#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dwa n THR 343 N 0.00 0.04 -5.09 -0.72 5.66 -1.26 -4.68 114.28 108.23 2dwa n THR 343 Ca 0.00 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.68 2dwa n THR 343 Cb 0.00 -0.19 -0.16 0.00 -1.55 0.00 0.00 70.33 68.42 2dwa n THR 343 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 2dwa s ARG 344 N -0.73 3.12 -0.13 1.09 3.52 -1.26 -4.91 118.95 119.65 2dwa s ARG 344 Ca 0.00 -0.84 -0.02 0.00 -0.13 0.00 0.00 55.73 54.75 2dwa s ARG 344 Cb 0.00 -2.38 -0.02 0.00 -1.56 0.00 0.00 34.95 30.98 2dwa s ARG 344 CO 0.00 0.17 -0.08 0.08 -0.81 0.00 0.00 175.30 174.67 2dwa s VAL 345 N 0.38 3.56 -0.37 7.11 1.01 -0.79 -5.02 120.40 126.28 2dwa s VAL 345 Ca -0.16 -0.49 -0.15 0.00 0.00 0.00 0.00 61.98 61.18 2dwa s VAL 345 Cb -0.17 -2.52 -0.00 0.00 0.00 0.00 0.00 36.38 33.68 2dwa s VAL 345 CO 0.08 0.52 0.35 -0.69 0.00 0.00 0.00 175.10 175.36 2dwa s VAL 346 N 0.14 5.18 0.28 2.92 1.01 -1.26 -1.17 120.40 127.50 2dwa s VAL 346 Ca -0.03 -0.16 -0.20 0.00 0.00 0.00 0.00 61.98 61.59 2dwa s VAL 346 Cb -0.14 -3.86 -0.09 0.00 0.00 0.00 0.00 36.38 32.29 2dwa s VAL 346 CO 0.04 -0.17 0.78 0.86 0.00 0.00 0.00 175.10 176.60 2dwa s TRP 347 N 1.95 3.56 -0.27 5.22 -0.11 0.60 -0.19 118.94 129.70 2dwa s TRP 347 Ca 0.10 1.43 -0.09 0.00 1.22 0.00 0.00 56.10 58.76 2dwa s TRP 347 Cb -0.17 -2.66 -0.03 0.00 -1.50 0.00 0.00 33.47 29.11 2dwa s TRP 347 CO 0.12 0.23 0.13 0.00 -4.62 0.00 0.00 176.95 172.80 2dwa s ALA 349 N 1.66 3.75 -0.40 0.00 0.00 0.43 -4.78 121.76 122.41 2dwa s ALA 349 Ca 0.06 -0.38 -0.12 0.00 0.00 0.00 0.00 51.96 51.52 2dwa s ALA 349 Cb -0.16 -2.25 0.04 0.00 0.00 0.00 0.00 23.12 20.75 2dwa s ALA 349 CO 0.06 0.49 0.26 0.08 0.00 0.00 0.00 175.76 176.66 2dwa s VAL 350 N -0.92 4.73 0.00 0.00 1.01 -1.26 -1.49 120.40 122.47 2dwa s VAL 350 Ca 0.20 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.23 2dwa s VAL 350 Cb -0.15 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.52 2dwa s VAL 350 CO 0.09 -0.35 0.00 0.61 0.00 0.00 0.00 175.10 175.45 2dwa n GLY 351 N 5.04 -1.46 0.20 4.51 0.00 0.03 -4.32 105.19 109.19 2dwa n GLY 351 Ca -0.11 -1.57 0.06 0.00 0.00 0.00 0.00 46.02 44.39 2dwa n GLY 351 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dwa h PRO 352 N 0.00 0.00 0.04 1.61 0.13 -1.94 -2.35 132.00 129.50 2dwa h PRO 352 Ca 0.00 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.87 2dwa h PRO 352 Cb 0.00 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.15 2dwa h PRO 352 CO 0.00 0.33 -1.03 0.93 -0.23 0.00 0.00 178.00 178.00 2dwa h GLU 353 N 0.00 0.63 -0.30 0.86 5.08 -1.97 -2.07 114.58 116.81 2dwa h GLU 353 Ca -0.00 -0.73 -0.09 0.00 -1.00 0.00 0.00 59.36 57.54 2dwa h GLU 353 Cb 0.68 0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 2dwa h GLU 353 CO 0.04 1.31 -0.21 0.93 -1.00 0.00 0.00 179.01 180.08 2dwa h GLU 354 N 0.26 0.55 -0.30 2.33 5.08 -1.74 -2.63 114.58 118.13 2dwa h GLU 354 Ca -0.14 -0.20 0.03 0.00 -1.00 0.00 0.00 59.36 58.06 2dwa h GLU 354 Cb 1.70 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.88 2dwa h GLU 354 CO 0.20 0.73 0.10 0.37 -1.00 0.00 0.00 179.01 179.41 2dwa h GLN 355 N 0.49 0.22 -0.26 2.33 4.15 -1.33 0.02 115.11 120.74 2dwa h GLN 355 Ca 0.08 -0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.51 2dwa h GLN 355 Cb 0.64 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.25 2dwa h GLN 355 CO 0.05 0.15 0.08 -0.22 -1.93 0.00 0.00 178.83 176.96 2dwa h LYS 356 N 0.23 0.19 -0.65 1.69 3.64 -1.25 -0.36 116.57 120.06 2dwa h LYS 356 Ca 0.13 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.52 2dwa h LYS 356 Cb 0.10 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.85 2dwa h LYS 356 CO -0.14 0.13 0.41 -0.22 -2.27 0.00 0.00 179.45 177.36 2dwa h LYS 357 N 0.20 0.81 -0.72 1.90 3.64 -1.30 -2.62 116.57 118.48 2dwa h LYS 357 Ca 0.12 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 2dwa h LYS 357 Cb 0.09 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 31.69 2dwa h LYS 357 CO -0.13 0.53 0.42 0.00 -2.27 0.00 0.00 179.45 178.01 2dwa h GLN 359 N 0.98 1.06 0.09 0.00 1.08 -0.78 0.50 115.11 118.04 2dwa h GLN 359 Ca 0.26 -0.09 -0.00 0.00 -1.45 0.00 0.00 58.65 57.36 2dwa h GLN 359 Cb -0.01 -0.22 0.00 0.00 -0.05 0.00 0.00 27.48 27.19 2dwa h GLN 359 CO -0.05 0.74 -0.05 1.96 -0.95 0.00 0.00 178.83 180.49 2dwa h GLN 360 N 1.08 -0.12 -0.75 1.46 4.20 -1.14 -0.17 115.11 119.66 2dwa h GLN 360 Ca 0.28 0.01 0.08 0.00 0.06 0.00 0.00 58.65 59.08 2dwa h GLN 360 Cb -0.05 0.03 -0.07 0.00 0.30 0.00 0.00 27.48 27.69 2dwa h GLN 360 CO -0.05 0.02 0.41 2.35 -0.67 0.00 0.00 178.83 180.89 2dwa h TRP 361 N -0.24 0.75 0.11 2.96 7.01 -0.94 -0.51 115.95 125.09 2dwa h TRP 361 Ca -0.01 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.01 2dwa h TRP 361 Cb 0.20 -0.22 -0.00 0.00 -2.10 0.00 0.00 29.16 27.04 2dwa h TRP 361 CO -0.03 0.31 -0.06 1.03 -2.79 0.00 0.00 178.44 176.90 2dwa h SER 362 N 0.71 -0.14 0.04 2.65 0.87 0.23 -0.72 113.55 117.19 2dwa h SER 362 Ca 0.36 0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.95 2dwa h SER 362 Cb 0.32 0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.27 2dwa h SER 362 CO -0.24 -0.10 -0.38 -0.61 -0.53 0.00 0.00 176.83 174.98 2dwa h GLN 363 N -0.16 -0.54 0.00 2.24 4.15 -0.67 -1.79 115.11 118.35 2dwa h GLN 363 Ca -0.01 0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.43 2dwa h GLN 363 Cb 0.13 0.12 -0.00 0.00 0.21 0.00 0.00 27.48 27.94 2dwa h GLN 363 CO 0.02 -0.36 -0.07 1.96 -1.93 0.00 0.00 178.83 178.45 2dwa h GLN 364 N -0.56 0.00 -0.01 1.69 1.08 -1.01 -1.78 115.11 114.53 2dwa h GLN 364 Ca 0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 2dwa h GLN 364 Cb 0.62 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.05 2dwa h GLN 364 CO -0.27 0.07 -0.05 -1.13 -0.95 0.00 0.00 178.83 176.50 2dwa n SER 365 N -4.14 0.89 -2.79 1.46 3.41 -0.28 -4.93 113.62 107.23 2dwa n SER 365 Ca -0.03 -1.13 -0.18 0.00 -0.26 0.00 0.00 58.87 57.27 2dwa n SER 365 Cb 0.16 -0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.16 2dwa n SER 365 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dwa n GLY 366 N 1.17 -0.18 2.48 5.00 0.00 -0.67 -2.35 105.19 110.64 2dwa n GLY 366 Ca 0.19 0.02 -0.09 0.00 0.00 0.00 0.00 46.02 46.13 2dwa n GLY 366 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dwa n GLN 367 N -3.85 -1.06 0.12 1.61 1.13 -0.70 -4.87 117.38 109.76 2dwa n GLN 367 Ca 0.00 0.76 -0.00 0.00 -1.94 0.00 0.00 57.00 55.82 2dwa n GLN 367 Cb 0.55 -4.80 0.29 0.00 0.11 0.00 0.00 30.24 26.38 2dwa n GLN 367 CO 0.00 0.00 0.00 -0.91 -1.44 0.00 0.00 177.06 174.71 2dwa h ASN 368 N 0.00 0.20 -3.67 1.08 2.35 -1.70 -3.41 115.58 110.43 2dwa h ASN 368 Ca -0.19 -0.07 -0.68 0.00 -0.55 0.00 0.00 56.30 54.82 2dwa h ASN 368 Cb 0.81 -0.05 -0.28 0.00 0.05 0.00 0.00 38.32 38.84 2dwa h ASN 368 CO 0.27 0.53 -0.81 -0.69 -1.65 0.00 0.00 177.43 175.08 2dwa s VAL 369 N -4.29 2.66 0.48 2.81 1.01 -1.26 -1.88 120.40 119.93 2dwa s VAL 369 Ca -0.04 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.13 2dwa s VAL 369 Cb 0.14 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.44 2dwa s VAL 369 CO 0.75 0.56 0.03 0.42 0.00 0.00 0.00 175.10 176.86 2dwa s THR 370 N -0.03 1.11 -0.04 3.92 -4.23 -0.32 -4.28 115.64 111.77 2dwa s THR 370 Ca -0.05 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.50 2dwa s THR 370 Cb -0.14 -2.29 -0.00 0.00 1.34 0.00 0.00 72.50 71.40 2dwa s THR 370 CO 0.04 0.00 -0.14 0.00 -0.54 0.00 0.00 174.62 173.98 2dwa s ALA 372 N 0.09 2.91 -0.00 0.00 0.00 0.03 -4.92 121.76 119.87 2dwa s ALA 372 Ca -0.04 -1.54 0.03 0.00 0.00 0.00 0.00 51.96 50.41 2dwa s ALA 372 Cb -0.10 -0.66 -0.01 0.00 0.00 0.00 0.00 23.12 22.34 2dwa s ALA 372 CO 0.02 0.43 -0.09 0.99 0.00 0.00 0.00 175.76 177.10 2dwa s THR 373 N -1.83 0.73 0.10 0.00 2.01 -1.26 -0.43 115.64 114.96 2dwa s THR 373 Ca 0.25 -0.46 0.01 0.00 0.31 0.00 0.00 61.69 61.81 2dwa s THR 373 Cb -0.08 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.76 2dwa s THR 373 CO 0.15 0.16 -0.03 0.00 -0.69 0.00 0.00 174.62 174.22 2dwa s ALA 374 N -0.30 0.90 -0.31 7.40 0.00 -0.56 -4.95 121.76 123.94 2dwa s ALA 374 Ca 0.03 -1.37 0.20 0.00 0.00 0.00 0.00 51.96 50.81 2dwa s ALA 374 Cb -0.04 0.35 0.20 0.00 0.00 0.00 0.00 23.12 23.63 2dwa s ALA 374 CO -0.00 -0.32 1.49 0.77 0.00 0.00 0.00 175.76 177.70 2dwa h SER 375 N 2.96 0.00 -5.25 0.00 0.02 -1.95 0.12 113.55 109.44 2dwa h SER 375 Ca -0.35 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.43 2dwa h SER 375 Cb 1.17 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.56 2dwa h SER 375 CO 0.64 0.22 -0.66 0.42 -1.14 0.00 0.00 176.83 176.31 2dwa s THR 376 N -3.11 0.21 0.17 -2.27 -4.23 -1.26 -4.46 115.64 100.69 2dwa s THR 376 Ca 0.05 -1.88 -0.10 0.00 -1.18 0.00 0.00 61.69 58.57 2dwa s THR 376 Cb 0.06 -1.86 0.05 0.00 1.34 0.00 0.00 72.50 72.09 2dwa s THR 376 CO 0.71 -0.66 1.64 0.74 -0.54 0.00 0.00 174.62 176.51 2dwa h THR 377 N 2.95 1.26 -0.71 3.99 2.02 -1.90 -1.75 112.91 118.77 2dwa h THR 377 Ca -0.35 -1.10 0.03 0.00 0.77 0.00 0.00 66.41 65.75 2dwa h THR 377 Cb 1.18 0.83 -0.04 0.00 -1.74 0.00 0.00 68.15 68.38 2dwa h THR 377 CO 0.62 0.40 0.45 0.44 0.37 0.00 0.00 175.52 177.80 2dwa h ASP 378 N 0.90 0.74 -0.47 4.18 3.32 -1.96 -0.06 116.42 123.07 2dwa h ASP 378 Ca 0.17 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.18 2dwa h ASP 378 Cb 0.52 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.88 2dwa h ASP 378 CO 0.03 0.52 0.18 0.44 -1.72 0.00 0.00 179.24 178.68 2dwa h ASP 379 N 0.88 0.71 -0.71 6.45 5.19 -1.91 -1.98 116.42 125.05 2dwa h ASP 379 Ca 0.28 -0.10 -0.04 0.00 -0.62 0.00 0.00 57.03 56.55 2dwa h ASP 379 Cb -0.01 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 39.29 2dwa h ASP 379 CO -0.10 0.67 0.28 0.00 -3.12 0.00 0.00 179.24 176.96 2dwa h ILE 381 N 1.02 1.21 -0.52 0.00 2.04 -0.50 -1.49 117.51 119.27 2dwa h ILE 381 Ca 0.24 -0.43 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 2dwa h ILE 381 Cb 0.22 -0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.13 2dwa h ILE 381 CO -0.02 0.23 0.21 0.58 0.00 0.00 0.00 178.15 179.15 2dwa h VAL 382 N 1.25 1.22 -0.73 1.67 2.07 -1.25 -1.52 116.25 118.96 2dwa h VAL 382 Ca 0.36 -0.68 0.07 0.00 0.82 0.00 0.00 66.70 67.27 2dwa h VAL 382 Cb -0.09 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.30 2dwa h VAL 382 CO -0.09 0.26 0.41 -0.07 0.02 0.00 0.00 177.57 178.10 2dwa h LEU 383 N 0.71 0.60 -0.48 2.57 3.38 -0.75 -0.68 115.31 120.65 2dwa h LEU 383 Ca 0.17 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 2dwa h LEU 383 Cb 0.20 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2dwa h LEU 383 CO -0.01 0.37 0.23 0.58 0.09 0.00 0.00 178.44 179.69 2dwa h VAL 384 N 0.73 1.19 -0.87 1.22 2.07 -1.00 -0.25 116.25 119.33 2dwa h VAL 384 Ca 0.34 -0.54 0.01 0.00 0.82 0.00 0.00 66.70 67.32 2dwa h VAL 384 Cb 0.26 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 2dwa h VAL 384 CO -0.21 0.21 0.57 -0.07 0.02 0.00 0.00 177.57 178.09 2dwa h LEU 385 N 0.63 1.01 -1.54 2.57 3.38 -0.90 -1.42 115.31 119.06 2dwa h LEU 385 Ca 0.16 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2dwa h LEU 385 Cb 0.13 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2dwa