 -2.04 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 3e9x s LEU 571 CO 0.00 0.38 0.43 -0.76 0.23 0.00 0.00 176.35 176.64 3e9x s LEU 572 N -0.88 4.10 0.48 1.79 1.43 -0.19 -2.01 118.68 123.41 3e9x s LEU 572 Ca 0.14 0.30 0.01 0.00 -1.03 0.00 0.00 54.13 53.54 3e9x s LEU 572 Cb -0.12 -2.51 0.01 0.00 0.03 0.00 0.00 46.19 43.60 3e9x s LEU 572 CO 0.03 -0.26 0.70 0.00 0.23 0.00 0.00 176.35 177.06 3e9x h LEU 574 N 0.29 0.00 -0.01 0.00 3.38 -1.88 -3.15 115.31 113.94 3e9x h LEU 574 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3e9x h LEU 574 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 3e9x h LEU 574 CO 0.56 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.19 3e9x n ASP 575 N -2.65 0.02 0.00 -0.43 5.68 -1.26 -4.86 116.55 113.05 3e9x n ASP 575 Ca 0.05 -1.59 0.00 0.00 -0.50 0.00 0.00 54.79 52.75 3e9x n ASP 575 Cb 0.47 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 3e9x n ASP 575 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3e9x n GLY 576 N 0.71 1.10 2.14 6.12 0.00 -1.19 -5.07 105.19 108.99 3e9x n GLY 576 Ca 0.10 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.97 3e9x n GLY 576 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3e9x n THR 577 N -2.00 0.00 -3.82 2.61 -2.24 -1.26 -4.52 114.28 103.04 3e9x n THR 577 Ca 0.00 -0.66 -0.17 0.00 -2.27 0.00 0.00 64.05 60.95 3e9x n THR 577 Cb 0.00 -1.50 -0.16 0.00 -2.10 0.00 0.00 70.33 66.56 3e9x n THR 577 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3e9x s ARG 578 N -4.34 0.14 0.18 -0.78 0.52 -1.26 -2.51 118.95 110.89 3e9x s ARG 578 Ca 0.40 0.17 0.06 0.00 -0.52 0.00 0.00 55.73 55.83 3e9x s ARG 578 Cb -0.01 -0.43 -0.05 0.00 0.52 0.00 0.00 34.95 34.98 3e9x s ARG 578 CO 0.27 -0.19 -0.11 0.15 0.02 0.00 0.00 175.30 175.45 3e9x s LYS 579 N 1.27 1.19 0.77 3.54 1.02 -0.85 -4.94 119.74 121.74 3e9x s LYS 579 Ca -0.06 -1.53 -0.14 0.00 0.02 0.00 0.00 55.97 54.26 3e9x s LYS 579 Cb -0.13 -0.81 0.06 0.00 -0.52 0.00 0.00 37.83 36.44 3e9x s LYS 579 CO -0.03 0.10 1.19 -2.14 -0.92 0.00 0.00 175.35 173.55 3e9x s PRO 580 N -3.72 1.89 0.00 -1.68 0.02 -1.26 -1.22 135.00 129.03 3e9x s PRO 580 Ca 0.20 1.68 0.01 0.00 0.02 0.00 0.00 61.00 62.92 3e9x s PRO 580 Cb 0.02 -1.81 0.06 0.00 0.02 0.00 0.00 34.50 32.79 3e9x s PRO 580 CO 0.04 -2.00 0.48 1.33 -0.33 0.00 0.00 177.00 176.51 3e9x n VAL 581 N -3.10 0.00 1.04 3.83 0.24 -1.26 -1.21 118.33 117.87 3e9x n VAL 581 Ca 0.13 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.54 3e9x n VAL 581 Cb 0.51 -0.33 0.10 0.00 -1.47 0.00 0.00 33.84 32.64 3e9x n VAL 581 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3e9x n THR 582 N -0.54 0.00 -1.29 3.34 -2.24 -1.26 -4.10 114.28 108.19 3e9x n THR 582 Ca 0.01 -0.06 -0.11 0.00 -2.27 0.00 0.00 64.05 61.62 3e9x n THR 582 Cb 0.00 0.70 0.21 0.00 -2.10 0.00 0.00 70.33 69.15 3e9x n THR 582 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3e9x n GLU 583 N -1.11 2.31 -0.35 -0.78 -0.58 -0.35 -4.67 120.64 115.10 3e9x n GLU 583 Ca 0.07 -3.09 0.06 0.00 -0.42 0.00 0.00 57.16 53.78 3e9x n GLU 583 Cb 0.36 -2.00 0.23 0.00 -0.57 0.00 0.00 31.44 29.46 3e9x n GLU 583 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3e9x h ALA 584 N 1.27 1.51 -0.16 0.62 0.00 -1.76 -0.74 119.26 120.00 3e9x h ALA 584 Ca 0.36 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.32 3e9x h ALA 584 Cb 2.17 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.71 3e9x h ALA 584 CO 0.68 0.29 0.27 0.37 0.00 0.00 0.00 179.25 180.86 3e9x h GLN 585 N 1.04 0.00 0.00 0.00 5.75 -1.94 -1.76 115.11 118.20 3e9x h GLN 585 Ca 0.46 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.96 3e9x h GLN 585 Cb 0.37 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.92 3e9x h GLN 585 CO -0.22 0.00 -0.08 -1.13 -2.65 0.00 0.00 178.83 174.75 3e9x n SER 586 N -3.43 1.89 -2.86 -0.69 3.41 -0.35 -4.83 113.62 106.76 3e9x n SER 586 Ca 0.01 -2.75 -0.12 0.00 -0.26 0.00 0.00 58.87 55.75 3e9x n SER 586 Cb 0.38 -0.34 0.03 0.00 -0.26 0.00 0.00 64.21 64.02 3e9x n SER 586 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3e9x s HIS 588 N 0.02 1.26 -0.01 0.00 -0.00 -1.23 -4.71 115.29 110.61 3e9x s HIS 588 Ca 0.31 -0.67 0.11 0.00 -0.00 0.00 0.00 55.06 54.81 3e9x s HIS 588 Cb 0.24 -0.65 -0.04 0.00 -0.00 0.00 0.00 32.58 32.13 3e9x s HIS 588 CO -0.17 0.09 1.38 -0.07 -0.00 0.00 0.00 174.74 175.97 3e9x h LEU 589 N 3.17 0.00 0.00 5.38 3.38 -1.23 -3.44 115.31 122.56 3e9x h LEU 589 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3e9x h LEU 589 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 3e9x h LEU 589 CO 0.57 0.73 0.00 0.00 0.09 0.00 0.00 178.44 179.83 3e9x n ALA 590 N -2.29 0.00 -3.03 1.53 0.00 -1.24 -5.03 120.51 110.46 3e9x n ALA 590 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.10 3e9x n ALA 590 Cb 0.82 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 20.15 3e9x n ALA 590 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3e9x s VAL 591 N -2.00 4.21 0.03 0.00 0.11 -1.26 -0.93 120.40 120.56 3e9x s VAL 591 Ca 0.00 -0.22 -0.03 0.00 -2.93 0.00 0.00 61.98 58.80 3e9x s VAL 591 Cb 0.00 -2.92 -0.04 0.00 -1.53 0.00 0.00 36.38 31.89 3e9x s VAL 591 CO 0.00 0.41 0.23 0.00 -3.33 0.00 0.00 175.10 172.40 3e9x s ALA 592 N 1.07 3.94 0.23 1.54 0.00 0.38 -4.85 121.76 124.07 3e9x s ALA 592 Ca 0.03 -0.73 -0.30 0.00 0.00 0.00 0.00 51.96 50.96 3e9x s ALA 592 Cb -0.14 -1.92 -0.09 0.00 0.00 0.00 0.00 23.12 20.97 3e9x s ALA 592 CO 0.02 0.75 1.14 -1.25 0.00 0.00 0.00 175.76 176.42 3e9x s PRO 593 N -2.17 4.57 0.64 0.00 0.04 -1.26 0.63 135.00 137.46 3e9x s PRO 593 Ca 0.31 1.83 -0.17 0.00 0.04 0.00 0.00 61.00 63.01 3e9x s PRO 593 Cb -0.13 -3.22 -0.06 0.00 0.04 0.00 0.00 34.50 31.13 3e9x s PRO 593 CO 0.22 0.08 0.56 0.09 0.04 0.00 0.00 177.00 177.98 3e9x n ASN 594 N 1.81 -0.98 -4.77 6.66 4.13 -1.26 -4.41 115.26 116.44 3e9x n ASN 594 Ca 0.01 0.68 -0.40 0.00 1.68 0.00 0.00 54.58 56.55 3e9x n ASN 594 Cb 0.45 -1.21 -0.01 0.00 -1.54 0.00 0.00 39.78 37.47 3e9x n ASN 594 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 3e9x s HIS 595 N -1.78 2.93 0.10 3.10 3.76 -1.26 -4.61 115.29 117.52 3e9x s HIS 595 Ca 0.68 1.39 0.04 0.00 -0.15 0.00 0.00 55.06 57.02 3e9x s HIS 595 Cb -0.40 -3.71 -0.04 0.00 1.11 0.00 0.00 32.58 29.54 3e9x s HIS 595 CO 0.55 -2.05 -0.11 0.00 -0.85 0.00 0.00 174.74 172.29 3e9x s ALA 596 N -1.18 1.18 0.04 -1.40 0.00 0.45 -1.14 121.76 119.71 3e9x s ALA 596 Ca 0.52 -1.21 -0.26 0.00 0.00 0.00 0.00 51.96 51.00 3e9x s ALA 596 Cb -0.40 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.69 3e9x s ALA 596 CO 0.53 -0.02 0.82 0.08 0.00 0.00 0.00 175.76 177.17 3e9x s VAL 597 N -2.44 4.74 0.28 0.00 1.01 0.15 0.86 120.40 125.01 3e9x s VAL 597 Ca 0.06 1.74 0.08 0.00 0.00 0.00 0.00 61.98 63.87 3e9x s VAL 597 Cb -0.03 -4.17 -0.06 0.00 0.00 0.00 0.00 36.38 32.13 3e9x s VAL 597 CO 0.00 0.32 -0.10 0.68 0.00 0.00 0.00 175.10 176.00 3e9x s VAL 598 N 0.19 1.93 0.23 2.92 -7.23 -0.33 0.15 120.40 118.27 3e9x s VAL 598 Ca 0.42 -2.20 -0.22 0.00 -1.81 0.00 0.00 61.98 58.17 3e9x s VAL 598 Cb -0.21 -2.41 0.06 0.00 0.56 0.00 0.00 36.38 34.38 3e9x s VAL 598 CO 0.24 -0.34 0.91 -0.94 -0.31 0.00 0.00 175.10 174.66 3e9x s SER 599 N -3.47 -0.10 0.43 4.85 1.04 -0.96 -2.94 113.70 112.55 3e9x s SER 599 Ca 0.29 -0.67 -0.23 0.00 0.48 0.00 0.00 55.95 55.82 3e9x s