h LEU 385 CO -0.02 0.75 0.00 0.11 0.09 0.00 0.00 178.44 179.37 2dwa h LYS 386 N 1.19 0.00 0.00 1.13 1.57 -0.87 -3.46 116.57 116.13 2dwa h LYS 386 Ca 0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 2dwa h LYS 386 Cb -0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.19 2dwa h LYS 386 CO -0.07 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.22 2dwa n GLY 387 N -0.10 0.67 0.12 3.86 0.00 -0.53 -4.95 105.19 104.26 2dwa n GLY 387 Ca 0.00 -0.26 0.12 0.00 0.00 0.00 0.00 46.02 45.88 2dwa n GLY 387 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dwa h GLU 388 N 1.33 0.00 -5.03 1.61 5.08 -1.29 -3.45 114.58 112.83 2dwa h GLU 388 Ca 0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.04 2dwa h GLU 388 Cb 0.00 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.10 2dwa h GLU 388 CO 0.00 0.00 -0.70 0.00 -1.00 0.00 0.00 179.01 177.31 2dwa s ALA 389 N -3.28 1.46 -0.20 3.43 0.00 -1.04 -4.93 121.76 117.20 2dwa s ALA 389 Ca 0.03 -1.53 0.05 0.00 0.00 0.00 0.00 51.96 50.51 2dwa s ALA 389 Cb 0.10 0.15 -0.21 0.00 0.00 0.00 0.00 23.12 23.15 2dwa s ALA 389 CO 0.74 -0.14 0.01 -0.25 0.00 0.00 0.00 175.76 176.13 2dwa n ASP 390 N -0.22 1.46 -3.49 0.00 8.00 0.73 -4.11 116.55 118.92 2dwa n ASP 390 Ca -0.09 -0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.28 2dwa n ASP 390 Cb 0.61 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 41.54 2dwa n ASP 390 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dwa s ALA 391 N -2.53 -1.75 0.18 2.24 0.00 -1.15 -4.12 121.76 114.63 2dwa s ALA 391 Ca -0.25 0.99 -0.23 0.00 0.00 0.00 0.00 51.96 52.48 2dwa s ALA 391 Cb 0.08 0.31 0.06 0.00 0.00 0.00 0.00 23.12 23.57 2dwa s ALA 391 CO 0.70 -0.58 0.66 -0.48 0.00 0.00 0.00 175.76 176.06 2dwa s LEU 392 N -2.05 -0.47 -0.16 0.00 2.34 -1.16 -1.25 118.68 115.93 2dwa s LEU 392 Ca -0.01 -0.16 -0.14 0.00 0.06 0.00 0.00 54.13 53.88 2dwa s LEU 392 Cb -0.01 2.57 -0.05 0.00 -0.56 0.00 0.00 46.19 48.15 2dwa s LEU 392 CO -0.04 -1.03 0.30 0.21 -1.06 0.00 0.00 176.35 174.73 2dwa s ASN 393 N -2.78 6.43 0.01 1.48 2.47 -1.26 -1.00 114.94 120.29 2dwa s ASN 393 Ca 0.04 0.51 0.06 0.00 0.42 0.00 0.00 52.86 53.89 2dwa s ASN 393 Cb -0.02 -2.19 -0.02 0.00 -1.45 0.00 0.00 41.25 37.57 2dwa s ASN 393 CO -0.07 0.09 -0.18 -0.76 -3.72 0.00 0.00 177.10 172.45 2dwa s LEU 394 N 0.53 2.09 0.70 3.21 1.43 0.02 -4.91 118.68 121.75 2dwa s LEU 394 Ca 0.17 -0.39 -0.16 0.00 -1.03 0.00 0.00 54.13 52.72 2dwa s LEU 394 Cb -0.13 -0.91 0.02 0.00 0.03 0.00 0.00 46.19 45.20 2dwa s LEU 394 CO 0.04 0.19 1.20 -0.62 0.23 0.00 0.00 176.35 177.39 2dwa s ASP 395 N -0.71 4.43 0.30 2.29 2.15 -1.26 -1.84 116.67 122.02 2dwa s ASP 395 Ca 0.07 2.34 0.04 0.00 0.43 0.00 0.00 52.55 55.42 2dwa s ASP 395 Cb -0.08 -2.59 0.76 0.00 -0.30 0.00 0.00 42.92 40.72 2dwa s ASP 395 CO 0.00 -2.10 1.67 1.23 -0.17 0.00 0.00 175.17 175.79 2dwa h GLY 396 N -0.08 1.51 1.25 2.66 0.00 -1.81 -0.98 103.07 105.62 2dwa h GLY 396 Ca -0.48 -0.11 0.04 0.00 0.00 0.00 0.00 47.33 46.78 2dwa h GLY 396 CO 0.51 -0.34 0.40 -1.33 0.00 0.00 0.00 176.54 175.78 2dwa h GLY 397 N 0.29 0.79 1.85 4.60 0.00 -1.89 -2.32 103.07 106.40 2dwa h GLY 397 Ca 0.58 -0.27 -0.22 0.00 0.00 0.00 0.00 47.33 47.42 2dwa h GLY 397 CO -0.60 0.22 -1.10 -0.97 0.00 0.00 0.00 176.54 174.09 2dwa h TYR 398 N 0.67 0.02 -0.61 5.60 0.05 -1.33 -3.14 116.97 118.23 2dwa h TYR 398 Ca 0.25 -0.01 0.04 0.00 0.05 0.00 0.00 58.73 59.05 2dwa h TYR 398 Cb 0.15 -0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.85 2dwa h TYR 398 CO -0.00 1.01 0.40 0.82 -1.05 0.00 0.00 178.16 179.34 2dwa h ILE 399 N 0.00 1.07 -0.13 -2.88 2.04 -0.85 0.14 117.51 116.90 2dwa h ILE 399 Ca -0.05 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.57 2dwa h ILE 399 Cb 1.81 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 2dwa h ILE 399 CO 0.13 0.13 0.07 0.22 0.00 0.00 0.00 178.15 178.69 2dwa h TYR 400 N 0.70 0.18 -0.01 1.37 3.20 -1.39 0.16 116.97 121.18 2dwa h TYR 400 Ca 0.24 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.12 2dwa h TYR 400 Cb 0.10 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 2dwa h TYR 400 CO -0.00 0.20 -0.08 1.15 -1.64 0.00 0.00 178.16 177.79 2dwa h THR 401 N 0.10 0.79 -0.79 1.81 2.02 -1.40 -2.59 112.91 112.85 2dwa h THR 401 Ca 0.05 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.18 2dwa h THR 401 Cb 0.09 0.79 -0.04 0.00 -1.74 0.00 0.00 68.15 67.25 2dwa h THR 401 CO -0.01 0.00 0.34 0.00 0.37 0.00 0.00 175.52 176.22 2dwa h ALA 402 N 0.86 1.10 -0.70 6.16 0.00 -0.68 -3.04 119.26 122.96 2dwa h ALA 402 Ca 0.04 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 2dwa h ALA 402 Cb 0.18 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2dwa h ALA 402 CO -0.09 0.65 0.14 0.78 0.00 0.00 0.00 179.25 180.73 2dwa h GLY 403 N 1.16 1.22 2.00 0.00 0.00 -0.55 -0.73 103.07 106.18 2dwa h GLY 403 Ca 0.27 -0.80 -0.01 0.00 0.00 0.00 0.00 47.33 46.79 2dwa h GLY 403 CO -0.03 0.74 -0.03 0.50 0.00 0.00 0.00 176.54 177.72 2dwa h LYS 404 N 1.07 0.00 -0.47 4.80 1.57 -1.35 -1.38 116.57 120.82 2dwa h LYS 404 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2dwa h LYS 404 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2dwa h LYS 404 CO 0.01 0.03 0.00 0.00 -0.57 0.00 0.00 179.45 178.92 2dwa n GLY 406 N 1.39 0.71 3.82 0.00 0.00 -0.52 -5.04 105.19 105.55 2dwa n GLY 406 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 2dwa n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dwa s LEU 407 N 0.00 3.80 0.11 0.99 1.43 -0.39 -4.04 118.68 120.58 2dwa s LEU 407 Ca 0.00 1.74 0.10 0.00 -1.03 0.00 0.00 54.13 54.94 2dwa s LEU 407 Cb 0.00 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.65 2dwa s LEU 407 CO 0.00 -0.60 -0.25 0.68 0.23 0.00 0.00 176.35 176.41 2dwa s VAL 408 N -2.26 2.08 0.26 -1.59 -7.23 0.62 -4.06 120.40 108.22 2dwa s VAL 408 Ca 0.63 -1.64 -0.29 0.00 -1.81 0.00 0.00 61.98 58.86 2dwa s VAL 408 Cb -0.12 -1.85 -0.09 0.00 0.56 0.00 0.00 36.38 34.88 2dwa s VAL 408 CO 0.21 0.08 1.16 -2.16 -0.31 0.00 0.00 175.10 174.09 2dwa s PRO 409 N -1.90 4.55 -0.07 4.82 0.04 -1.26 -1.60 135.00 139.57 2dwa s PRO 409 Ca 0.12 1.90 -0.03 0.00 0.04 0.00 0.00 61.00 63.02 2dwa s PRO 409 Cb -0.10 -3.18 -0.03 0.00 0.04 0.00 0.00 34.50 31.22 2dwa s PRO 409 CO 0.05 0.05 -0.09 0.28 0.04 0.00 0.00 177.00 177.33 2dwa n VAL 410 N 1.53 0.41 -3.75 -0.36 0.31 0.60 -4.94 118.33 112.12 2dwa n VAL 410 Ca 0.01 -0.11 -0.13 0.00 -0.01 0.00 0.00 64.34 64.09 2dwa n VAL 410 Cb 0.44 -1.49 -0.09 0.00 -0.91 0.00 0.00 33.84 31.79 2dwa n VAL 410 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2dwa s LEU 411 N -6.27 0.80 0.01 7.52 1.43 -1.24 -4.48 118.68 116.44 2dwa s LEU 411 Ca -0.10 0.18 0.05 0.00 -1.03 0.00 0.00 54.13 53.23 2dwa s LEU 411 Cb 0.04 1.28 -0.03 0.00 0.03 0.00 0.00 46.19 47.51 2dwa s LEU 411 CO 0.14 -0.41 -0.13 0.00 0.23 0.00 0.00 176.35 176.18 2dwa s ALA 412 N -1.12 2.78 0.30 4.21 0.00 -0.26 -0.47 121.76 127.20 2dwa s ALA 412 Ca -0.12 -1.09 -0.30 0.00 0.00 0.00 0.00 51.96 50.46 2dwa s ALA 412 Cb -0.05 -0.94 -0.12 0.00 0.00 0.00 0.00 23.12 22.02 2dwa s ALA 412 CO 0.04 0.59 1.53 0.39 0.00 0.00 0.00 175.76 178.31 2dwa n GLU 413 N 1.68 2.56 -4.33 0.00 1.02 -0.19 0.02 120.64 121.40 2dwa n GLU 413 Ca -0.16 0.91 -0.26 0.00 -0.02 0.00 0.00 57.16 57.63 2dwa n GLU 413 Cb 0.52 -2.65 -0.17 0.00 -0.02 0.00 0.00 31.44 29.13 2dwa n GLU 413 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2dwa s ASN 414 N 0.32 1.98 0.54 1.62 3.04 -0.26 -4.78 114.94 117.42 2dwa s ASN 414 Ca 0.63 -0.32 0.09 0.00 0.04 0.00 0.00 52.86 53.30 2dwa s ASN 414 Cb -0.52 -0.86 0.07 0.00 -1.54 0.00 0.00 41.25 38.39 2dwa s ASN 414 CO 0.52 -0.02 0.71 0.00 -3.04 0.00 0.00 177.10 175.27 2dwa s ARG 415 N 1.06 2.38 0.50 0.43 1.70 -1.26 -0.48 118.95 123.27 2dwa s ARG 415 Ca -0.07 -1.62 -0.22 0.00 -0.47 0.00 0.00 55.73 53.35 2dwa s ARG 415 Cb -0.15 -2.60 -0.06 0.00 -0.57 0.00 0.00 34.95 31.57 2dwa s ARG 415 CO -0.01 -0.73 1.21 -1.59 -1.08 0.00 0.00 175.30 173.10 2dwa s LYS 416 N -4.57 3.49 0.05 3.89 -2.85 -1.26 -4.81 119.74 113.68 2dwa s LYS 416 Ca 0.58 1.87 -0.08 0.00 -1.00 0.00 0.00 55.97 57.33 2dwa s LYS 416 Cb -0.06 -2.28 -0.00 0.00 -2.06 0.00 0.00 37.83 33.43 2dwa s LYS 416 CO 0.36 -0.80 0.16 -1.54 0.10 0.00 0.00 175.35 173.64 2dwa s SER 417 N -1.33 0.09 0.02 0.03 1.04 -1.26 -5.05 113.70 107.24 2dwa s SER 417 Ca 0.68 -0.46 -0.19 0.00 0.48 0.00 0.00 55.95 56.45 2dwa s SER 417 Cb -0.31 0.28 -0.20 0.00 0.10 0.00 0.00 66.02 65.89 2dwa s SER 417 CO 0.37 -0.57 1.19 0.77 0.98 0.00 0.00 173.24 175.98 2dwa h SER 418 N 3.41 0.54 -3.88 7.02 4.64 -2.04 -3.45 113.55 119.79 2dwa h SER 418 Ca -0.32 -0.67 -0.49 0.00 -0.47 0.00 0.00 61.79 59.84 2dwa h SER 418 Cb 1.19 -0.16 0.01 0.00 -0.31 0.00 0.00 62.40 63.13 2dwa h SER 418 CO 0.50 1.13 0.21 -0.75 -0.87 0.00 0.00 176.83 177.05 2dwa s LYS 419 N -3.56 3.83 -1.13 4.77 2.36 -1.26 -4.34 119.74 120.41 2dwa s LYS 419 Ca -0.13 0.64 -0.00 0.00 -2.55 0.00 0.00 55.97 53.93 2dwa s LYS 419 Cb 0.05 -2.30 0.00 0.00 -1.05 0.00 0.00 37.83 34.53 2dwa s LYS 419 CO 0.81 -0.13 0.95 0.72 1.55 0.00 0.00 175.35 179.24 2dwa n HIS 420 N -1.44 -2.08 0.10 4.03 8.25 -1.26 -4.96 115.22 117.86 2dwa n HIS 420 Ca 0.04 0.89 0.08 0.00 -0.26 0.00 0.00 57.72 58.46 2dwa n HIS 420 Cb 0.54 -4.90 -0.01 0.00 1.12 0.00 0.00 29.99 26.74 2dwa n HIS 420 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2dwa h SER 421 N -1.81 0.00 -0.35 0.41 4.64 -1.87 -3.36 113.55 111.21 2dwa h SER 421 Ca -0.55 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.63 2dwa h SER 421 Cb 1.