SER 599 Cb 0.01 0.61 -0.08 0.00 0.10 0.00 0.00 66.02 66.66 3e9x s SER 599 CO 0.13 -1.16 1.07 -0.13 0.98 0.00 0.00 173.24 174.13 3e9x s ARG 600 N -2.88 4.01 0.30 4.02 0.52 -1.26 -0.41 118.95 123.24 3e9x s ARG 600 Ca 0.15 1.55 0.05 0.00 -0.52 0.00 0.00 55.73 56.96 3e9x s ARG 600 Cb -0.03 -2.43 0.73 0.00 0.52 0.00 0.00 34.95 33.73 3e9x s ARG 600 CO 0.06 -0.29 1.77 1.03 0.02 0.00 0.00 175.30 177.89 3e9x h SER 601 N 2.23 0.76 0.27 0.23 0.87 -1.91 0.26 113.55 116.26 3e9x h SER 601 Ca -0.49 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 3e9x h SER 601 Cb 1.22 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 3e9x h SER 601 CO 0.61 0.27 0.00 -0.90 -0.53 0.00 0.00 176.83 176.28 3e9x n ASP 602 N -4.78 0.00 0.00 6.23 5.75 -1.26 -2.90 116.55 119.59 3e9x n ASP 602 Ca 0.23 -0.16 0.00 0.00 -0.01 0.00 0.00 54.79 54.85 3e9x n ASP 602 Cb 0.57 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.45 3e9x n ASP 602 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3e9x n ARG 603 N -1.21 0.18 -0.35 0.11 5.12 0.02 -4.78 116.66 115.75 3e9x n ARG 603 Ca 0.11 -0.42 -0.03 0.00 -1.93 0.00 0.00 57.85 55.58 3e9x n ARG 603 Cb 0.13 -0.92 0.10 0.00 -1.16 0.00 0.00 32.46 30.61 3e9x n ARG 603 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3e9x h ALA 604 N 0.00 1.20 -0.39 7.54 0.00 -1.26 -1.54 119.26 124.81 3e9x h ALA 604 Ca 0.00 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 3e9x h ALA 604 Cb 0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 3e9x h ALA 604 CO 0.00 0.63 -0.02 0.00 0.00 0.00 0.00 179.25 179.85 3e9x h ALA 605 N 1.33 0.53 -0.38 0.00 0.00 -1.86 -1.24 119.26 117.63 3e9x h ALA 605 Ca 0.34 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 3e9x h ALA 605 Cb -0.10 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3e9x h ALA 605 CO -0.07 0.33 -0.24 1.25 0.00 0.00 0.00 179.25 180.52 3e9x h HIS 606 N 0.53 0.99 -0.44 0.00 6.17 -1.88 -1.80 115.15 118.71 3e9x h HIS 606 Ca 0.11 -0.26 -0.06 0.00 0.71 0.00 0.00 60.37 60.87 3e9x h HIS 606 Cb 0.51 -0.22 -0.02 0.00 2.52 0.00 0.00 27.41 30.20 3e9x h HIS 606 CO 0.04 1.04 0.05 0.28 0.71 0.00 0.00 177.93 180.05 3e9x h VAL 607 N 0.65 1.22 -0.30 5.26 2.07 -1.22 -2.37 116.25 121.55 3e9x h VAL 607 Ca 0.08 -0.85 -0.05 0.00 0.82 0.00 0.00 66.70 66.70 3e9x h VAL 607 Cb 0.81 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 3e9x h VAL 607 CO 0.07 0.30 -0.01 -0.08 0.02 0.00 0.00 177.57 177.86 3e9x h GLU 608 N 0.66 0.54 0.48 1.57 4.81 -1.04 -2.55 114.58 119.05 3e9x h GLU 608 Ca 0.14 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 3e9x h GLU 608 Cb 0.34 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 3e9x h GLU 608 CO 0.01 0.69 -0.44 0.37 -0.73 0.00 0.00 179.01 178.91 3e9x h GLN 609 N 0.32 -0.89 -0.20 1.92 4.15 -1.06 -2.73 115.11 116.63 3e9x h GLN 609 Ca 0.08 0.06 0.06 0.00 0.77 0.00 0.00 58.65 59.62 3e9x h GLN 609 Cb 0.46 0.20 -0.06 0.00 0.21 0.00 0.00 27.48 28.29 3e9x h GLN 609 CO 0.02 -0.59 -0.23 0.28 -1.93 0.00 0.00 178.83 176.38 3e9x h VAL 610 N -0.92 0.42 -0.59 2.39 2.07 -1.45 -2.89 116.25 115.28 3e9x h VAL 610 Ca -0.05 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.51 3e9x h VAL 610 Cb 0.80 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 3e9x h VAL 610 CO -0.04 0.00 0.39 -0.07 0.02 0.00 0.00 177.57 177.87 3e9x h LEU 611 N -0.26 0.56 -0.75 2.57 3.38 -1.40 0.21 115.31 119.63 3e9x h LEU 611 Ca 0.12 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 3e9x h LEU 611 Cb 0.44 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3e9x h LEU 611 CO -0.35 0.38 -0.03 -0.07 0.09 0.00 0.00 178.44 178.47 3e9x h LEU 612 N 0.65 0.90 -0.37 1.67 3.38 -1.28 -0.90 115.31 119.37 3e9x h LEU 612 Ca 0.24 -0.25 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 3e9x h LEU 612 Cb 0.15 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3e9x h LEU 612 CO -0.07 0.98 -0.66 -0.74 0.09 0.00 0.00 178.44 178.04 3e9x h HIS 613 N 0.85 0.00 -0.31 1.13 2.76 -1.25 -2.50 115.15 115.83 3e9x h HIS 613 Ca 0.15 0.00 -0.17 0.00 -2.20 0.00 0.00 60.37 58.15 3e9x h HIS 613 Cb 0.54 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.50 3e9x h HIS 613 CO 0.03 0.66 -0.49 1.96 -1.30 0.00 0.00 177.93 178.79 3e9x h GLN 614 N 0.00 0.85 0.00 5.26 1.08 -0.11 -2.92 115.11 119.27 3e9x h GLN 614 Ca -0.01 -0.51 0.00 0.00 -1.45 0.00 0.00 58.65 56.69 3e9x h GLN 614 Cb 1.34 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.82 3e9x h GLN 614 CO 0.09 1.14 0.00 -0.56 -0.95 0.00 0.00 178.83 178.55 3e9x h GLN 615 N 0.67 0.00 0.00 1.46 3.07 -1.19 -0.46 115.11 118.65 3e9x h GLN 615 Ca 0.03 0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.71 3e9x h GLN 615 Cb 1.09 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.64 3e9x h GLN 615 CO 0.11 0.00 -0.29 0.00 0.09 0.00 0.00 178.83 178.74 3e9x h ALA 616 N 2.26 1.19 0.05 0.06 0.00 -1.26 0.17 119.26 121.74 3e9x h ALA 616 Ca 0.00 -0.27 -0.38 0.00 0.00 0.00 0.00 54.91 54.27 3e9x h ALA 616 Cb 0.83 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 3e9x h ALA 616 CO 0.00 0.37 -2.21 1.28 0.00 0.00 0.00 179.25 178.69 3e9x n LEU 617 N -3.72 2.71 -0.09 0.00 4.77 -0.96 -2.87 117.00 116.84 3e9x n LEU 617 Ca -0.01 0.07 0.05 0.00 -0.03 0.00 0.00 56.01 56.09 3e9x n LEU 617 Cb 0.40 -1.00 0.08 0.00 -2.33 0.00 0.00 43.42 40.57 3e9x n LEU 617 CO 0.35 0.84 0.54 0.49 -1.33 0.00 0.00 177.39 178.29 3e9x n PHE 618 N -3.49 0.05 -0.85 -1.77 3.72 -0.22 -0.01 117.46 114.89 3e9x n PHE 618 Ca -0.40 -0.74 0.00 0.00 -0.05 0.00 0.00 57.45 56.26 3e9x n PHE 618 Cb 0.99 -0.10 0.00 0.00 -0.94 0.00 0.00 39.48 39.43 3e9x n PHE 618 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3e9x n GLY 619 N -0.90 -1.36 0.26 1.37 0.00 0.58 -1.38 105.19 103.77 3e9x n GLY 619 Ca 0.09 -1.63 0.02 0.00 0.00 0.00 0.00 46.02 44.50 3e9x n GLY 619 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3e9x h LYS 620 N 0.00 0.05 -0.16 1.61 1.63 -1.81 -1.92 116.57 115.97 3e9x h LYS 620 Ca 0.00 -0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.68 3e9x h LYS 620 Cb 0.00 -0.01 -0.10 0.00 -0.60 0.00 0.00 32.23 31.52 3e9x h LYS 620 CO 0.00 0.03 -0.58 0.09 -3.45 0.00 0.00 179.45 175.54 3e9x n ASN 621 N -5.40 2.37 -4.71 4.20 4.13 -1.26 -4.91 115.26 109.68 3e9x n ASN 621 Ca 0.11 -3.83 -0.31 0.00 1.68 0.00 0.00 54.58 52.23 3e9x n ASN 621 Cb 0.41 -0.49 0.13 0.00 -1.54 0.00 0.00 39.78 38.30 3e9x n ASN 621 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 3e9x s GLY 622 N -3.29 1.68 0.28 7.41 0.00 -0.72 -4.93 107.32 107.74 3e9x s GLY 622 Ca 0.41 0.44 -0.00 0.00 0.00 0.00 0.00 44.72 45.56 3e9x s GLY 622 CO -0.05 0.83 1.85 0.50 0.00 0.00 0.00 173.10 176.23 3e9x h LYS 623 N -1.56 1.03 -0.37 2.90 1.57 -1.30 -2.97 116.57 115.86 3e9x h LYS 623 Ca -0.43 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.25 3e9x h LYS 623 Cb 1.25 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 33.31 3e9x h LYS 623 CO 0.46 0.68 0.02 0.09 -0.57 0.00 0.00 179.45 180.13 3e9x n ASN 624 N -4.58 4.27 -4.07 0.86 3.02 0.99 -4.86 115.26 110.89 3e9x n ASN 624 Ca 0.18 -3.07 -0.24 0.00 -0.03 0.00 0.00 54.58 51.41 3e9x n ASN 624 Cb 0.29 -0.60 -0.16 0.00 -0.61 0.00 0.00 39.78 38.70 3e9x n ASN 624 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3e9x n PRO 626 N 3.40 1.36 -0.28 0.00 -0.02 -1.26 -4.46 135.00 133.74 3e9x n PRO 626 