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.40 2dwa h SER 421 CO 0.47 0.20 -0.30 0.77 -0.87 0.00 0.00 176.83 177.10 2dwa h SER 422 N 0.00 0.92 -4.00 4.97 4.64 -1.95 -3.44 113.55 114.69 2dwa h SER 422 Ca -0.05 -0.38 -0.50 0.00 -0.47 0.00 0.00 61.79 60.39 2dwa h SER 422 Cb 1.20 -0.25 0.06 0.00 -0.31 0.00 0.00 62.40 63.09 2dwa h SER 422 CO 0.02 1.14 0.48 -0.76 -0.87 0.00 0.00 176.83 176.84 2dwa s LEU 423 N -8.90 4.03 0.66 5.97 1.43 -1.26 -5.01 118.68 115.61 2dwa s LEU 423 Ca -0.10 2.28 -0.17 0.00 -1.03 0.00 0.00 54.13 55.11 2dwa s LEU 423 Cb 0.12 -4.23 -0.00 0.00 0.03 0.00 0.00 46.19 42.11 2dwa s LEU 423 CO 0.86 -0.87 1.25 -1.81 0.23 0.00 0.00 176.35 176.01 2dwa s ASP 424 N -1.37 4.60 0.24 2.29 1.01 -1.26 -4.80 116.67 117.39 2dwa s ASP 424 Ca 0.63 2.49 -0.04 0.00 0.71 0.00 0.00 52.55 56.34 2dwa s ASP 424 Cb -0.28 -2.61 0.43 0.00 1.01 0.00 0.00 42.92 41.47 2dwa s ASP 424 CO 0.34 -2.00 1.77 0.00 0.21 0.00 0.00 175.17 175.50 2dwa h VAL 426 N 0.62 0.80 -0.01 0.00 2.07 -1.92 -2.75 116.25 115.07 2dwa h VAL 426 Ca 0.40 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2dwa h VAL 426 Cb 0.50 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 2dwa h VAL 426 CO -0.32 0.12 -0.57 0.18 0.02 0.00 0.00 177.57 177.00 2dwa n LEU 427 N -3.97 1.33 -4.75 2.57 4.77 -0.83 -0.97 117.00 115.15 2dwa n LEU 427 Ca -0.02 -0.64 -0.41 0.00 -0.03 0.00 0.00 56.01 54.91 2dwa n LEU 427 Cb 0.21 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.26 2dwa n LEU 427 CO 0.32 0.27 0.75 -0.60 -1.33 0.00 0.00 177.39 176.80 2dwa s ARG 428 N -2.32 4.68 0.46 3.23 3.52 -0.67 -4.95 118.95 122.91 2dwa s ARG 428 Ca 0.11 1.66 -0.25 0.00 -0.13 0.00 0.00 55.73 57.13 2dwa s ARG 428 Cb 0.14 -3.26 -0.08 0.00 -1.56 0.00 0.00 34.95 30.19 2dwa s ARG 428 CO 0.57 0.24 1.37 -2.14 -0.81 0.00 0.00 175.30 174.53 2dwa s PRO 429 N -0.84 3.64 0.57 5.12 0.02 -1.26 -4.87 135.00 137.37 2dwa s PRO 429 Ca 0.46 2.29 -0.17 0.00 0.02 0.00 0.00 61.00 63.60 2dwa s PRO 429 Cb -0.29 -2.58 -0.05 0.00 0.02 0.00 0.00 34.50 31.60 2dwa s PRO 429 CO 0.35 -0.81 1.06 0.95 -0.33 0.00 0.00 177.00 178.23 2dwa s THR 430 N -1.25 3.73 -0.15 0.99 -4.23 -1.26 -5.01 115.64 108.46 2dwa s THR 430 Ca 0.62 0.89 0.12 0.00 -1.18 0.00 0.00 61.69 62.14 2dwa s THR 430 Cb -0.41 -3.37 -0.18 0.00 1.34 0.00 0.00 72.50 69.88 2dwa s THR 430 CO 0.52 -0.41 0.03 -0.62 -0.54 0.00 0.00 174.62 173.59 2dwa n GLU 431 N -1.77 1.48 0.00 3.99 1.02 -1.26 -5.07 120.64 119.03 2dwa n GLU 431 Ca 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 2dwa n GLU 431 Cb 0.53 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.57 2dwa n GLU 431 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dwa n GLY 432 N 2.14 0.81 3.64 0.62 0.00 -1.26 -4.95 105.19 106.20 2dwa n GLY 432 Ca -0.25 -1.76 -0.24 0.00 0.00 0.00 0.00 46.02 43.78 2dwa n GLY 432 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dwa s TYR 433 N -2.97 2.59 -0.28 1.61 -0.85 -0.05 -4.82 117.35 112.59 2dwa s TYR 433 Ca 0.00 -0.38 -0.15 0.00 -0.52 0.00 0.00 57.07 56.01 2dwa s TYR 433 Cb 0.00 -1.44 -0.03 0.00 0.38 0.00 0.00 41.96 40.87 2dwa s TYR 433 CO 0.00 0.49 0.39 -0.51 -1.52 0.00 0.00 175.55 174.40 2dwa s LEU 434 N -3.72 4.10 -0.09 -3.49 1.43 -1.26 0.93 118.68 116.57 2dwa s LEU 434 Ca 0.34 0.22 -0.30 0.00 -1.03 0.00 0.00 54.13 53.37 2dwa s LEU 434 Cb -0.02 -2.44 -0.02 0.00 0.03 0.00 0.00 46.19 43.74 2dwa s LEU 434 CO 0.20 -0.23 1.18 0.00 0.23 0.00 0.00 176.35 177.74 2dwa s ALA 435 N 2.10 3.53 0.24 4.21 0.00 -0.52 -0.78 121.76 130.54 2dwa s ALA 435 Ca 0.15 0.53 0.07 0.00 0.00 0.00 0.00 51.96 52.72 2dwa s ALA 435 Cb -0.16 -3.53 -0.05 0.00 0.00 0.00 0.00 23.12 19.38 2dwa s ALA 435 CO 0.10 -0.85 -0.11 0.14 0.00 0.00 0.00 175.76 175.05 2dwa s VAL 436 N 2.52 1.69 -0.15 0.00 -7.23 -0.39 -0.23 120.40 116.60 2dwa s VAL 436 Ca 0.54 -2.18 -0.01 0.00 -1.81 0.00 0.00 61.98 58.52 2dwa s VAL 436 Cb -0.23 -2.22 -0.01 0.00 0.56 0.00 0.00 36.38 34.48 2dwa s VAL 436 CO 0.19 -0.47 -0.10 0.00 -0.31 0.00 0.00 175.10 174.41 2dwa s ALA 437 N -3.00 2.69 -0.07 1.32 0.00 -1.26 -2.50 121.76 118.94 2dwa s ALA 437 Ca 0.26 -0.95 0.04 0.00 0.00 0.00 0.00 51.96 51.30 2dwa s ALA 437 Cb 0.01 -1.36 -0.02 0.00 0.00 0.00 0.00 23.12 21.76 2dwa s ALA 437 CO 0.09 0.08 -0.20 0.08 0.00 0.00 0.00 175.76 175.81 2dwa s VAL 438 N 0.63 2.53 0.29 0.00 1.01 -0.17 -0.91 120.40 123.78 2dwa s VAL 438 Ca -0.06 -0.89 0.04 0.00 0.00 0.00 0.00 61.98 61.07 2dwa s VAL 438 Cb -0.15 -1.97 -0.06 0.00 0.00 0.00 0.00 36.38 34.19 2dwa s VAL 438 CO 0.03 0.57 0.04 0.68 0.00 0.00 0.00 175.10 176.41 2dwa s VAL 439 N -0.19 1.09 0.13 2.92 -7.23 0.43 -1.63 120.40 115.92 2dwa s VAL 439 Ca -0.01 -2.02 -0.30 0.00 -1.81 0.00 0.00 61.98 57.84 2dwa s VAL 439 Cb -0.13 -2.62 -0.06 0.00 0.56 0.00 0.00 36.38 34.12 2dwa s VAL 439 CO 0.03 -0.11 1.05 -0.54 -0.31 0.00 0.00 175.10 175.22 2dwa s LYS 440 N -3.89 4.62 0.32 4.82 3.01 -1.26 -1.20 119.74 126.15 2dwa s LYS 440 Ca 0.34 1.60 0.07 0.00 -1.01 0.00 0.00 55.97 56.97 2dwa s LYS 440 Cb 0.07 -3.34 0.79 0.00 -1.01 0.00 0.00 37.83 34.35 2dwa s LYS 440 CO 0.13 0.09 1.78 -0.22 0.51 0.00 0.00 175.35 177.65 2dwa h LYS 441 N 5.56 0.70 0.00 1.68 3.64 -1.24 -1.72 116.57 125.19 2dwa h LYS 441 Ca -0.43 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2dwa h LYS 441 Cb 1.21 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.87 2dwa h LYS 441 CO 0.73 0.46 -0.02 0.00 -2.27 0.00 0.00 179.45 178.35 2dwa h ALA 442 N 1.64 1.06 -0.62 5.00 0.00 -1.93 -3.28 119.26 121.13 2dwa h ALA 442 Ca 0.57 -0.02 -0.73 0.00 0.00 0.00 0.00 54.91 54.74 2dwa h ALA 442 Cb 0.96 -0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.64 2dwa h ALA 442 CO -0.36 0.02 2.42 -1.71 0.00 0.00 0.00 179.25 179.62 2dwa n ASN 443 N -3.19 4.60 -4.78 0.00 2.85 -0.65 -4.99 115.26 109.10 2dwa n ASN 443 Ca -0.02 -2.96 -0.34 0.00 -0.11 0.00 0.00 54.58 51.15 2dwa n ASN 443 Cb 0.17 -1.60 0.00 0.00 1.24 0.00 0.00 39.78 39.59 2dwa n ASN 443 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 2dwa s GLU 444 N 2.18 3.38 0.00 1.20 2.02 -1.24 -3.12 118.70 123.12 2dwa s GLU 444 Ca 0.45 1.50 0.00 0.00 0.02 0.00 0.00 54.97 56.94 2dwa s GLU 444 Cb 0.09 -2.02 0.00 0.00 0.10 0.00 0.00 34.13 32.30 2dwa s GLU 444 CO -0.02 -0.80 0.00 0.41 0.02 0.00 0.00 175.26 174.86 2dwa n GLY 445 N -0.10 0.19 3.64 -1.39 0.00 -1.26 -4.96 105.19 101.30 2dwa n GLY 445 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2dwa n GLY 445 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dwa s LEU 446 N 0.00 4.06 0.37 0.99 2.96 -1.18 -4.91 118.68 120.96 2dwa s LEU 446 Ca 0.00 1.00 0.04 0.00 -0.22 0.00 0.00 54.13 54.95 2dwa s LEU 446 Cb 0.00 -3.30 -0.03 0.00 0.50 0.00 0.00 46.19 43.36 2dwa s LEU 446 CO 0.00 -0.65 0.13 0.42 -1.32 0.00 0.00 176.35 174.93 2dwa s THR 447 N 3.11 0.60 0.33 3.68 -4.23 -1.26 -4.98 115.64 112.89 2dwa s THR 447 Ca 0.38 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.99 2dwa s THR 447 Cb -0.14 -2.45 0.32 0.00 1.34 0.00 0.00 72.50 71.57 2dwa s THR 447 CO 0.10 0.00 1.76 -0.25 -0.54 0.00 0.00 174.62 175.69 2dwa h TRP 448 N 1.93 0.97 -0.00 3.99 2.91 -1.83 -1.71 115.95 122.22 2dwa h TRP 448 Ca -0.35 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.70 2dwa h TRP 448 Cb 1.26 -0.29 0.00 0.00 -0.51 0.00 0.00 29.16 29.63 2dwa h TRP 448 CO 1.28 0.14 -0.00 0.09 -1.03 0.00 0.00 178.44 178.92 2dwa n ASN 449 N -4.78 0.12 -0.81 2.65 3.02 -1.26 -3.49 115.26 110.71 2dwa n ASN 449 Ca 0.25 -0.99 0.06 0.00 -0.03 0.00 0.00 54.58 53.86 2dwa n ASN 449 Cb 0.69 -0.01 0.15 0.00 -0.61 0.00 0.00 39.78 39.99 2dwa n ASN 449 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2dwa n SER 450 N -0.92 1.51 0.15 6.41 3.41 -0.65 -4.79 113.62 118.74 2dwa n SER 450 Ca 0.23 -3.29 0.02 0.00 -0.26 0.00 0.00 58.87 55.57 2dwa n SER 450 Cb 0.14 -0.45 0.18 0.00 -0.26 0.00 0.00 64.21 63.82 2dwa n SER 450 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2dwa h LEU 451 N 0.91 0.00 -9.47 1.04 4.07 -1.58 -3.45 115.31 106.84 2dwa h LEU 451 Ca -0.06 0.00 -0.61 0.00 0.08 0.00 0.00 57.88 57.29 2dwa h LEU 451 Cb 1.26 0.00 0.07 0.00 1.08 0.00 0.00 40.66 43.07 2dwa h LEU 451 CO 0.03 0.55 0.56 1.17 -1.08 0.00 0.00 178.44 179.66 2dwa n LYS 452 N -3.55 1.75 -0.97 1.13 4.81 -1.26 -1.31 118.16 118.76 2dwa n LYS 452 Ca -0.00 0.62 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 2dwa n LYS 452 Cb 0.63 -2.27 0.00 0.00 0.02 0.00 0.00 35.03 33.41 2dwa n LYS 452 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2dwa n ASP 453 N 2.47 -4.29 -4.44 3.14 10.43 0.21 -4.96 116.55 119.12 2dwa n ASP 453 Ca 0.15 0.00 -0.26 0.00 2.57 0.00 0.00 54.79 57.24 2dwa n ASP 453 Cb 0.28 -2.16 0.14 0.00 1.84 0.00 0.00 41.12 41.22 2dwa n ASP 453 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2dwa s LYS 454 N -1.10 1.22 -0.19 -1.24 -0.14 -0.43 -3.95 119.74 113.92 2dwa s LYS 454 Ca 0.00 -0.81 -0.09 0.00 -1.36 0.00 0.00 55.97 53.71 2dwa s LYS 454 Cb 0.00 -2.12 -0.05 0.00 -1.68 0.00 0.00 37.83 33.99 2dwa s LYS 454 CO 0.00 -1.87 0.10 0.15 -0.76 0.00 0.00 175.35 172.96 2dwa s LYS 455 N -5.47 4.07 0.15 1.68 1.02 -1.26 -1.24 119.74 118.68 2dwa s LYS 455 Ca 0.70 -0.28 0.11 0.00 0.02 0.00 0.00 55.97 56.52 2dwa s LYS 455 Cb -0.05 -3.31 -0.04 0.00 -0.52 0.00 0.00 37.83 33.91 2dwa s LYS 455 CO 0.48 0.30 -0.25 -1.54 -0.92 0.00 0.00 175.35 173.42 2dwa s SER 456 N 0.33 3.40 -0.15 2.83 1.04 -0.66 0.65 113.70 121.13 2dwa s SER 456 Ca 0.06 -0.77 0.01 0.00 0.48 0.00 0.00 55.95 55.72 2dwa s SER 456 Cb -0.12 -0.26 0.02 0.00 0.10 0.00 0.00 66.02 65.77 2dwa s SER 456 CO -0.01 0.16 -0.16 0.00 0.98 0.00 0.00 173.24 174.21 2dwa s HIS 458 N 1.39 2.02 0.14 0.00 3.76 -0.45 -1.21 115.29 120.95 2dwa s HIS 458 Ca 0.04 -0.39 -0.18 0.00 -0.15 0.00 0.00 55.06 54.38 2dwa s HIS 458 Cb -0.13 -1.19 -0.02 0.00 1.11 0.00 0.00 32.58 32.35 2dwa s HIS 458 CO -0.11 0.14 1.79 1.79 -0.85 0.00 0.00 174.74 177.50 2dwa h THR 459 N 4.24 1.05 0.00 1.30 1.35 -1.75 -3.40 112.91 115.69 2dwa h THR 459 Ca -0.45 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 2dwa h THR 459 Cb 1.16 0.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 2dwa h THR 459 CO 0.43 0.07 0.00 0.00 -0.25 0.00 0.00 175.52 175.76 2dwa n ALA 460 N -2.19 0.00 -1.65 6.62 0.00 -1.26 -0.89 120.51 121.13 2dwa n ALA 460 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 2dwa n ALA 460 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.49 2dwa n ALA 460 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2dwa n VAL 461 N -0.09 2.31 -0.99 0.00 0.31 0.25 -2.97 118.33 117.14 2dwa n VAL 461 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 2dwa n VAL 461 Cb 0.00 -1.35 0.00 0.00 -0.91 0.00 0.00 33.84 31.58 2dwa n VAL 461 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2dwa n ASP 462 N 0.58 -1.11 -4.94 4.52 8.00 -1.26 -4.97 116.55 117.37 2dwa n ASP 462 Ca 0.07 0.00 -0.25 0.00 0.71 0.00 0.00 54.79 55.32 2dwa n ASP 462 Cb 0.37 -0.23 -0.03 0.00 -0.02 0.00 0.00 41.12 41.21 2dwa n ASP 462 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2dwa s ARG 463 N -0.03 3.49 0.01 -1.24 0.52 -1.16 -3.93 118.95 116.61 2dwa s ARG 463 Ca 0.00 -0.45 -0.08 0.00 -0.52 0.00 0.00 55.73 54.68 2dwa s ARG 463 Cb 0.00 -2.83 -0.05 0.00 0.52 0.00 0.00 34.95 32.59 2dwa s ARG 463 CO 0.00 0.38 0.98 1.15 0.02 0.00 0.00 175.30 177.83 2dwa h THR 464 N 1.35 0.00 -0.07 0.02 2.02 -1.92 0.71 112.91 115.02 2dwa h THR 464 Ca -0.49 -0.04 -0.15 0.00 0.77 0.00 0.00 66.41 66.50 2dwa h THR 464 Cb 1.20 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 2dwa h THR 464 CO 0.66 0.00 -0.62 0.00 0.37 0.00 0.00 175.52 175.93 2dwa h ALA 465 N -1.83 0.83 0.00 6.16 0.00 -1.91 -1.31 119.26 121.21 2dwa h ALA 465 Ca -0.03 -0.55 -0.05 0.00 0.00 0.00 0.00 54.91 54.28 2dwa h ALA 465 Cb 0.23 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2dwa h ALA 465 CO 0.05 0.74 -0.38 0.78 0.00 0.00 0.00 179.25 180.44 2dwa h GLY 466 N 1.49 0.00 0.00 0.00 0.00 -1.66 -3.39 103.07 99.50 2dwa h GLY 466 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2dwa h GLY 466 CO 0.10 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.51 2dwa n TRP 467 N -3.10 -2.02 -0.30 5.60 -0.00 -0.75 -4.29 117.44 112.58 2dwa n TRP 467 Ca 0.02 0.38 -0.04 0.00 -0.00 0.00 0.00 57.50 57.85 2dwa n TRP 467 Cb 0.63 0.67 0.08 0.00 -0.00 0.00 0.00 31.31 32.69 2dwa n TRP 467 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 2dwa h ASN 468 N 0.00 0.99 0.22 5.87 2.35 -0.80 0.21 115.58 124.41 2dwa h ASN 468 Ca 0.00 -0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 2dwa h ASN 468 Cb 0.00 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.12 2dwa h ASN 468 CO 0.00 0.76 -0.10 0.40 -1.65 0.00 0.00 177.43 176.83 2dwa h ILE 469 N 1.13 0.55 -0.55 2.81 1.08 -1.47 -2.03 117.51 119.03 2dwa h ILE 469 Ca 0.30 -0.99 -0.09 0.00 -0.39 0.00 0.00 64.86 