Ca -0.20 -0.52 -0.06 0.00 -2.02 0.00 0.00 63.50 60.70 3e9x n PRO 626 Cb 0.53 -1.48 -0.01 0.00 -0.02 0.00 0.00 33.50 32.52 3e9x n PRO 626 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3e9x h ASP 627 N 1.25 -1.47 0.00 2.55 3.32 -1.89 -3.39 116.42 116.79 3e9x h ASP 627 Ca 0.00 0.27 -0.05 0.00 0.02 0.00 0.00 57.03 57.27 3e9x h ASP 627 Cb 0.27 0.71 -0.01 0.00 0.22 0.00 0.00 39.33 40.52 3e9x h ASP 627 CO 0.00 -0.31 -0.92 0.29 -1.72 0.00 0.00 179.24 176.58 3e9x n LYS 628 N -5.42 0.08 -3.70 3.56 5.02 0.13 -5.09 118.16 112.75 3e9x n LYS 628 Ca 0.05 0.04 -0.11 0.00 -2.02 0.00 0.00 58.31 56.26 3e9x n LYS 628 Cb 0.36 -0.64 -0.10 0.00 -0.02 0.00 0.00 35.03 34.62 3e9x n LYS 628 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 3e9x s PHE 629 N -2.09 -0.58 -0.22 2.13 5.36 -0.21 -5.02 117.98 117.34 3e9x s PHE 629 Ca -0.05 1.28 -0.02 0.00 -0.96 0.00 0.00 56.93 57.18 3e9x s PHE 629 Cb 0.02 0.25 0.01 0.00 -0.34 0.00 0.00 43.02 42.96 3e9x s PHE 629 CO 0.07 -0.31 -0.09 0.00 -1.46 0.00 0.00 175.22 173.43 3e9x h LEU 631 N 8.02 0.00 -3.52 0.00 5.85 -1.55 -3.01 115.31 121.10 3e9x h LEU 631 Ca -0.38 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.15 3e9x h LEU 631 Cb 1.13 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 42.05 3e9x h LEU 631 CO 0.60 0.06 0.14 0.49 -0.34 0.00 0.00 178.44 179.38 3e9x n PHE 632 N -4.15 1.70 -4.21 1.25 3.72 -1.26 -4.72 117.46 109.78 3e9x n PHE 632 Ca -0.03 -1.32 -0.26 0.00 -0.05 0.00 0.00 57.45 55.80 3e9x n PHE 632 Cb 0.15 -0.56 -0.17 0.00 -0.94 0.00 0.00 39.48 37.96 3e9x n PHE 632 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3e9x s LYS 633 N -3.07 1.58 0.00 -1.08 -0.14 -1.14 -4.27 119.74 111.61 3e9x s LYS 633 Ca 0.49 -0.32 0.00 0.00 -1.36 0.00 0.00 55.97 54.78 3e9x s LYS 633 Cb 0.41 -1.48 0.00 0.00 -1.68 0.00 0.00 37.83 35.08 3e9x s LYS 633 CO 0.08 -0.13 0.16 -1.13 -0.76 0.00 0.00 175.35 173.57 3e9x n SER 634 N 4.40 0.00 -1.82 2.83 3.41 -1.26 -4.86 113.62 116.33 3e9x n SER 634 Ca -0.18 -1.00 -0.00 0.00 -0.26 0.00 0.00 58.87 57.43 3e9x n SER 634 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 3e9x n SER 634 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3e9x n GLU 635 N 0.00 -0.28 -1.09 4.33 1.02 -1.26 -4.06 120.64 119.31 3e9x n GLU 635 Ca 0.00 0.71 -0.07 0.00 -0.02 0.00 0.00 57.16 57.78 3e9x n GLU 635 Cb 0.33 -2.37 -0.03 0.00 -0.02 0.00 0.00 31.44 29.35 3e9x n GLU 635 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 3e9x n THR 636 N -1.14 0.00 0.63 2.62 5.66 -1.26 -4.75 114.28 116.05 3e9x n THR 636 Ca 0.00 0.00 0.07 0.00 -3.05 0.00 0.00 64.05 61.07 3e9x n THR 636 Cb 0.49 -1.13 -0.00 0.00 -1.55 0.00 0.00 70.33 68.13 3e9x n THR 636 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 3e9x n LYS 637 N -0.42 1.79 -3.91 1.09 5.02 -1.26 -4.86 118.16 115.62 3e9x n LYS 637 Ca -0.07 -0.75 -0.35 0.00 -2.02 0.00 0.00 58.31 55.12 3e9x n LYS 637 Cb 0.46 -1.22 0.01 0.00 -0.02 0.00 0.00 35.03 34.27 3e9x n LYS 637 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3e9x n ASN 638 N -0.16 -4.61 -4.72 4.39 3.02 -1.26 -4.93 115.26 106.98 3e9x n ASN 638 Ca 0.06 -1.11 -0.37 0.00 -0.03 0.00 0.00 54.58 53.13 3e9x n ASN 638 Cb 0.30 -1.85 -0.07 0.00 -0.61 0.00 0.00 39.78 37.55 3e9x n ASN 638 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3e9x s LEU 639 N -6.23 4.24 0.00 3.41 1.43 -1.26 -4.43 118.68 115.84 3e9x s LEU 639 Ca 0.26 0.53 0.00 0.00 -1.03 0.00 0.00 54.13 53.90 3e9x s LEU 639 Cb -0.14 -2.41 0.00 0.00 0.03 0.00 0.00 46.19 43.67 3e9x s LEU 639 CO 0.93 0.07 0.00 0.18 0.23 0.00 0.00 176.35 177.76 3e9x n LEU 640 N 3.67 0.00 -4.04 1.79 4.77 -1.26 -4.72 117.00 117.20 3e9x n LEU 640 Ca -0.11 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.79 3e9x n LEU 640 Cb 0.52 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 3e9x n LEU 640 CO 0.40 0.00 -0.36 -0.36 -1.33 0.00 0.00 177.39 175.74 3e9x s PHE 641 N 0.00 0.42 0.29 -1.77 0.08 -1.26 -4.47 117.98 111.27 3e9x s PHE 641 Ca 0.00 -0.81 -0.29 0.00 0.12 0.00 0.00 56.93 55.95 3e9x s PHE 641 Cb 0.00 -0.31 -0.10 0.00 -0.57 0.00 0.00 43.02 42.05 3e9x s PHE 641 CO 0.00 -0.28 1.26 -0.80 -0.10 0.00 0.00 175.22 175.30 3e9x s ASN 642 N -2.24 6.91 0.56 1.36 0.01 -1.26 -4.45 114.94 115.82 3e9x s ASN 642 Ca -0.03 2.53 0.37 0.00 -0.71 0.00 0.00 52.86 55.02 3e9x s ASN 642 Cb -0.01 -2.64 1.94 0.00 0.41 0.00 0.00 41.25 40.95 3e9x s ASN 642 CO -0.06 -0.45 2.14 0.44 -1.51 0.00 0.00 177.10 177.66 3e9x h ASP 643 N 3.93 0.00 -0.45 -1.22 3.32 -1.90 -2.31 116.42 117.79 3e9x h ASP 643 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3e9x h ASP 643 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 3e9x h ASP 643 CO 0.68 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.74 3e9x n ASN 644 N -2.88 3.41 -4.69 6.45 6.94 -1.26 -4.75 115.26 118.48 3e9x n ASN 644 Ca -0.02 -2.30 -0.42 0.00 -0.02 0.00 0.00 54.58 51.82 3e9x n ASN 644 Cb 0.11 -0.48 -0.03 0.00 -2.36 0.00 0.00 39.78 37.03 3e9x n ASN 644 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 3e9x s THR 645 N -1.74 4.28 -0.04 5.53 2.01 -0.87 -4.49 115.64 120.32 3e9x s THR 645 Ca 0.35 1.61 -0.08 0.00 0.31 0.00 0.00 61.69 63.88 3e9x s THR 645 Cb 0.23 -4.03 -0.30 0.00 0.01 0.00 0.00 72.50 68.41 3e9x s THR 645 CO 0.17 0.02 0.70 -0.08 -0.69 0.00 0.00 174.62 174.74 3e9x h GLU 646 N 7.32 0.34 -2.07 4.92 4.81 -0.03 -3.46 114.58 126.41 3e9x h GLU 646 Ca -0.35 -0.58 0.22 0.00 -0.13 0.00 0.00 59.36 58.51 3e9x h GLU 646 Cb 1.17 0.22 -0.10 0.00 0.63 0.00 0.00 28.75 30.67 3e9x h GLU 646 CO 0.86 1.24 0.59 0.00 -0.73 0.00 0.00 179.01 180.97 3e9x s LEU 648 N -2.91 4.09 -0.04 0.00 1.43 -1.26 -1.10 118.68 118.90 3e9x s LEU 648 Ca 0.12 0.14 -0.04 0.00 -1.03 0.00 0.00 54.13 53.33 3e9x s LEU 648 Cb 0.00 -2.17 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 3e9x s LEU 648 CO -0.00 0.01 0.17 0.00 0.23 0.00 0.00 176.35 176.76 3e9x s ALA 649 N 1.29 3.92 0.48 4.21 0.00 0.14 -4.66 121.76 127.15 3e9x s ALA 649 Ca 0.09 -0.74 -0.23 0.00 0.00 0.00 0.00 51.96 51.08 3e9x s ALA 649 Cb -0.14 -1.89 -0.07 0.00 0.00 0.00 0.00 23.12 21.02 3e9x s ALA 649 CO 0.07 0.71 1.31 0.15 0.00 0.00 0.00 175.76 178.00 3e9x s LYS 650 N -1.70 3.55 0.00 0.00 1.02 -0.06 -2.02 119.74 120.53 3e9x s LYS 650 Ca 0.24 2.14 0.00 0.00 0.02 0.00 0.00 55.97 58.37 3e9x s LYS 650 Cb -0.12 -2.46 0.00 0.00 -0.52 0.00 0.00 37.83 34.72 3e9x s LYS 650 CO 0.15 -0.83 0.03 1.28 -0.92 0.00 0.00 175.35 175.05 3e9x n LEU 651 N -0.52 0.70 -0.08 3.17 4.77 -1.26 -4.85 117.00 118.93 3e9x n LEU 651 Ca 0.07 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 3e9x n LEU 651 Cb 0.45 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3e9x n LEU 651 CO 0.53 -0.38 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 3e9x n GLY 652 N 2.03 -1.65 0.00 -0.72 0.00 -1.26 -4.89 105.19 98.71 3e9x n GLY 652 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.95 3e9x n GLY 652 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e9x n GLY 653 N 0.80 0.75 3.57 -0.02 0.00 -1.26 -4.59 105.19 104.45 3e9x n GLY 653 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 3e9x n GLY 653 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3e9x n ARG 654 N -1.84 -0.68 -1.80 1.61 1.74 -1.26 -4.80 116.66 109.64 3e9x n ARG 654 Ca 0.00 -0.03 -0.41 0.00 -0.77 0.00 0.00 57.85 56.64 3e9x