63.68 2dwa h ILE 469 Cb -0.05 0.93 -0.02 0.00 -3.07 0.00 0.00 36.82 34.61 2dwa h ILE 469 CO -0.06 0.15 -0.03 1.55 -0.69 0.00 0.00 178.15 179.07 2dwa h PRO 470 N -0.96 0.97 -0.00 2.37 0.13 -1.77 -1.52 132.00 131.22 2dwa h PRO 470 Ca -0.03 -0.31 -0.16 0.00 -0.87 0.00 0.00 66.00 64.63 2dwa h PRO 470 Cb 0.46 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 31.48 2dwa h PRO 470 CO 0.05 0.98 -0.76 0.52 -0.23 0.00 0.00 178.00 178.56 2dwa h MET 471 N 0.89 0.01 -0.11 0.86 2.86 -1.08 -1.75 114.93 116.61 2dwa h MET 471 Ca 0.16 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.79 2dwa h MET 471 Cb 0.56 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.21 2dwa h MET 471 CO 0.03 0.76 0.07 0.78 1.06 0.00 0.00 176.91 179.61 2dwa h GLY 472 N 2.23 0.15 0.88 8.32 0.00 -1.18 0.26 103.07 113.74 2dwa h GLY 472 Ca -0.01 -0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.29 2dwa h GLY 472 CO 0.10 0.06 0.41 1.41 0.00 0.00 0.00 176.54 178.52 2dwa h LEU 473 N 0.12 0.67 -0.50 3.11 3.38 -1.20 -1.94 115.31 118.95 2dwa h LEU 473 Ca 0.04 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.86 2dwa h LEU 473 Cb 0.02 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2dwa h LEU 473 CO -0.01 0.47 -0.39 0.40 0.09 0.00 0.00 178.44 179.00 2dwa h ILE 474 N 0.81 1.28 -0.08 1.22 2.04 -1.14 -0.33 117.51 121.31 2dwa h ILE 474 Ca 0.26 -1.56 -0.00 0.00 1.00 0.00 0.00 64.86 64.56 2dwa h ILE 474 Cb 0.01 1.44 -0.00 0.00 -0.74 0.00 0.00 36.82 37.52 2dwa h ILE 474 CO -0.10 0.51 0.05 0.58 0.00 0.00 0.00 178.15 179.19 2dwa h VAL 475 N 0.65 1.06 -0.37 1.67 2.07 -0.92 -0.54 116.25 119.88 2dwa h VAL 475 Ca 0.05 -0.17 0.03 0.00 0.82 0.00 0.00 66.70 67.43 2dwa h VAL 475 Cb 0.95 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 2dwa h VAL 475 CO 0.09 0.06 0.17 0.78 0.02 0.00 0.00 177.57 178.69 2dwa h ASN 476 N 0.06 0.25 -0.57 0.57 4.21 -1.16 0.58 115.58 119.51 2dwa h ASN 476 Ca 0.03 0.02 -0.09 0.00 1.21 0.00 0.00 56.30 57.47 2dwa h ASN 476 Cb 0.05 -0.02 -0.02 0.00 -1.12 0.00 0.00 38.32 37.20 2dwa h ASN 476 CO -0.00 0.18 0.03 1.56 -1.29 0.00 0.00 177.43 177.91 2dwa h GLN 477 N 0.36 1.01 -0.00 0.81 4.20 -1.03 -3.13 115.11 117.34 2dwa h GLN 477 Ca 0.16 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.57 2dwa h GLN 477 Cb 0.08 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.75 2dwa h GLN 477 CO -0.12 0.98 -0.39 0.25 -0.67 0.00 0.00 178.83 178.89 2dwa n THR 478 N -4.19 0.00 -4.07 -0.54 -2.24 -0.22 -4.94 114.28 98.08 2dwa n THR 478 Ca 0.03 -0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.49 2dwa n THR 478 Cb 0.32 0.09 -0.00 0.00 -2.10 0.00 0.00 70.33 68.64 2dwa n THR 478 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dwa n GLY 479 N 1.49 -0.43 3.11 3.38 0.00 0.17 -4.98 105.19 107.93 2dwa n GLY 479 Ca 0.06 0.16 -0.12 0.00 0.00 0.00 0.00 46.02 46.12 2dwa n GLY 479 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dwa s SER 480 N -3.46 -0.06 0.00 1.61 0.15 -1.20 -5.03 113.70 105.71 2dwa s SER 480 Ca 0.60 -0.01 0.20 0.00 0.70 0.00 0.00 55.95 57.44 2dwa s SER 480 Cb -0.32 0.27 0.60 0.00 -1.71 0.00 0.00 66.02 64.86 2dwa s SER 480 CO 0.88 -0.29 1.47 0.00 1.20 0.00 0.00 173.24 176.50 2dwa n ALA 482 N 0.66 6.68 0.31 0.00 0.00 -1.26 -4.59 120.51 122.31 2dwa n ALA 482 Ca 0.16 -2.89 0.21 0.00 0.00 0.00 0.00 53.44 50.92 2dwa n ALA 482 Cb 0.39 -2.52 1.05 0.00 0.00 0.00 0.00 19.45 18.38 2dwa n ALA 482 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2dwa h PHE 483 N 3.60 0.00 0.00 0.00 -0.00 -1.96 -1.27 116.94 117.31 2dwa h PHE 483 Ca 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.43 2dwa h PHE 483 Cb 0.85 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.80 2dwa h PHE 483 CO 1.67 0.00 0.00 -0.40 -0.00 0.00 0.00 178.31 179.58 2dwa n ASP 484 N -2.99 0.00 -0.32 -0.68 5.75 -1.26 -3.03 116.55 114.02 2dwa n ASP 484 Ca -0.02 0.16 0.04 0.00 -0.01 0.00 0.00 54.79 54.96 2dwa n ASP 484 Cb 0.12 -0.37 0.04 0.00 -1.03 0.00 0.00 41.12 39.88 2dwa n ASP 484 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2dwa n GLU 485 N -1.37 0.53 0.03 0.11 1.02 -0.48 -4.76 120.64 115.73 2dwa n GLU 485 Ca 0.09 -1.10 -0.12 0.00 -0.02 0.00 0.00 57.16 56.01 2dwa n GLU 485 Cb 0.22 -1.15 -0.09 0.00 -0.02 0.00 0.00 31.44 30.40 2dwa n GLU 485 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2dwa h PHE 486 N 1.43 -0.14 -3.43 -0.32 3.57 -1.56 -3.45 116.94 113.03 2dwa h PHE 486 Ca 0.00 -0.00 -0.54 0.00 3.53 0.00 0.00 57.97 60.96 2dwa h PHE 486 Cb 0.37 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 2dwa h PHE 486 CO 0.03 0.34 -0.07 -0.06 -2.23 0.00 0.00 178.31 176.32 2dwa s PHE 487 N -3.59 3.49 0.09 0.41 0.08 -1.26 -0.62 117.98 116.59 2dwa s PHE 487 Ca -0.14 1.00 -0.18 0.00 0.12 0.00 0.00 56.93 57.74 2dwa s PHE 487 Cb 0.01 -2.35 -0.07 0.00 -0.57 0.00 0.00 43.02 40.04 2dwa s PHE 487 CO 0.54 0.31 1.53 0.66 -0.10 0.00 0.00 175.22 178.17 2dwa h SER 488 N 2.92 0.47 -4.66 1.36 4.64 -1.30 -3.45 113.55 113.53 2dwa h SER 488 Ca -0.48 -0.30 -0.15 0.00 -0.47 0.00 0.00 61.79 60.39 2dwa h SER 488 Cb 1.18 -0.13 -0.22 0.00 -0.31 0.00 0.00 62.40 62.92 2dwa h SER 488 CO 0.67 0.66 -0.45 -1.10 -0.87 0.00 0.00 176.83 175.73 2dwa s GLN 489 N -5.01 0.45 0.13 4.77 -0.21 -1.26 -4.91 119.66 113.63 2dwa s GLN 489 Ca -0.13 -0.18 -0.03 0.00 0.02 0.00 0.00 55.36 55.03 2dwa s GLN 489 Cb 0.08 0.19 -0.03 0.00 1.00 0.00 0.00 33.01 34.25 2dwa s GLN 489 CO 0.75 -0.10 0.11 -1.12 -2.12 0.00 0.00 175.29 172.81 2dwa s SER 490 N -0.97 0.25 -0.30 5.90 0.01 0.03 -1.66 113.70 116.96 2dwa s SER 490 Ca -0.11 -1.09 0.00 0.00 1.31 0.00 0.00 55.95 56.07 2dwa s SER 490 Cb -0.06 0.32 0.06 0.00 0.21 0.00 0.00 66.02 66.56 2dwa s SER 490 CO 0.02 -0.76 -0.01 0.00 0.41 0.00 0.00 173.24 172.90 2dwa s ALA 492 N 1.16 2.40 0.17 0.00 0.00 0.39 -1.34 121.76 124.52 2dwa s ALA 492 Ca -0.03 -2.85 -0.34 0.00 0.00 0.00 0.00 51.96 48.74 2dwa s ALA 492 Cb -0.20 -1.90 -0.15 0.00 0.00 0.00 0.00 23.12 20.87 2dwa s ALA 492 CO -0.03 -2.05 1.34 -2.30 0.00 0.00 0.00 175.76 172.71 2dwa n PRO 493 N 3.06 1.54 0.00 0.00 -0.02 -1.26 -2.01 135.00 136.31 2dwa n PRO 493 Ca 0.15 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2dwa n PRO 493 Cb 0.37 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 2dwa n PRO 493 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dwa n GLY 494 N 2.41 0.38 3.97 -1.23 0.00 -0.04 -0.59 105.19 110.09 2dwa n GLY 494 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 2dwa n GLY 494 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dwa s ALA 495 N -2.05 3.19 -0.08 4.61 0.00 -0.85 -4.92 121.76 121.67 2dwa s ALA 495 Ca 0.00 -1.56 -0.30 0.00 0.00 0.00 0.00 51.96 50.10 2dwa s ALA 495 Cb 0.00 -2.27 -0.05 0.00 0.00 0.00 0.00 23.12 20.80 2dwa s ALA 495 CO 0.00 -1.82 1.60 0.34 0.00 0.00 0.00 175.76 175.88 2dwa s ASP 496 N -4.80 6.68 0.60 0.00 2.15 -1.26 -4.88 116.67 115.16 2dwa s ASP 496 Ca 0.69 2.13 0.29 0.00 0.43 0.00 0.00 52.55 56.09 2dwa s ASP 496 Cb -0.05 -2.53 1.50 0.00 -0.30 0.00 0.00 42.92 41.54 2dwa s ASP 496 CO 0.47 -0.92 1.91 -0.65 -0.17 0.00 0.00 175.17 175.81 2dwa h PRO 497 N 9.45 0.00 0.00 4.34 0.11 -1.93 0.15 132.00 144.12 2dwa h PRO 497 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2dwa h PRO 497 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2dwa h PRO 497 CO 0.96 0.00 -0.39 1.63 -0.21 0.00 0.00 178.00 179.98 2dwa n LYS 498 N -3.63 0.05 -2.05 1.05 5.02 -1.26 -4.70 118.16 112.63 2dwa n LYS 498 Ca 0.07 0.02 -0.30 0.00 -2.02 0.00 0.00 58.31 56.08 2dwa n LYS 498 Cb 0.61 -1.54 0.02 0.00 -0.02 0.00 0.00 35.03 34.11 2dwa n LYS 498 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2dwa s SER 499 N -3.24 5.91 0.63 4.39 1.04 0.53 -4.97 113.70 118.00 2dwa s SER 499 Ca 0.11 1.17 0.41 0.00 0.48 0.00 0.00 55.95 58.12 2dwa s SER 499 Cb 0.17 -2.18 2.11 0.00 0.10 0.00 0.00 66.02 66.22 2dwa s SER 499 CO 0.66 -1.00 2.26 0.08 0.98 0.00 0.00 173.24 176.23 2dwa h ARG 500 N -0.32 0.00 0.00 4.02 0.11 -1.91 -1.50 114.38 114.78 2dwa h ARG 500 Ca -0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.63 2dwa h ARG 500 Cb 1.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 2dwa h ARG 500 CO 0.62 0.00 0.00 -0.07 0.10 0.00 0.00 179.97 180.63 2dwa h LEU 501 N 0.00 0.00 -1.41 0.08 3.38 -1.85 0.17 115.31 115.68 2dwa h LEU 501 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dwa h LEU 501 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2dwa h LEU 501 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 2dwa h ALA 503 N 1.50 1.81 0.00 0.00 0.00 -1.20 -1.79 119.26 119.58 2dwa h ALA 503 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2dwa h ALA 503 Cb 0.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2dwa h ALA 503 CO 0.00 0.16 -0.63 1.28 0.00 0.00 0.00 179.25 180.06 2dwa n LEU 504 N -4.47 0.61 -4.78 0.00 4.32 -0.36 -4.92 117.00 107.40 2dwa n LEU 504 Ca -0.00 -0.10 -0.35 0.00 -0.02 0.00 0.00 56.01 55.54 2dwa n LEU 504 Cb 0.11 -0.19 0.00 0.00 -1.62 0.00 0.00 43.42 41.72 2dwa n LEU 504 CO 0.35 0.14 0.77 0.00 -1.22 0.00 0.00 177.39 177.43 2dwa n ALA 506 N -1.37 2.48 -0.24 0.00 0.00 -1.26 -4.81 120.51 115.31 2dwa n ALA 506 Ca 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2dwa n ALA 506 Cb 0.51 -0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.72 2dwa n ALA 506 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dwa n GLY 507 N 1.77 -0.58 0.00 0.00 0.00 -1.26 -4.46 105.19 100.66 2dwa n GLY 507 Ca -0.00 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.90 2dwa n GLY 507 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dwa n ASP 508 N -0.43 0.00 0.32 1.61 5.68 0.31 -1.58 116.55 122.47 2dwa n ASP 508 Ca 0.00 -0.44 0.20 0.00 -0.50 0.00 0.00 54.79 54.05 2dwa n ASP 508 Cb 0.00 0.00 1.11 0.00 -1.14 0.00 0.00 41.12 41.09 2dwa n ASP 508 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 2dwa h ASP 509 N 0.00 0.00 -0.33 -1.12 2.03 -1.88 -0.89 116.42 114.22 2dwa h ASP 509 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2dwa h ASP 509 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 2dwa h ASP 509 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 178.21 2dwa n GLN 510 N -3.36 2.73 -1.02 4.15 6.02 -1.26 -4.97 117.38 119.67 2dwa n GLN 510 Ca -0.03 -2.01 -0.01 0.00 -0.01 0.00 0.00 57.00 54.94 2dwa n GLN 510 Cb 0.08 -1.27 -0.00 0.00 1.02 0.00 0.00 30.24 30.07 2dwa n GLN 510 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2dwa n GLY 511 N 0.55 0.47 3.91 1.08 0.00 -0.34 -5.04 105.19 105.82 2dwa n GLY 511 Ca 0.12 -0.23 -0.27 0.00 0.00 0.00 0.00 46.02 45.64 2dwa n GLY 511 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dwa s LEU 512 N -0.15 3.54 -1.23 0.99 1.43 -1.26 -4.38 118.68 117.62 2dwa s LEU 512 Ca 0.00 0.81 -0.02 0.00 -1.03 0.00 0.00 54.13 53.89 2dwa s LEU 512 Cb 0.00 -3.72 0.00 0.00 0.03 0.00 0.00 46.19 42.50 2dwa s LEU 512 CO 0.00 -0.70 0.29 0.47 0.23 0.00 0.00 176.35 176.63 2dwa n ASP 513 N -2.32 -4.87 -4.68 2.29 8.00 -1.26 -0.53 116.55 113.18 2dwa n ASP 513 Ca 0.01 -0.14 -0.44 0.00 0.71 0.00 0.00 54.79 54.93 2dwa n ASP 513 Cb 0.56 -3.83 -0.04 0.00 -0.02 0.00 0.00 41.12 37.79 2dwa n ASP 513 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2dwa n