n ARG 654 Cb 0.00 -0.74 -0.01 0.00 -1.02 0.00 0.00 32.46 30.69 3e9x n ARG 654 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 3e9x s PRO 655 N -5.01 4.13 0.69 5.56 0.02 -1.26 -5.05 135.00 134.08 3e9x s PRO 655 Ca 0.13 2.56 -0.09 0.00 0.02 0.00 0.00 61.00 63.62 3e9x s PRO 655 Cb -0.08 -3.02 0.03 0.00 0.02 0.00 0.00 34.50 31.46 3e9x s PRO 655 CO 0.43 -0.60 1.04 0.95 -0.33 0.00 0.00 177.00 178.48 3e9x s THR 656 N -0.19 3.08 0.54 0.99 -4.23 -1.26 -4.71 115.64 109.85 3e9x s THR 656 Ca 0.61 0.14 0.21 0.00 -1.18 0.00 0.00 61.69 61.48 3e9x s THR 656 Cb -0.47 -3.31 0.33 0.00 1.34 0.00 0.00 72.50 70.38 3e9x s THR 656 CO 0.50 -0.37 2.11 0.10 -0.54 0.00 0.00 174.62 176.42 3e9x h TYR 657 N -0.58 0.00 -0.30 3.99 -0.00 -1.94 -0.64 116.97 117.51 3e9x h TYR 657 Ca -0.45 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 58.14 3e9x h TYR 657 Cb 1.28 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 38.00 3e9x h TYR 657 CO 0.43 0.00 -0.37 0.93 -0.00 0.00 0.00 178.16 179.16 3e9x h GLU 658 N 0.00 0.77 0.00 0.10 5.08 -1.95 -2.19 114.58 116.39 3e9x h GLU 658 Ca 0.08 -0.43 -0.13 0.00 -1.00 0.00 0.00 59.36 57.88 3e9x h GLU 658 Cb 0.35 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 3e9x h GLU 658 CO -0.00 1.06 -0.60 0.93 -1.00 0.00 0.00 179.01 179.40 3e9x h GLU 659 N 0.53 0.00 -0.20 2.33 5.08 -1.59 -1.58 114.58 119.14 3e9x h GLU 659 Ca 0.04 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 3e9x h GLU 659 Cb 0.95 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.20 3e9x h GLU 659 CO 0.09 0.60 -0.14 -0.92 -1.00 0.00 0.00 179.01 177.65 3e9x h TYR 660 N 0.00 0.53 0.00 4.33 3.20 -1.10 -3.03 116.97 120.90 3e9x h TYR 660 Ca -0.01 -0.14 -0.03 0.00 3.14 0.00 0.00 58.73 61.69 3e9x h TYR 660 Cb 1.23 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 39.37 3e9x h TYR 660 CO 0.00 0.77 -0.16 -0.07 -1.64 0.00 0.00 178.16 177.05 3e9x h LEU 661 N 0.14 0.00 0.00 2.82 3.38 -1.38 -3.48 115.31 116.78 3e9x h LEU 661 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3e9x h LEU 661 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3e9x h LEU 661 CO 0.04 0.16 0.00 0.61 0.09 0.00 0.00 178.44 179.34 3e9x n GLY 662 N 0.23 -0.32 0.21 0.83 0.00 -0.60 -4.48 105.19 101.06 3e9x n GLY 662 Ca 0.01 -1.58 -0.08 0.00 0.00 0.00 0.00 46.02 44.37 3e9x n GLY 662 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3e9x h THR 663 N 0.00 1.33 -0.36 2.61 2.02 -1.88 -2.68 112.91 113.94 3e9x h THR 663 Ca 0.00 -1.76 -0.16 0.00 0.77 0.00 0.00 66.41 65.27 3e9x h THR 663 Cb 0.00 1.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 3e9x h THR 663 CO 0.00 0.54 -0.38 1.05 0.37 0.00 0.00 175.52 177.10 3e9x h GLU 664 N 0.37 0.88 -0.34 6.66 4.11 -1.96 -2.83 114.58 121.47 3e9x h GLU 664 Ca 0.01 -0.46 -0.17 0.00 0.07 0.00 0.00 59.36 58.82 3e9x h GLU 664 Cb 1.03 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 3e9x h GLU 664 CO 0.09 1.10 -0.44 -0.92 0.07 0.00 0.00 179.01 178.92 3e9x h TYR 665 N 0.72 1.07 -0.43 2.06 3.20 -1.78 -2.64 116.97 119.16 3e9x h TYR 665 Ca 0.06 -0.34 -0.04 0.00 3.14 0.00 0.00 58.73 61.55 3e9x h TYR 665 Cb 0.97 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.00 3e9x h TYR 665 CO 0.06 1.16 0.11 0.28 -1.64 0.00 0.00 178.16 178.13 3e9x h VAL 666 N 0.70 1.19 -0.11 1.81 2.07 -1.47 -1.57 116.25 118.88 3e9x h VAL 666 Ca 0.04 -0.66 -0.16 0.00 0.82 0.00 0.00 66.70 66.74 3e9x h VAL 666 Cb 1.03 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 3e9x h VAL 666 CO 0.10 0.25 -0.63 0.71 0.02 0.00 0.00 177.57 178.02 3e9x h THR 667 N 0.63 1.36 -0.11 2.57 1.35 -1.41 -2.17 112.91 115.13 3e9x h THR 667 Ca 0.15 -1.98 0.00 0.00 -0.55 0.00 0.00 66.41 64.03 3e9x h THR 667 Cb 0.22 1.97 -0.01 0.00 -1.73 0.00 0.00 68.15 68.61 3e9x h THR 667 CO -0.00 0.60 0.07 0.00 -0.25 0.00 0.00 175.52 175.94 3e9x h ALA 668 N 1.03 0.15 -0.58 6.62 0.00 -1.01 -1.46 119.26 124.00 3e9x h ALA 668 Ca -0.01 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3e9x h ALA 668 Cb 1.17 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 3e9x h ALA 668 CO 0.11 -0.36 0.38 0.82 0.00 0.00 0.00 179.25 180.19 3e9x h ILE 669 N 0.15 1.12 0.59 0.00 1.08 -1.24 -2.10 117.51 117.11 3e9x h ILE 669 Ca 0.04 -0.26 -0.02 0.00 -0.39 0.00 0.00 64.86 64.23 3e9x h ILE 669 Cb -0.01 0.29 -0.00 0.00 -3.07 0.00 0.00 36.82 34.03 3e9x h ILE 669 CO -0.01 0.14 -0.36 0.00 -0.69 0.00 0.00 178.15 177.23 3e9x h ALA 670 N 1.23 -0.91 -0.93 1.87 0.00 -1.09 -1.05 119.26 118.38 3e9x h ALA 670 Ca 0.22 -0.18 0.13 0.00 0.00 0.00 0.00 54.91 55.08 3e9x h ALA 670 Cb -0.05 0.44 -0.08 0.00 0.00 0.00 0.00 17.79 18.10 3e9x h ALA 670 CO -0.07 -1.03 0.59 -0.91 0.00 0.00 0.00 179.25 177.84 3e9x h ASN 671 N -0.90 0.76 -0.37 0.00 2.35 -1.19 -1.22 115.58 115.02 3e9x h ASN 671 Ca -0.07 0.04 -0.14 0.00 -0.55 0.00 0.00 56.30 55.58 3e9x h ASN 671 Cb 0.72 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 3e9x h ASN 671 CO 0.08 0.39 -0.28 0.25 -1.65 0.00 0.00 177.43 176.23 3e9x h LEU 672 N 0.81 0.92 -1.79 1.61 5.85 -1.11 -2.99 115.31 118.61 3e9x h LEU 672 Ca 0.46 -0.37 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 3e9x h LEU 672 Cb 0.62 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.39 3e9x h LEU 672 CO -0.23 1.14 -0.15 0.11 -0.34 0.00 0.00 178.44 178.96 3e9x h LYS 673 N 0.76 0.00 -0.99 1.25 1.79 0.00 -2.33 116.57 117.04 3e9x h LYS 673 Ca 0.09 0.00 0.12 0.00 -2.18 0.00 0.00 60.65 58.67 3e9x h LYS 673 Cb 0.84 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.41 3e9x h LYS 673 CO 0.07 0.15 0.62 0.87 -1.08 0.00 0.00 179.45 180.09 3e9x h LYS 674 N 0.00 0.97 -0.15 3.15 1.57 -1.26 -2.66 116.57 118.19 3e9x h LYS 674 Ca -0.00 -0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.77 3e9x h LYS 674 Cb 0.33 -0.22 -0.05 0.00 0.08 0.00 0.00 32.23 32.37 3e9x h LYS 674 CO 0.02 0.64 -0.19 0.00 -0.57 0.00 0.00 179.45 179.35 3e9x n SER 676 N -5.33 1.29 0.14 0.00 2.88 -1.01 -5.04 113.62 106.55 3e9x n SER 676 Ca -0.02 -0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.42 3e9x n SER 676 Cb 0.24 1.65 0.00 0.00 -0.75 0.00 0.00 64.21 65.35 3e9x n SER 676 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3e9x n LEU 681 N -1.98 -1.21 -3.65 2.46 7.94 -1.26 -5.09 117.00 114.21 3e9x n LEU 681 Ca -0.02 0.49 -0.29 0.00 -1.11 0.00 0.00 56.01 55.08 3e9x n LEU 681 Cb 0.40 1.28 -0.15 0.00 0.53 0.00 0.00 43.42 45.48 3e9x n LEU 681 CO 0.33 -0.44 -0.34 -0.70 -1.11 0.00 0.00 177.39 175.14 3e9x s GLU 682 N -1.75 0.45 0.00 1.96 2.56 -1.26 -5.09 118.70 115.56 3e9x s GLU 682 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 54.97 54.28 3e9x s GLU 682 Cb 0.00 -1.66 0.00 0.00 2.00 0.00 0.00 34.13 34.47 3e9x s GLU 682 CO 0.00 -0.93 0.00 0.00 -0.56 0.00 0.00 175.26 173.77 3e9x n ALA 683 N 5.07 0.00 -2.42 6.30 0.00 -1.26 -5.12 120.51 123.07 3e9x n ALA 683 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.97 3e9x n ALA 683 Cb 0.43 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.85 3e9x n ALA 683 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3e9x n ALA 685 N 3.76 1.73 -0.64 0.00 0.00 -1.26 -5.03 120.51 119.07 3e9x n ALA 685 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3e9x n ALA 685 Cb 0.47 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.89 3e9x n ALA 685 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69