LYS 514 N -2.94 2.57 -1.03 -1.24 4.81 -1.26 -2.31 118.16 116.75 2dwa n LYS 514 Ca -0.12 0.93 -0.01 0.00 -0.87 0.00 0.00 58.31 58.24 2dwa n LYS 514 Cb 0.61 -2.80 -0.00 0.00 0.02 0.00 0.00 35.03 32.86 2dwa n LYS 514 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2dwa s VAL 516 N -1.82 2.89 -1.51 0.00 -7.23 -0.98 -0.86 120.40 110.90 2dwa s VAL 516 Ca 0.00 0.87 -0.09 0.00 -1.81 0.00 0.00 61.98 60.95 2dwa s VAL 516 Cb 0.00 -3.56 -0.00 0.00 0.56 0.00 0.00 36.38 33.38 2dwa s VAL 516 CO 0.00 0.20 2.65 -0.81 -0.31 0.00 0.00 175.10 176.82 2dwa n PRO 517 N 1.11 3.81 -3.99 4.82 -0.04 -1.26 -4.45 135.00 135.00 2dwa n PRO 517 Ca 0.01 -2.66 -0.09 0.00 -0.04 0.00 0.00 63.50 60.71 2dwa n PRO 517 Cb 0.42 -2.83 -0.05 0.00 -0.04 0.00 0.00 33.50 31.00 2dwa n PRO 517 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2dwa s ASN 518 N 1.77 -0.04 0.00 3.54 2.20 -1.26 -4.53 114.94 116.61 2dwa s ASN 518 Ca 0.61 -0.95 0.14 0.00 -0.94 0.00 0.00 52.86 51.72 2dwa s ASN 518 Cb 0.17 0.61 0.63 0.00 -2.00 0.00 0.00 41.25 40.66 2dwa s ASN 518 CO -0.07 -1.18 1.40 -1.54 -2.94 0.00 0.00 177.10 172.77 2dwa n SER 519 N -0.48 0.00 0.03 3.54 3.41 -1.26 -1.71 113.62 117.15 2dwa n SER 519 Ca -0.02 0.31 0.06 0.00 -0.26 0.00 0.00 58.87 58.96 2dwa n SER 519 Cb 0.62 -0.40 0.47 0.00 -0.26 0.00 0.00 64.21 64.64 2dwa n SER 519 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2dwa h LYS 520 N 0.00 0.43 -6.25 4.33 1.57 -1.93 -3.41 116.57 111.31 2dwa h LYS 520 Ca 0.00 -0.03 -0.55 0.00 -1.87 0.00 0.00 60.65 58.20 2dwa h LYS 520 Cb 0.19 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 2dwa h LYS 520 CO 0.00 0.28 0.99 -2.00 -0.57 0.00 0.00 179.45 178.15 2dwa s GLU 521 N -5.41 4.21 0.27 3.15 2.56 -0.69 -3.44 118.70 119.35 2dwa s GLU 521 Ca -0.08 2.00 0.00 0.00 0.00 0.00 0.00 54.97 56.89 2dwa s GLU 521 Cb 0.18 -3.85 0.63 0.00 2.00 0.00 0.00 34.13 33.09 2dwa s GLU 521 CO 0.72 -0.76 1.69 -0.22 -0.56 0.00 0.00 175.26 176.13 2dwa h LYS 522 N 8.84 0.32 -0.82 4.30 3.64 -1.52 -2.30 116.57 129.02 2dwa h LYS 522 Ca -0.35 -0.02 -0.35 0.00 -1.27 0.00 0.00 60.65 58.66 2dwa h LYS 522 Cb 1.16 -0.07 -0.21 0.00 -0.41 0.00 0.00 32.23 32.70 2dwa h LYS 522 CO 0.95 0.21 0.42 0.66 -2.27 0.00 0.00 179.45 179.42 2dwa n TYR 523 N -5.11 2.62 -2.89 1.91 4.01 -1.26 -4.47 117.16 111.97 2dwa n TYR 523 Ca 0.19 -1.52 -0.36 0.00 -0.16 0.00 0.00 57.90 56.05 2dwa n TYR 523 Cb 0.59 -0.79 -0.06 0.00 -0.31 0.00 0.00 39.34 38.76 2dwa n TYR 523 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 2dwa s TYR 524 N -3.15 3.64 0.00 -0.72 5.04 -0.87 -2.87 117.35 118.42 2dwa s TYR 524 Ca 0.55 1.63 0.00 0.00 -2.44 0.00 0.00 57.07 56.81 2dwa s TYR 524 Cb 0.46 -2.81 0.00 0.00 0.35 0.00 0.00 41.96 39.95 2dwa s TYR 524 CO 0.11 0.22 0.00 0.41 -1.34 0.00 0.00 175.55 174.95 2dwa n GLY 525 N 0.49 -1.00 0.15 8.97 0.00 -0.07 -1.85 105.19 111.87 2dwa n GLY 525 Ca 0.01 -1.63 -0.06 0.00 0.00 0.00 0.00 46.02 44.34 2dwa n GLY 525 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2dwa h TYR 526 N 0.00 -0.09 -0.17 1.61 0.05 -1.93 -0.15 116.97 116.28 2dwa h TYR 526 Ca 0.00 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.73 2dwa h TYR 526 Cb 0.00 0.09 -0.00 0.00 1.01 0.00 0.00 36.73 37.83 2dwa h TYR 526 CO 0.00 -0.10 -0.19 1.15 -1.05 0.00 0.00 178.16 177.97 2dwa h THR 527 N 0.05 1.34 -0.31 -2.88 2.02 -1.89 -1.99 112.91 109.25 2dwa h THR 527 Ca 0.17 -1.36 0.03 0.00 0.77 0.00 0.00 66.41 66.01 2dwa h THR 527 Cb 0.24 1.83 -0.03 0.00 -1.74 0.00 0.00 68.15 68.46 2dwa h THR 527 CO -0.31 0.41 0.14 1.23 0.37 0.00 0.00 175.52 177.36 2dwa h GLY 528 N 0.08 0.41 1.15 2.16 0.00 -1.22 -0.74 103.07 104.92 2dwa h GLY 528 Ca 0.03 -0.10 -0.06 0.00 0.00 0.00 0.00 47.33 47.20 2dwa h GLY 528 CO 0.05 0.07 0.19 0.00 0.00 0.00 0.00 176.54 176.84 2dwa h ALA 529 N 1.17 1.05 -0.28 3.60 0.00 -0.88 -0.88 119.26 123.05 2dwa h ALA 529 Ca 0.13 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 2dwa h ALA 529 Cb 0.07 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2dwa h ALA 529 CO -0.11 0.63 -0.25 0.35 0.00 0.00 0.00 179.25 179.87 2dwa h PHE 530 N 1.01 0.61 -0.44 0.00 3.57 -1.10 -2.85 116.94 117.73 2dwa h PHE 530 Ca 0.22 -0.13 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 2dwa h PHE 530 Cb 0.32 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 2dwa h PHE 530 CO 0.02 0.74 -0.07 -0.09 -2.23 0.00 0.00 178.31 176.69 2dwa h ARG 531 N 0.47 0.76 -0.76 1.11 2.43 -0.69 -0.32 114.38 117.40 2dwa h ARG 531 Ca 0.07 -0.23 0.07 0.00 -0.81 0.00 0.00 59.98 59.08 2dwa h ARG 531 Cb 0.69 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 30.12 2dwa h ARG 531 CO 0.05 0.82 0.50 0.00 -1.51 0.00 0.00 179.97 179.83 2dwa h LEU 533 N 0.78 0.02 -1.41 0.00 5.85 -1.22 -1.14 115.31 118.20 2dwa h LEU 533 Ca 0.33 -0.92 0.16 0.00 0.84 0.00 0.00 57.88 58.29 2dwa h LEU 533 Cb 0.29 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.25 2dwa h LEU 533 CO -0.11 0.94 0.56 0.00 -0.34 0.00 0.00 178.44 179.49 2dwa h ALA 534 N 0.08 1.99 -0.12 1.25 0.00 -0.80 0.50 119.26 122.17 2dwa h ALA 534 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2dwa h ALA 534 Cb 0.95 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2dwa h ALA 534 CO 0.01 -0.24 0.00 0.39 0.00 0.00 0.00 179.25 179.41 2dwa n GLU 535 N -4.53 1.54 -2.58 0.00 1.02 -0.39 -4.92 120.64 110.77 2dwa n GLU 535 Ca 0.17 -0.81 -0.19 0.00 -0.02 0.00 0.00 57.16 56.32 2dwa n GLU 535 Cb 0.54 -1.37 0.01 0.00 -0.02 0.00 0.00 31.44 30.60 2dwa n GLU 535 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2dwa n ASP 536 N 0.03 -5.44 0.07 1.62 8.00 0.18 -4.87 116.55 116.13 2dwa n ASP 536 Ca 0.16 -0.11 -0.21 0.00 0.71 0.00 0.00 54.79 55.33 2dwa n ASP 536 Cb 0.26 -4.41 -0.15 0.00 -0.02 0.00 0.00 41.12 36.80 2dwa n ASP 536 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2dwa h VAL 537 N -0.49 1.44 -1.84 2.53 2.07 -1.43 -3.47 116.25 115.07 2dwa h VAL 537 Ca -0.45 -2.58 -0.57 0.00 0.82 0.00 0.00 66.70 63.93 2dwa h VAL 537 Cb 1.32 3.15 -0.09 0.00 -1.52 0.00 0.00 31.29 34.15 2dwa h VAL 537 CO 0.51 0.74 -0.57 -0.83 0.02 0.00 0.00 177.57 177.45 2dwa s GLY 538 N -4.49 2.09 0.12 2.17 0.00 -0.76 -4.90 107.32 101.55 2dwa s GLY 538 Ca -0.13 -1.96 0.16 0.00 0.00 0.00 0.00 44.72 42.80 2dwa s GLY 538 CO 0.86 -1.86 1.00 -0.55 0.00 0.00 0.00 173.10 172.55 2dwa h ASP 539 N 1.64 0.00 -4.03 1.64 3.32 -0.12 -3.42 116.42 115.46 2dwa h ASP 539 Ca -0.43 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.44 2dwa h ASP 539 Cb 1.25 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.55 2dwa h ASP 539 CO 0.67 0.58 -0.55 0.54 -1.72 0.00 0.00 179.24 178.76 2dwa s VAL 540 N -2.92 0.02 -0.04 -1.35 0.11 -1.01 -4.37 120.40 110.82 2dwa s VAL 540 Ca -0.01 -0.15 0.07 0.00 -2.93 0.00 0.00 61.98 58.96 2dwa s VAL 540 Cb 0.08 -0.25 -0.01 0.00 -1.53 0.00 0.00 36.38 34.67 2dwa s VAL 540 CO 0.79 -0.08 -0.25 0.00 -3.33 0.00 0.00 175.10 172.23 2dwa s ALA 541 N -0.22 2.15 -0.45 1.54 0.00 -0.64 -0.29 121.76 123.84 2dwa s ALA 541 Ca -0.03 -1.07 -0.09 0.00 0.00 0.00 0.00 51.96 50.77 2dwa s ALA 541 Cb -0.02 -0.62 0.11 0.00 0.00 0.00 0.00 23.12 22.58 2dwa s ALA 541 CO 0.00 0.45 0.32 -0.06 0.00 0.00 0.00 175.76 176.48 2dwa s PHE 542 N -0.32 3.40 0.00 0.00 0.08 -0.35 -0.99 117.98 119.80 2dwa s PHE 542 Ca 0.01 -1.76 0.00 0.00 0.12 0.00 0.00 56.93 55.31 2dwa s PHE 542 Cb -0.12 -3.32 0.00 0.00 -0.57 0.00 0.00 43.02 39.01 2dwa s PHE 542 CO 0.02 -0.95 0.00 1.33 -0.10 0.00 0.00 175.22 175.52 2dwa n VAL 543 N 4.91 0.00 -4.36 -0.44 0.24 -1.04 -3.84 118.33 113.81 2dwa n VAL 543 Ca -0.09 0.00 -0.24 0.00 -2.04 0.00 0.00 64.34 61.97 2dwa n VAL 543 Cb 0.41 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.70 2dwa n VAL 543 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 2dwa s LYS 544 N 1.25 2.05 0.22 7.34 -2.85 -1.26 -1.26 119.74 125.22 2dwa s LYS 544 Ca 0.00 -1.69 -0.11 0.00 -1.00 0.00 0.00 55.97 53.17 2dwa s LYS 544 Cb 0.00 -1.94 0.30 0.00 -2.06 0.00 0.00 37.83 34.13 2dwa s LYS 544 CO 0.00 0.22 1.63 -0.97 0.10 0.00 0.00 175.35 176.33 2dwa h ASN 545 N 1.91 -0.49 -0.25 0.03 -1.24 -1.30 -2.57 115.58 111.68 2dwa h ASN 545 Ca -0.43 0.19 0.01 0.00 0.71 0.00 0.00 56.30 56.78 2dwa h ASN 545 Cb 1.25 0.37 -0.01 0.00 0.73 0.00 0.00 38.32 40.66 2dwa h ASN 545 CO 0.64 -0.19 0.16 0.44 -1.29 0.00 0.00 177.43 177.20 2dwa h ASP 546 N 0.04 0.26 -0.54 1.15 5.19 -1.96 -2.84 116.42 117.73 2dwa h ASP 546 Ca 0.34 -0.01 0.02 0.00 -0.62 0.00 0.00 57.03 56.76 2dwa h ASP 546 Cb 0.55 -0.07 -0.03 0.00 0.18 0.00 0.00 39.33 39.96 2dwa h ASP 546 CO -0.65 0.19 0.34 0.74 -3.12 0.00 0.00 179.24 176.74 2dwa h THR 547 N 0.31 1.09 -0.20 0.35 2.02 -1.86 -0.52 112.91 114.10 2dwa h THR 547 Ca 0.09 -0.23 0.02 0.00 0.77 0.00 0.00 66.41 67.06 2dwa h THR 547 Cb -0.00 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 2dwa h THR 547 CO -0.02 0.12 0.07 0.58 0.37 0.00 0.00 175.52 176.64 2dwa h VAL 548 N 0.68 0.96 -0.51 3.16 2.07 -1.63 -2.49 116.25 118.49 2dwa h VAL 548 Ca 0.21 -0.06 -0.07 0.00 0.82 0.00 0.00 66.70 67.60 2dwa h VAL 548 Cb -0.02 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 2dwa h VAL 548 CO -0.08 0.03 0.02 -0.50 0.02 0.00 0.00 177.57 177.07 2dwa h TRP 549 N 0.17 0.89 0.00 1.57 4.06 -1.53 -2.96 115.95 118.14 2dwa h TRP 549 Ca 0.08 -0.12 0.00 0.00 2.06 0.00 0.00 58.89 60.91 2dwa h TRP 549 Cb 0.05 -0.24 0.00 0.00 -1.00 0.00 0.00 29.16 27.97 2dwa h TRP 549 CO -0.11 0.80 0.00 0.93 -3.56 0.00 0.00 178.44 176.50 2dwa h GLU 550 N 0.78 0.00 -0.01 0.49 5.08 -0.92 -3.24 114.58 116.76 2dwa h GLU 550 Ca 0.15 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2dwa h GLU 550 Cb 0.44 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 2dwa h GLU 550 CO 0.02 0.00 -0.08 0.09 -1.00 0.00 0.00 179.01 178.04 2dwa n ASN 551 N -2.38 2.28 -4.23 1.42 3.02 -0.96 -3.68 115.26 110.74 2dwa n ASN 551 Ca 0.04 -3.22 -0.13 0.00 -0.03 0.00 0.00 54.58 51.24 2dwa n ASN 551 Cb 0.37 -0.45 -0.10 0.00 -0.61 0.00 0.00 39.78 38.99 2dwa n ASN 551 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2dwa s THR 552 N -2.94 0.39 -1.46 3.41 -4.23 -1.18 -4.75 115.64 104.89 2dwa s THR 552 Ca 0.33 -1.97 -0.10 0.00 -1.18 0.00 0.00 61.69 58.77 2dwa s THR 552 Cb 0.30 -2.29 0.06 0.00 1.34 0.00 0.00 72.50 71.90 2dwa s THR 552 CO 0.02 -0.27 0.84 0.59 -0.54 0.00 0.00 174.62 175.25 2dwa n ASN 553 N -0.27 -5.13 0.00 3.99 4.13 0.13 -1.60 115.26 116.50 2dwa n ASN 553 Ca -0.03 -0.56 0.00 0.00 1.68 0.00 0.00 54.58 55.67 2dwa n ASN 553 Cb 0.65 -4.12 0.00 0.00 -1.54 0.00 0.00 39.78 34.76 2dwa n ASN 553 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2dwa n GLY 554 N -1.60 0.44 0.22 7.41 0.00 -1.26 -4.92 105.19 105.48 2dwa n GLY 554 Ca -0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.12 2dwa n GLY 554 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dwa h GLU 555 N 0.90 0.00 0.00 1.61 4.39 -1.55 -3.37 114.58 116.55 2dwa h GLU 555 Ca 0.00 0.00 -0.37 0.00 0.34 0.00 0.00 59.36 59.33 2dwa h GLU 555 Cb 0.13 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.71 2dwa h GLU 555 CO 0.00 0.19 -2.38 0.45 -1.16 0.00 0.00 179.01 176.11 2dwa n SER 556 N -3.28 2.09 0.00 1.42 2.88 -1.24 -4.89 113.62 110.60 2dwa n SER 556 Ca 0.01 -0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 2dwa n SER 556 Cb 0.45 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 2dwa n SER 556 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2dwa n THR 557 N -3.32 0.00 -1.97 2.46 -2.24 -1.26 -4.96 114.28 102.99 2dwa n THR 557 Ca -0.44 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 60.94 2dwa n THR 557 Cb 0.94 -0.09 -0.01 0.00 -2.10 0.00 0.00 70.33 69.07 2dwa n THR 557 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dwa s ALA 558 N -1.47 3.40 0.34 6.98 0.00 -1.26 -4.71 121.76 125.04 2dwa s ALA 558 Ca 0.00 1.36 0.09 0.00 0.00 0.00 0.00 51.96 53.42 2dwa s ALA 558 Cb 0.00 -3.53 0.84 0.00 0.00 0.00 0.00 23.12 20.43 2dwa s ALA 558 CO 0.00 -0.88 1.80 0.38 0.00 0.00 0.00 175.76 177.06 2dwa h ASP 559 N 2.90 0.68 0.97 0.00 2.03 -2.01 0.29 116.42 121.28 2dwa h ASP 559 Ca -0.50 0.08 -0.11 0.00 -0.73 0.00 0.00 57.03 55.77 2dwa h ASP 559 Cb 1.24 -0.05 -0.02 0.00 -0.83 0.00 0.00 39.33 39.68 2dwa h ASP 559 CO 0.64 0.26 -0.52 4.11 -1.03 0.00 0.00 179.24 182.69 2dwa h TRP 560 N 0.67 0.00 0.00 4.15 5.08 -2.01 -3.34 115.95 120.49 2dwa h TRP 560 Ca 0.54 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.51 2dwa h TRP 560 Cb 0.97 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.13 2dwa h TRP 560 CO -0.00 0.52 -1.94 0.00 -1.28 0.00 0.00 178.44 175.74 2dwa n ALA 561 N -2.31 2.92 -0.19 0.11 0.00 0.75 -4.60 120.51 117.19 2dwa n ALA 561 Ca 0.00 -0.52 0.01 0.00 0.00 0.00 0.00 53.44 52.93 2dwa n ALA 561 Cb 0.63 -0.75 0.04 0.00 0.00 0.00 0.00 19.45 19.36 2dwa n ALA 561 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2dwa n LYS 562 N -2.22 -0.09 -0.38 0.00 5.02 0.32 -1.75 118.16 119.06 2dwa n LYS 562 Ca -0.04 0.79 0.09 0.00 -2.02 0.00 0.00 58.31 57.14 2dwa n LYS 562 Cb 0.56 -1.18 0.27 0.00 -0.02 0.00 0.00 35.03 34.66 2dwa n LYS 562 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2dwa n ASN 563 N -4.78 3.84 -4.71 4.39 3.02 -1.26 -4.37 115.26 111.39 2dwa n ASN 563 Ca 0.06 -2.19 -0.42 0.00 -0.03 0.00 0.00 54.58 52.00 2dwa n ASN 563 Cb 0.22 -0.44 -0.03 0.00 -0.61 0.00 0.00 39.78 38.93 2dwa n ASN 563 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2dwa s LEU 564 N -1.36 4.37 -0.13 3.41 1.43 -0.72 -4.97 118.68 120.72 2dwa s LEU 564 Ca 0.41 1.78 -0.01 0.00 -1.03 0.00 0.00 54.13 55.28 2dwa s LEU 564 Cb 0.24 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.87 2dwa s LEU 564 CO 0.24 -0.33 -0.10 -0.75 0.23 0.00 0.00 176.35 175.64 2dwa s LYS 565 N 1.02 3.37 0.33 1.70 2.36 -1.26 0.17 119.74 127.43 2dwa s LYS 565 Ca 0.54 -0.63 0.12 0.00 -2.55 0.00 0.00 55.97 53.46 2dwa s LYS 565 Cb -0.24 -2.70 0.99 0.00 -1.05 0.00 0.00 37.83 34.83 2dwa s LYS 565 CO 0.28 0.28 1.70 0.00 1.55 0.00 0.00 175.35 179.17 2dwa h ARG 566 N 6.51 0.45 0.00 4.03 3.08 -1.92 -1.18 114.38 125.35 2dwa h ARG 566 Ca -0.30 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.72 2dwa h ARG 566 Cb 1.20 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.15 2dwa h ARG 566 CO 0.57 0.30 0.00 1.49 -1.07 0.00 0.00 179.97 181.26 2dwa h GLU 567 N 0.46 0.00 -0.00 0.04 4.22 -2.02 -2.20 114.58 115.07 2dwa h GLU 567 Ca 0.68 0.00 0.00 0.00 0.08 0.00 0.00 59.36 60.12 2dwa h GLU 567 Cb 1.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.69 2dwa h GLU 567 CO -0.52 0.00 0.00 -0.25 -2.18 0.00 0.00 179.01 176.06 2dwa n ASP 568 N -2.50 0.06 -4.31 1.04 8.00 -0.44 -4.80 116.55 113.60 2dwa n ASP 568 Ca 0.01 -1.31 -0.25 0.00 0.71 0.00 0.00 54.79 53.95 2dwa n ASP 568 Cb 0.22 -0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.19 2dwa n ASP 568 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2dwa s PHE 569 N -1.99 1.92 0.04 1.24 0.08 -0.83 -0.79 117.98 117.65 2dwa s PHE 569 Ca 0.34 -0.41 0.05 0.00 0.12 0.00 0.00 56.93 57.03 2dwa s PHE 569 Cb 0.16 -1.05 -0.02 0.00 -0.57 0.00 0.00 43.02 41.53 2dwa s PHE 569 CO 0.26 0.23 -0.14 1.03 -0.10 0.00 0.00 175.22 176.51 2dwa s ARG 570 N -1.92 0.90 0.05 0.44 1.81 -0.35 -4.40 118.95 115.49 2dwa s ARG 570 Ca 0.08 -0.76 -0.20 0.00 -1.72 0.00 0.00 55.73 53.13 2dwa s ARG 570 Cb -0.10 -0.90 -0.06 0.00 -0.45 0.00 0.00 34.95 33.43 2dwa s ARG 570 CO 0.05 0.22 0.60 -0.51 -0.68 0.00 0.00 175.30 174.97 2dwa s LEU 571 N -1.17 4.49 -0.21 2.53 1.43 0.38 -0.43 118.68 125.70 2dwa s LEU 571 Ca 0.01 1.26 -0.19 0.00 -1.03 0.00 0.00 54.13 54.18 2dwa s LEU 571 Cb -0.08 -2.94 -0.03 0.00 0.03 0.00 0.00 46.19 43.17 2dwa s LEU 571 CO 0.01 0.20 0.56 -0.76 0.23 0.00 0.00 176.35 176.59 2dwa s LEU 572 N -0.75 4.13 0.23 1.79 1.43 -0.09 -1.36 118.68 124.06 2dwa s LEU 572 Ca 0.30 0.70 -0.01 0.00 -1.03 0.00 0.00 54.13 54.10 2dwa s LEU 572 Cb -0.19 -2.76 -0.04 0.00 0.03 0.00 0.00 46.19 43.22 2dwa s LEU 572 CO 0.19 -0.23 0.43 0.00 0.23 0.00 0.00 176.35 176.97 2dwa h LEU 574 N 1.80 0.00 -0.82 0.00 3.38 -1.87 -2.51 115.31 115.29 2dwa h LEU 574 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2dwa h LEU 574 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2dwa h LEU 574 CO 0.67 0.08 0.00 -0.90 0.09 0.00 0.00 178.44 178.38 2dwa n ASP 575 N -3.27 1.12 0.00 -0.43 5.75 -1.26 -4.86 116.55 113.59 2dwa n ASP 575 Ca -0.00 -2.05 0.00 0.00 -0.01 0.00 0.00 54.79 52.72 2dwa n ASP 575 Cb 0.30 -0.22 0.00 0.00 -1.03 0.00 0.00 41.12 40.17 2dwa n ASP 575 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dwa n GLY 576 N 0.56 0.81 3.93 6.12 0.00 -0.95 -5.05 105.19 110.62 2dwa n GLY 576 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 2dwa n GLY 576 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dwa s THR 577 N -3.08 3.54 -0.06 2.61 2.01 -1.25 -4.66 115.64 114.75 2dwa s THR 577 Ca 0.00 -0.21 0.04 0.00 0.31 0.00 0.00 61.69 61.83 2dwa s THR 577 Cb 0.00 -3.38 0.00 0.00 0.01 0.00 0.00 72.50 69.13 2dwa s THR 577 CO 0.00 -0.35 -0.17 -0.13 -0.69 0.00 0.00 174.62 173.28 2dwa s ARG 578 N -4.88 2.01 0.13 4.92 0.52 -1.26 -1.93 118.95 118.46 2dwa s ARG 578 Ca 0.53 -0.61 0.05 0.00 -0.52 0.00 0.00 55.73 55.18 2dwa s ARG 578 Cb -0.10 -1.67 -0.04 0.00 0.52 0.00 0.00 34.95 33.66 2dwa s ARG 578 CO 0.43 0.18 -0.13 0.15 0.02 0.00 0.00 175.30 175.95 2dwa s LYS 579 N 0.26 1.02 0.83 3.54 1.02 -0.47 -4.95 119.74 121.01 2dwa s LYS 579 Ca -0.09 -1.29 -0.13 0.00 0.02 0.00 0.00 55.97 54.47 2dwa s LYS 579 Cb -0.14 -0.81 0.06 0.00 -0.52 0.00 0.00 37.83 36.43 2dwa s LYS 579 CO 0.04 0.14 0.95 -2.30 -0.92 0.00 0.00 175.35 173.26 2dwa n PRO 580 N 0.33 0.04 0.00 -1.68 -0.02 -1.26 -0.47 135.00 131.94 2dwa n PRO 580 Ca -0.14 0.08 0.10 0.00 -2.02 0.00 0.00 63.50 61.52 2dwa n PRO 580 Cb 0.58 -2.23 0.50 0.00 -0.02 0.00 0.00 33.50 32.32 2dwa n PRO 580 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2dwa n VAL 581 N -3.33 0.42 0.70 -1.45 0.24 -1.26 -1.33 118.33 112.32 2dwa n VAL 581 Ca 0.12 0.10 0.12 0.00 -2.04 0.00 0.00 64.34 62.65 2dwa n VAL 581 Cb 0.51 -0.77 0.48 0.00 -1.47 0.00 0.00 33.84 32.59 2dwa n VAL 581 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2dwa n THR 582 N -1.31 0.48 -1.09 3.34 -2.24 -1.26 -3.82 114.28 108.38 2dwa n THR 582 Ca 0.09 -0.05 -0.02 0.00 -2.27 0.00 0.00 64.05 61.79 2dwa n THR 582 Cb 0.17 -0.69 0.29 0.00 -2.10 0.00 0.00 70.33 68.00 2dwa n THR 582 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dwa n GLU 583 N -1.92 3.37 0.14 -0.78 4.71 -0.44 -4.67 120.64 121.04 2dwa n GLU 583 Ca 0.05 -3.06 0.12 0.00 -0.01 0.00 0.00 57.16 54.26 2dwa n GLU 583 Cb 0.34 -2.09 0.64 0.00 -1.01 0.00 0.00 31.44 29.31 2dwa n GLU 583 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2dwa h ALA 584 N 2.32 2.15 0.00 0.62 0.00 -1.76 -1.08 119.26 121.52 2dwa h ALA 584 Ca 0.20 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2dwa h ALA 584 Cb 2.06 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.84 2dwa h ALA 584 CO 0.58 -0.21 -0.13 0.37 0.00 0.00 0.00 179.25 179.86 2dwa h GLN 585 N 0.06 0.00 -0.23 0.00 4.15 -1.93 -2.50 115.11 114.66 2dwa h GLN 585 Ca 0.11 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.53 2dwa h GLN 585 Cb 0.37 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.06 2dwa h GLN 585 CO -0.01 0.13 0.00 -1.13 -1.93 0.00 0.00 178.83 175.89 2dwa n SER 586 N -3.98 2.70 -3.01 -0.69 3.41 -0.45 -4.77 113.62 106.82 2dwa n SER 586 Ca -0.02 -1.80 -0.16 0.00 -0.26 0.00 0.00 58.87 56.63 2dwa n SER 586 Cb 0.21 -0.15 -0.00 0.00 -0.26 0.00 0.00 64.21 64.01 2dwa n SER 586 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dwa s HIS 588 N -0.91 1.95 -0.08 0.00 -3.43 -1.21 -4.71 115.29 106.90 2dwa s HIS 588 Ca 0.33 -0.83 0.14 0.00 -0.80 0.00 0.00 55.06 53.90 2dwa s HIS 588 Cb 0.26 -1.21 -0.20 0.00 -1.43 0.00 0.00 32.58 30.00 2dwa s HIS 588 CO -0.12 0.14 0.67 1.28 -2.00 0.00 0.00 174.74 174.71 2dwa n LEU 589 N -0.64 0.80 -3.63 5.38 4.77 0.68 -4.71 117.00 119.66 2dwa n LEU 589 Ca -0.04 0.37 -0.01 0.00 -0.03 0.00 0.00 56.01 56.30 2dwa n LEU 589 Cb 0.65 0.16 -0.01 0.00 -2.33 0.00 0.00 43.42 41.89 2dwa n LEU 589 CO 0.41 0.32 0.96 0.00 -1.33 0.00 0.00 177.39 177.75 2dwa s ALA 590 N -2.70 -2.07 -0.14 -1.18 0.00 -1.24 -5.02 121.76 109.41 2dwa s ALA 590 Ca -0.05 0.84 -0.10 0.00 0.00 0.00 0.00 51.96 52.65 2dwa s ALA 590 Cb 0.08 0.30 -0.05 0.00 0.00 0.00 0.00 23.12 23.45 2dwa s ALA 590 CO 0.82 -0.92 0.19 0.54 0.00 0.00 0.00 175.76 176.40 2dwa s VAL 591 N -2.62 5.39 -0.01 0.00 0.11 -1.26 -1.44 120.40 120.56 2dwa s VAL 591 Ca 0.12 0.33 -0.00 0.00 -2.93 0.00 0.00 61.98 59.50 2dwa s VAL 591 Cb 0.02 -3.50 -0.04 0.00 -1.53 0.00 0.00 36.38 31.33 2dwa s VAL 591 CO -0.03 0.51 0.06 0.00 -3.33 0.00 0.00 175.10 172.30 2dwa s ALA 592 N -0.28 3.49 0.34 1.54 0.00 0.26 -4.89 121.76 122.22 2dwa s ALA 592 Ca 0.14 -0.88 -0.28 0.00 0.00 0.00 0.00 51.96 50.93 2dwa s ALA 592 Cb -0.12 -1.52 -0.10 0.00 0.00 0.00 0.00 23.12 21.38 2dwa s ALA 592 CO 0.03 0.67 1.31 -1.25 0.00 0.00 0.00 175.76 176.52 2dwa s PRO 593 N -1.61 4.32 0.70 0.00 0.04 -1.26 -0.87 135.00 136.32 2dwa s PRO 593 Ca 0.21 2.21 -0.16 0.00 0.04 0.00 0.00 61.00 63.30 2dwa s PRO 593 Cb -0.12 -3.04 0.01 0.00 0.04 0.00 0.00 34.50 31.39 2dwa s PRO 593 CO 0.12 -0.22 1.09 0.09 0.04 0.00 0.00 177.00 178.11 2dwa n ASN 594 N 0.73 1.01 -4.66 6.66 3.02 -1.26 -4.47 115.26 116.29 2dwa n ASN 594 Ca 0.00 0.71 -0.37 0.00 -0.03 0.00 0.00 54.58 54.90 2dwa n ASN 594 Cb 0.42 -1.46 0.06 0.00 -0.61 0.00 0.00 39.78 38.19 2dwa n ASN 594 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2dwa n HIS 595 N -2.37 1.19 -3.73 3.10 8.25 -1.26 -4.59 115.22 115.80 2dwa n HIS 595 Ca 0.14 0.42 -0.13 0.00 -0.26 0.00 0.00 57.72 57.89 2dwa n HIS 595 Cb 0.49 -2.18 -0.09 0.00 1.12 0.00 0.00 29.99 29.33 2dwa n HIS 595 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2dwa s ALA 596 N -1.50 -0.94 0.17 -1.41 0.00 -0.77 -1.02 121.76 116.29 2dwa s ALA 596 Ca 0.79 0.81 -0.30 0.00 0.00 0.00 0.00 51.96 53.25 2dwa s ALA 596 Cb -0.39 -0.32 -0.08 0.00 0.00 0.00 0.00 23.12 22.32 2dwa s ALA 596 CO 0.44 -0.23 1.31 0.08 0.00 0.00 0.00 175.76 177.37 2dwa s VAL 597 N -0.48 3.29 0.20 0.00 1.01 0.38 -0.80 120.40 124.00 2dwa s VAL 597 Ca -0.06 1.03 0.11 0.00 0.00 0.00 0.00 61.98 63.05 2dwa s VAL 597 Cb -0.04 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2dwa s VAL 597 CO 0.03 0.13 -0.22 0.68 0.00 0.00 0.00 175.10 175.72 2dwa s VAL 598 N 0.36 2.24 0.24 2.92 -7.23 -0.17 -0.29 120.40 118.47 2dwa s VAL 598 Ca 0.58 -2.07 -0.13 0.00 -1.81 0.00 0.00 61.98 58.56 2dwa s VAL 598 Cb -0.36 -2.08 -0.00 0.00 0.56 0.00 0.00 36.38 34.49 2dwa s VAL 598 CO 0.36 -0.22 0.47 -0.94 -0.31 0.00 0.00 175.10 174.46 2dwa s SER 599 N -2.81 -0.09 0.33 4.85 1.04 -0.63 -2.97 113.70 113.42 2dwa s SER 599 Ca 0.21 -0.93 -0.29 0.00 0.48 0.00 0.00 55.95 55.42 2dwa s SER 599 Cb -0.07 0.58 -0.11 0.00 0.10 0.00 0.00 66.02 66.52 2dwa s SER 599 CO 0.10 -1.13 1.55 0.54 0.98 0.00 0.00 173.24 175.28 2dwa n ARG 600 N -0.38 2.69 -0.32 4.02 1.74 -1.26 -0.27 116.66 122.88 2dwa n ARG 600 Ca -0.02 0.95 0.09 0.00 -0.77 0.00 0.00 57.85 58.11 2dwa n ARG 600 Cb 0.62 -2.71 0.26 0.00 -1.02 0.00 0.00 32.46 29.61 2dwa n ARG 600 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2dwa h SER 601 N 3.99 0.63 0.35 0.55 0.87 -1.92 0.79 113.55 118.81 2dwa h SER 601 Ca -0.49 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 2dwa h SER 601 Cb 1.23 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 2dwa h SER 601 CO 0.73 0.25 0.00 -0.90 -0.53 0.00 0.00 176.83 176.37 2dwa n ASP 602 N -4.83 0.02 -0.10 6.23 5.75 -1.26 -2.08 116.55 120.29 2dwa n ASP 602 Ca 0.20 0.51 0.04 0.00 -0.01 0.00 0.00 54.79 55.53 2dwa n ASP 602 Cb 0.49 -0.51 -0.03 0.00 -1.03 0.00 0.00 41.12 40.04 2dwa n ASP 602 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2dwa n ARG 603 N -1.53 3.11 -0.22 0.11 5.12 0.22 -4.79 116.66 118.68 2dwa n ARG 603 Ca 0.02 -0.28 0.01 0.00 -1.93 0.00 0.00 57.85 55.68 2dwa n ARG 603 Cb 0.12 -1.00 0.13 0.00 -1.16 0.00 0.00 32.46 30.56 2dwa n ARG 603 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2dwa h ALA 604 N 1.47 0.88 -0.36 7.54 0.00 -0.85 -1.73 119.26 126.20 2dwa h ALA 604 Ca 0.00 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 2dwa h ALA 604 Cb 0.27 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2dwa h ALA 604 CO 0.00 -0.18 -0.23 0.00 0.00 0.00 0.00 179.25 178.85 2dwa h ALA 605 N 1.45 0.92 -0.10 0.00 0.00 -1.87 -1.51 119.26 118.15 2dwa h ALA 605 Ca 0.34 -0.37 -0.20 0.00 0.00 0.00 0.00 54.91 54.68 2dwa h ALA 605 Cb 0.44 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.09 2dwa h ALA 605 CO -0.33 0.62 -0.72 1.25 0.00 0.00 0.00 179.25 180.07 2dwa h HIS 606 N 0.63 0.92 -0.56 0.00 6.17 -1.76 -2.66 115.15 117.89 2dwa h HIS 606 Ca 0.09 -0.43 -0.01 0.00 0.71 0.00 0.00 60.37 60.73 2dwa h HIS 606 Cb 0.72 -0.13 -0.03 0.00 2.52 0.00 0.00 27.41 30.49 2dwa h HIS 606 CO 0.03 1.25 0.32 0.28 0.71 0.00 0.00 177.93 180.52 2dwa h VAL 607 N 0.34 1.18 0.07 5.26 2.07 -1.18 -2.58 116.25 121.40 2dwa h VAL 607 Ca -0.06 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.03 2dwa h VAL 607 Cb 1.36 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2dwa h VAL 607 CO 0.15 0.19 -0.10 -0.08 0.02 0.00 0.00 177.57 177.75 2dwa h GLU 608 N 0.75 -0.19 -0.41 1.57 4.81 -1.27 -1.23 114.58 118.61 2dwa h GLU 608 Ca 0.20 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.49 2dwa h GLU 608 Cb 0.02 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.40 2dwa h GLU 608 CO -0.03 -0.13 0.15 0.37 -0.73 0.00 0.00 179.01 178.64 2dwa h GLN 609 N -0.20 0.31 -0.34 1.92 4.15 -1.44 -1.79 115.11 117.71 2dwa h GLN 609 Ca 0.02 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 2dwa h GLN 609 Cb 0.21 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.81 2dwa h GLN 609 CO -0.05 0.21 0.19 0.28 -1.93 0.00 0.00 178.83 177.53 2dwa h VAL 610 N 0.32 1.13 -0.73 2.39 2.07 -1.31 -2.79 116.25 117.34 2dwa h VAL 610 Ca 0.19 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.31 2dwa h VAL 610 Cb 0.16 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 2dwa h VAL 610 CO -0.18 0.14 0.25 -0.07 0.02 0.00 0.00 177.57 177.72 2dwa h LEU 611 N 0.43 1.04 -0.89 2.57 4.07 -1.02 0.70 115.31 122.21 2dwa h LEU 611 Ca 0.12 -0.20 0.04 0.00 0.08 0.00 0.00 57.88 57.92 2dwa h LEU 611 Cb 0.05 -0.27 -0.05 0.00 1.08 0.00 0.00 40.66 41.46 2dwa h LEU 611 CO -0.02 0.96 0.57 -0.07 -1.08 0.00 0.00 178.44 178.80 2dwa h LEU 612 N 1.06 0.95 -0.35 1.67 3.38 -1.29 -0.67 115.31 120.06 2dwa h LEU 612 Ca 0.24 -0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.02 2dwa h LEU 612 Cb 0.27 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2dwa h LEU 612 CO -0.01 0.64 -0.54 -0.74 0.09 0.00 0.00 178.44 177.89 2dwa h HIS 613 N 1.10 1.02 -0.59 1.13 2.76 -1.17 -2.84 115.15 116.56 2dwa h HIS 613 Ca 0.36 -0.36 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2dwa h HIS 613 Cb 0.03 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 28.77 2dwa h HIS 613 CO -0.02 1.17 0.38 1.96 -1.30 0.00 0.00 177.93 180.13 2dwa h GLN 614 N 0.63 0.78 0.00 5.26 1.08 -0.53 -2.83 115.11 119.50 2dwa h GLN 614 Ca 0.02 -0.05 -0.14 0.00 -1.45 0.00 0.00 58.65 57.02 2dwa h GLN 614 Cb 1.13 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 28.37 2dwa h GLN 614 CO 0.12 0.53 -0.69 -0.56 -0.95 0.00 0.00 178.83 177.27 2dwa h GLN 615 N 0.80 0.00 0.00 1.46 3.07 -1.11 -0.56 115.11 118.77 2dwa h GLN 615 Ca 0.22 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.93 2dwa h GLN 615 Cb -0.08 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.48 2dwa h GLN 615 CO -0.05 0.69 -0.12 0.00 0.09 0.00 0.00 178.83 179.44 2dwa h ALA 616 N 1.31 1.62 0.10 0.06 0.00 -1.27 0.34 119.26 121.42 2dwa h ALA 616 Ca -0.01 -0.11 -0.29 0.00 0.00 0.00 0.00 54.91 54.50 2dwa h ALA 616 Cb 1.50 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 2dwa h ALA 616 CO 0.09 0.15 -1.53 -0.07 0.00 0.00 0.00 179.25 177.90 2dwa h LEU 617 N 0.00 0.33 -0.72 0.00 3.38 -1.34 -2.20 115.31 114.76 2dwa h LEU 617 Ca -0.00 -0.83 0.00 0.00 0.09 0.00 0.00 57.88 57.14 2dwa h LEU 617 Cb 0.24 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2dwa h LEU 617 CO 0.02 1.66 0.00 0.49 0.09 0.00 0.00 178.44 180.69 2dwa n PHE 618 N -3.90 0.00 -0.23 1.13 3.72 -0.23 -0.10 117.46 117.84 2dwa n PHE 618 Ca -0.28 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.12 2dwa n PHE 618 Cb 0.90 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.44 2dwa n PHE 618 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dwa n GLY 619 N 0.17 -2.24 0.21 1.37 0.00 0.12 -1.75 105.19 103.07 2dwa n GLY 619 Ca 0.00 -1.43 -0.07 0.00 0.00 0.00 0.00 46.02 44.52 2dwa n GLY 619 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2dwa h LYS 620 N 0.00 -0.13 -0.51 1.61 3.64 -1.79 -1.88 116.57 117.50 2dwa h LYS 620 Ca 0.00 0.01 -0.35 0.00 -1.27 0.00 0.00 60.65 59.04 2dwa h LYS 620 Cb 0.00 0.03 -0.23 0.00 -0.41 0.00 0.00 32.23 31.62 2dwa h LYS 620 CO 0.00 -0.09 -0.34 0.09 -2.27 0.00 0.00 179.45 176.84 2dwa n ASN 621 N -5.32 3.86 -4.71 4.20 3.02 -1.26 -4.88 115.26 110.17 2dwa n ASN 621 Ca -0.01 -3.80 -0.33 0.00 -0.03 0.00 0.00 54.58 50.41 2dwa n ASN 621 Cb 0.23 -0.54 0.11 0.00 -0.61 0.00 0.00 39.78 38.98 2dwa n ASN 621 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2dwa s GLY 622 N -3.01 2.13 0.32 7.41 0.00 -0.71 -4.89 107.32 108.58 2dwa s GLY 622 Ca 0.48 0.77 0.09 0.00 0.00 0.00 0.00 44.72 46.06 2dwa s GLY 622 CO -0.00 1.18 1.65 0.50 0.00 0.00 0.00 173.10 176.43 2dwa h LYS 623 N -0.78 0.24 -0.12 2.90 6.56 -1.18 -2.77 116.57 121.41 2dwa h LYS 623 Ca -0.46 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.11 2dwa h LYS 623 Cb 1.29 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.89 2dwa h LYS 623 CO 0.47 0.16 0.00 0.09 -2.06 0.00 0.00 179.45 178.11 2dwa n ASN 624 N -5.16 2.27 0.00 0.86 3.02 0.85 -4.89 115.26 112.22 2dwa n ASN 624 Ca 0.27 -1.92 0.00 0.00 -0.03 0.00 0.00 54.58 52.90 2dwa n ASN 624 Cb 0.86 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.95 2dwa n ASN 624 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dwa h PRO 626 N 0.00 0.40 0.25 0.00 0.11 -1.82 -2.12 132.00 128.81 2dwa h PRO 626 Ca 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 2dwa h PRO 626 Cb 0.00 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.02 2dwa h PRO 626 CO 0.00 0.26 -0.12 -0.44 -0.21 0.00 0.00 178.00 177.49 2dwa h ASP 627 N 0.41 -0.29 0.00 -2.05 3.32 -1.91 -3.42 116.42 112.48 2dwa h ASP 627 Ca 0.66 -0.23 -0.13 0.00 0.02 0.00 0.00 57.03 57.35 2dwa h ASP 627 Cb 1.56 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 41.17 2dwa h ASP 627 CO -0.41 0.20 -1.33 0.29 -1.72 0.00 0.00 179.24 176.27 2dwa n LYS 628 N -5.02 0.47 -3.66 3.56 5.02 0.18 -5.07 118.16 113.64 2dwa n LYS 628 Ca -0.08 0.19 -0.10 0.00 -2.02 0.00 0.00 58.31 56.30 2dwa n LYS 628 Cb 0.25 -1.31 -0.08 0.00 -0.02 0.00 0.00 35.03 33.87 2dwa n LYS 628 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2dwa s PHE 629 N -2.67 -0.82 -0.25 2.13 5.36 -0.32 -5.02 117.98 116.39 2dwa s PHE 629 Ca -0.28 1.76 -0.02 0.00 -0.96 0.00 0.00 56.93 57.44 2dwa s PHE 629 Cb 0.06 0.41 0.03 0.00 -0.34 0.00 0.00 43.02 43.18 2dwa s PHE 629 CO 0.38 -0.41 -0.06 0.00 -1.46 0.00 0.00 175.22 173.67 2dwa h LEU 631 N 8.01 0.51 -3.45 0.00 3.38 -1.67 -3.05 115.31 119.04 2dwa h LEU 631 Ca -0.32 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2dwa h LEU 631 Cb 1.10 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2dwa h LEU 631 CO 0.57 0.18 0.00 0.49 0.09 0.00 0.00 178.44 179.77 2dwa n PHE 632 N -4.59 1.67 -4.64 1.13 3.72 -1.26 -4.71 117.46 108.78 2dwa n PHE 632 Ca 0.21 -0.77 -0.29 0.00 -0.05 0.00 0.00 57.45 56.55 2dwa n PHE 632 Cb 0.70 -0.43 -0.14 0.00 -0.94 0.00 0.00 39.48 38.67 2dwa n PHE 632 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2dwa s LYS 633 N -2.74 1.59 -0.22 -1.08 3.01 -1.16 -4.22 119.74 114.91 2dwa s LYS 633 Ca 0.50 -1.23 0.07 0.00 -1.01 0.00 0.00 55.97 54.30 2dwa s LYS 633 Cb 0.39 -1.93 0.23 0.00 -1.01 0.00 0.00 37.83 35.51 2dwa s LYS 633 CO 0.14 0.48 1.11 -1.13 0.51 0.00 0.00 175.35 176.46 2dwa n SER 634 N 1.33 -0.96 -3.87 2.83 3.41 -1.26 -4.90 113.62 110.19 2dwa n SER 634 Ca -0.17 -1.75 -0.37 0.00 -0.26 0.00 0.00 58.87 56.31 2dwa n SER 634 Cb 0.52 0.50 0.02 0.00 -0.26 0.00 0.00 64.21 65.00 2dwa n SER 634 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2dwa n GLU 635 N -0.82 -0.79 -0.95 4.33 4.71 -1.26 -2.38 120.64 123.48 2dwa n GLU 635 Ca -0.11 0.36 0.00 0.00 -0.01 0.00 0.00 57.16 57.40 2dwa n GLU 635 Cb 0.72 -3.07 0.00 0.00 -1.01 0.00 0.00 31.44 28.08 2dwa n GLU 635 CO 0.00 0.00 0.00 -2.37 0.09 0.00 0.00 177.13 174.85 2dwa n THR 636 N -4.25 0.00 1.02 2.62 5.66 -1.26 -4.84 114.28 113.23 2dwa n THR 636 Ca -0.14 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 60.97 2dwa n THR 636 Cb 0.59 -0.48 -0.01 0.00 -1.55 0.00 0.00 70.33 68.88 2dwa n THR 636 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2dwa n LYS 637 N -1.11 0.45 -3.62 1.09 5.02 -1.00 -4.84 118.16 114.15 2dwa n LYS 637 Ca 0.00 -0.36 -0.25 0.00 -2.02 0.00 0.00 58.31 55.68 2dwa n LYS 637 Cb 0.21 -1.49 0.04 0.00 -0.02 0.00 0.00 35.03 33.77 2dwa n LYS 637 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2dwa n ASN 638 N -0.96 -4.16 -4.69 4.39 5.03 -1.26 -4.94 115.26 108.67 2dwa n ASN 638 Ca 0.06 -0.90 -0.38 0.00 0.87 0.00 0.00 54.58 54.23 2dwa n ASN 638 Cb 0.38 -3.91 -0.07 0.00 -1.02 0.00 0.00 39.78 35.16 2dwa n ASN 638 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2dwa s LEU 639 N -6.34 4.20 0.00 3.41 1.43 -1.26 -4.40 118.68 115.72 2dwa s LEU 639 Ca 0.32 0.70 0.00 0.00 -1.03 0.00 0.00 54.13 54.11 2dwa s LEU 639 Cb -0.09 -2.67 0.00 0.00 0.03 0.00 0.00 46.19 43.46 2dwa s LEU 639 CO 0.83 -0.10 0.00 0.18 0.23 0.00 0.00 176.35 177.49 2dwa n LEU 640 N 4.32 0.00 -4.15 1.79 4.77 -1.26 -4.75 117.00 117.72 2dwa n LEU 640 Ca -0.06 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.79 2dwa n LEU 640 Cb 0.51 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.49 2dwa n LEU 640 CO 0.42 0.00 -0.40 -0.36 -1.33 0.00 0.00 177.39 175.72 2dwa s PHE 641 N 0.00 0.91 0.28 -1.77 0.08 -1.26 -4.49 117.98 111.73 2dwa s PHE 641 Ca 0.00 -0.74 -0.30 0.00 0.12 0.00 0.00 56.93 56.02 2dwa s PHE 641 Cb 0.00 -0.52 -0.10 0.00 -0.57 0.00 0.00 43.02 41.83 2dwa s PHE 641 CO 0.00 -0.08 1.44 -0.80 -0.10 0.00 0.00 175.22 175.68 2dwa s ASN 642 N -2.54 6.61 0.60 1.36 0.01 -1.26 -4.45 114.94 115.26 2dwa s ASN 642 Ca 0.05 2.74 0.33 0.00 -0.71 0.00 0.00 52.86 55.28 2dwa s ASN 642 Cb -0.01 -2.63 1.90 0.00 0.41 0.00 0.00 41.25 40.92 2dwa s ASN 642 CO -0.02 -0.72 2.25 0.44 -1.51 0.00 0.00 177.10 177.54 2dwa h ASP 643 N 4.54 0.00 -0.16 -1.22 3.32 -1.90 -2.19 116.42 118.80 2dwa h ASP 643 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 2dwa h ASP 643 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2dwa h ASP 643 CO 0.75 0.02 0.00 -0.46 -1.72 0.00 0.00 179.24 177.83 2dwa n ASN 644 N -3.58 1.16 -4.69 6.45 6.94 -1.26 -4.76 115.26 115.52 2dwa n ASN 644 Ca -0.03 -1.77 -0.42 0.00 -0.02 0.00 0.00 54.58 52.35 2dwa n ASN 644 Cb 0.12 -0.10 -0.03 0.00 -2.36 0.00 0.00 39.78 37.40 2dwa n ASN 644 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2dwa s THR 645 N -1.79 3.09 -0.07 5.53 2.01 -0.83 -4.44 115.64 119.15 2dwa s THR 645 Ca 0.25 0.56 -0.17 0.00 0.31 0.00 0.00 61.69 62.64 2dwa s THR 645 Cb 0.13 -3.36 -0.29 0.00 0.01 0.00 0.00 72.50 68.98 2dwa s THR 645 CO 0.19 0.00 0.69 -0.08 -0.69 0.00 0.00 174.62 174.73 2dwa h GLU 646 N 8.17 0.30 -2.86 4.92 4.81 -1.10 -3.46 114.58 125.37 2dwa h GLU 646 Ca -0.42 -0.52 0.09 0.00 -0.13 0.00 0.00 59.36 58.38 2dwa h GLU 646 Cb 1.20 0.19 -0.06 0.00 0.63 0.00 0.00 28.75 30.71 2dwa h GLU 646 CO 0.93 1.25 0.29 0.00 -0.73 0.00 0.00 179.01 180.74 2dwa s LEU 648 N -2.92 4.30 0.03 0.00 1.43 -1.26 -1.10 118.68 119.16 2dwa s LEU 648 Ca 0.11 0.82 0.02 0.00 -1.03 0.00 0.00 54.13 54.05 2dwa s LEU 648 Cb -0.05 -2.67 -0.04 0.00 0.03 0.00 0.00 46.19 43.47 2dwa s LEU 648 CO 0.06 0.04 0.02 0.00 0.23 0.00 0.00 176.35 176.69 2dwa s ALA 649 N 0.43 3.34 0.65 4.21 0.00 0.10 -4.59 121.76 125.91 2dwa s ALA 649 Ca 0.25 -1.00 -0.16 0.00 0.00 0.00 0.00 51.96 51.06 2dwa s ALA 649 Cb -0.15 -1.33 -0.00 0.00 0.00 0.00 0.00 23.12 21.64 2dwa s ALA 649 CO 0.10 0.68 1.12 0.15 0.00 0.00 0.00 175.76 177.81 2dwa s LYS 650 N -1.88 2.80 -0.12 0.00 1.02 -0.14 -1.10 119.74 120.33 2dwa s LYS 650 Ca 0.23 1.45 -0.07 0.00 0.02 0.00 0.00 55.97 57.60 2dwa s LYS 650 Cb -0.12 -1.95 -0.02 0.00 -0.52 0.00 0.00 37.83 35.22 2dwa s LYS 650 CO 0.14 -1.26 -0.14 -0.07 -0.92 0.00 0.00 175.35 173.11 2dwa h LEU 651 N 0.14 0.00 -0.64 3.17 3.38 -1.89 -3.46 115.31 116.01 2dwa h LEU 651 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2dwa h LEU 651 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2dwa h LEU 651 CO 0.54 0.63 0.00 0.61 0.09 0.00 0.00 178.44 180.31 2dwa n GLY 652 N 1.65 -3.21 1.29 0.83 0.00 -1.26 -4.82 105.19 99.68 2dwa n GLY 652 Ca -0.05 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.10 2dwa n GLY 652 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dwa n GLY 653 N 0.06 0.65 2.01 -0.02 0.00 -1.26 -4.55 105.19 102.07 2dwa n GLY 653 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2dwa n GLY 653 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dwa n ARG 654 N -2.65 0.00 -2.32 1.61 1.74 -1.26 -4.73 116.66 109.06 2dwa n ARG 654 Ca 0.00 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.75 2dwa n ARG 654 Cb 0.00 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.43 2dwa n ARG 654 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2dwa s PRO 655 N -1.50 3.59 1.01 5.56 0.04 -1.26 -5.05 135.00 137.38 2dwa s PRO 655 Ca 0.00 1.29 -0.15 0.00 0.04 0.00 0.00 61.00 62.17 2dwa s PRO 655 Cb 0.00 -2.07 0.20 0.00 0.04 0.00 0.00 34.50 32.67 2dwa s PRO 655 CO 0.00 -0.60 1.19 0.95 0.04 0.00 0.00 177.00 178.58 2dwa s THR 656 N -2.20 1.88 0.42 1.26 -4.23 -1.26 -4.73 115.64 106.78 2dwa s THR 656 Ca 0.66 0.00 0.13 0.00 -1.18 0.00 0.00 61.69 61.29 2dwa s THR 656 Cb -0.16 -2.75 0.16 0.00 1.34 0.00 0.00 72.50 71.09 2dwa s THR 656 CO 0.28 0.00 1.95 0.10 -0.54 0.00 0.00 174.62 176.40 2dwa h TYR 657 N -1.86 0.08 -0.09 3.99 -0.00 -1.95 0.74 116.97 117.89 2dwa h TYR 657 Ca -0.47 -0.01 -0.20 0.00 0.00 0.00 0.00 58.73 58.05 2dwa h TYR 657 Cb 1.29 -0.02 0.01 0.00 0.00 0.00 0.00 36.73 38.01 2dwa h TYR 657 CO -0.88 0.27 -0.73 0.93 -0.00 0.00 0.00 178.16 177.74 2dwa h GLU 658 N 0.07 0.66 -0.38 0.10 5.08 -1.96 -1.50 114.58 116.65 2dwa h GLU 658 Ca 0.01 -0.59 -0.08 0.00 -1.00 0.00 0.00 59.36 57.70 2dwa h GLU 658 Cb 0.38 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2dwa h GLU 658 CO 0.03 1.20 -0.12 0.93 -1.00 0.00 0.00 179.01 180.05 2dwa h GLU 659 N 0.32 0.66 -0.44 2.33 5.08 -1.88 -0.93 114.58 119.73 2dwa h GLU 659 Ca -0.07 -0.21 -0.08 0.00 -1.00 0.00 0.00 59.36 58.01 2dwa h GLU 659 Cb 1.38 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.56 2dwa h GLU 659 CO 0.15 0.76 -0.03 -0.92 -1.00 0.00 0.00 179.01 177.97 2dwa h TYR 660 N 0.61 0.87 0.00 4.33 3.20 -0.68 -3.19 116.97 122.11 2dwa h TYR 660 Ca 0.11 -0.16 -0.20 0.00 3.14 0.00 0.00 58.73 61.62 2dwa h TYR 660 Cb 0.55 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 2dwa h TYR 660 CO 0.02 0.86 -0.94 -0.07 -1.64 0.00 0.00 178.16 176.39 2dwa h LEU 661 N 0.62 0.02 0.00 2.82 3.38 -1.23 -3.48 115.31 117.44 2dwa h LEU 661 Ca 0.12 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2dwa h LEU 661 Cb 0.53 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2dwa h LEU 661 CO 0.03 0.95 0.00 0.61 0.09 0.00 0.00 178.44 180.12 2dwa n GLY 662 N 1.17 -0.19 0.37 0.83 0.00 -0.36 -4.31 105.19 102.71 2dwa n GLY 662 Ca -0.00 -1.43 -0.01 0.00 0.00 0.00 0.00 46.02 44.58 2dwa n GLY 662 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2dwa h THR 663 N 0.00 1.22 -0.63 2.61 2.02 -1.90 -0.75 112.91 115.49 2dwa h THR 663 Ca 0.00 -0.41 0.06 0.00 0.77 0.00 0.00 66.41 66.82 2dwa h THR 663 Cb 0.00 -0.10 -0.08 0.00 -1.74 0.00 0.00 68.15 66.23 2dwa h THR 663 CO 0.00 0.22 -0.43 -0.08 0.37 0.00 0.00 175.52 175.60 2dwa h GLU 664 N 1.21 -0.08 -0.30 6.66 4.81 -1.95 -2.32 114.58 122.61 2dwa h GLU 664 Ca 0.34 0.01 -0.16 0.00 -0.13 0.00 0.00 59.36 59.41 2dwa h GLU 664 Cb -0.12 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 2dwa h GLU 664 CO -0.08 -0.05 -0.45 -0.92 -0.73 0.00 0.00 179.01 176.78 2dwa h TYR 665 N -0.08 1.02 -0.30 0.92 3.20 -1.62 -3.14 116.97 116.97 2dwa h TYR 665 Ca 0.10 -0.34 0.00 0.00 3.14 0.00 0.00 58.73 61.63 2dwa h TYR 665 Cb 0.34 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 2dwa h TYR 665 CO -0.92 1.15 0.20 0.28 -1.64 0.00 0.00 178.16 177.22 2dwa h VAL 666 N 0.60 1.08 0.13 1.81 2.07 -1.07 -2.13 116.25 118.73 2dwa h VAL 666 Ca 0.03 -0.14 -0.29 0.00 0.82 0.00 0.00 66.70 67.11 2dwa h VAL 666 Cb 1.05 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 2dwa h VAL 666 CO 0.10 0.08 -1.39 0.71 0.02 0.00 0.00 177.57 177.09 2dwa h THR 667 N 0.40 1.33 -0.40 2.57 1.35 -1.43 -2.55 112.91 114.18 2dwa h THR 667 Ca 0.11 -2.92 0.08 0.00 -0.55 0.00 0.00 66.41 63.13 2dwa h THR 667 Cb -0.04 2.86 -0.09 0.00 -1.73 0.00 0.00 68.15 69.15 2dwa h THR 667 CO -0.02 0.85 -0.32 0.00 -0.25 0.00 0.00 175.52 175.78 2dwa h ALA 668 N 0.52 -0.17 -0.35 6.62 0.00 -1.43 -1.08 119.26 123.38 2dwa h ALA 668 Ca -0.19 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2dwa h ALA 668 Cb 2.00 0.69 -0.02 0.00 0.00 0.00 0.00 17.79 20.47 2dwa h ALA 668 CO 0.19 -0.72 0.19 0.82 0.00 0.00 0.00 179.25 179.73 2dwa h ILE 669 N -0.25 1.14 -0.42 0.00 2.04 -1.41 -2.16 117.51 116.45 2dwa h ILE 669 Ca 0.17 -0.37 0.03 0.00 1.00 0.00 0.00 64.86 65.70 2dwa h ILE 669 Cb 0.53 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 2dwa h ILE 669 CO -0.53 0.14 0.22 0.00 0.00 0.00 0.00 178.15 177.98 2dwa h ALA 670 N 1.06 0.53 -0.52 1.87 0.00 -1.23 0.10 119.26 121.07 2dwa h ALA 670 Ca 0.12 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2dwa h ALA 670 Cb 0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2dwa h ALA 670 CO -0.02 -0.13 0.34 -0.91 0.00 0.00 0.00 179.25 178.53 2dwa h ASN 671 N 0.44 0.58 -0.11 0.00 2.35 -1.08 -2.60 115.58 115.17 2dwa h ASN 671 Ca 0.18 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.83 2dwa h ASN 671 Cb 0.07 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 2dwa h ASN 671 CO -0.11 0.42 -0.19 0.25 -1.65 0.00 0.00 177.43 176.15 2dwa h LEU 672 N 0.69 0.51 -1.84 1.61 5.85 -1.10 -3.04 115.31 117.98 2dwa h LEU 672 Ca 0.19 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2dwa h LEU 672 Cb -0.07 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 2dwa h LEU 672 CO -0.05 0.71 -0.06 0.11 -0.34 0.00 0.00 178.44 178.81 2dwa h LYS 673 N 0.46 0.00 0.00 1.25 1.79 -0.60 -1.88 116.57 117.60 2dwa h LYS 673 Ca 0.08 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.55 2dwa h LYS 673 Cb 0.59 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.24 2dwa h LYS 673 CO 0.04 0.06 -0.00 0.87 -1.08 0.00 0.00 179.45 179.34 2dwa h LYS 674 N 0.00 0.00 -0.03 3.15 1.79 -1.38 -2.59 116.57 117.51 2dwa h LYS 674 Ca -0.00 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.28 2dwa h LYS 674 Cb 0.39 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.04 2dwa h LYS 674 CO 0.01 0.00 -0.79 0.00 -1.08 0.00 0.00 179.45 177.59 2dwa n SER 676 N -3.74 1.73 -2.55 0.00 7.64 -0.98 -5.04 113.62 110.68 2dwa n SER 676 Ca -0.04 0.06 -0.20 0.00 1.01 0.00 0.00 58.87 59.70 2dwa n SER 676 Cb 0.75 -0.41 0.01 0.00 -1.01 0.00 0.00 64.21 63.55 2dwa n SER 676 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2dwa n LEU 681 N -3.27 3.49 0.00 -3.43 7.94 -1.26 -5.14 117.00 115.32 2dwa n LEU 681 Ca -0.36 -4.66 0.00 0.00 -1.11 0.00 0.00 56.01 49.87 2dwa n LEU 681 Cb 1.04 -0.13 0.00 0.00 0.53 0.00 0.00 43.42 44.86 2dwa n LEU 681 CO 0.36 1.99 0.00 -1.84 -1.11 0.00 0.00 177.39 176.79 2dwa n GLU 682 N -0.32 0.00 -3.04 1.96 0.28 -1.26 -5.13 120.64 113.13 2dwa n GLU 682 Ca 0.28 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.28 2dwa n GLU 682 Cb 0.72 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.59 2dwa n GLU 682 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2dwa n ALA 683 N -0.01 0.00 -2.01 -1.84 0.00 -1.26 -5.10 120.51 110.29 2dwa n ALA 683 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 2dwa n ALA 683 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2dwa n ALA 683 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dwa n ALA 685 N 2.66 2.40 -0.22 0.00 0.00 -1.26 -5.05 120.51 119.05 2dwa n ALA 685 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2dwa n ALA 685 Cb 0.43 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.88 2dwa n ALA 685 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69