#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3t h ARG 366 N 0.00 0.00 -0.59 -1.40 0.11 -2.04 -2.11 114.38 108.35 3h3t h ARG 366 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3h3t h ARG 366 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 3h3t h ARG 366 CO 0.00 0.00 0.00 1.19 0.10 0.00 0.00 179.97 181.26 3h3t n PHE 367 N -2.39 0.78 -0.16 4.08 3.72 -1.26 -4.67 117.46 117.56 3h3t n PHE 367 Ca -0.01 -0.46 -0.02 0.00 -0.05 0.00 0.00 57.45 56.91 3h3t n PHE 367 Cb 0.05 -0.01 0.07 0.00 -0.94 0.00 0.00 39.48 38.65 3h3t n PHE 367 CO 0.00 0.00 0.00 -0.39 -0.05 0.00 0.00 176.76 176.32 3h3t h VAL 368 N 3.74 0.66 -0.33 -4.37 -1.51 -1.82 -0.51 116.25 112.12 3h3t h VAL 368 Ca 0.00 -0.06 -0.08 0.00 -1.23 0.00 0.00 66.70 65.33 3h3t h VAL 368 Cb 0.92 0.46 -0.01 0.00 -2.13 0.00 0.00 31.29 30.53 3h3t h VAL 368 CO 0.00 0.03 -0.11 1.56 -1.23 0.00 0.00 177.57 177.83 3h3t h GLN 369 N 0.19 0.65 -0.44 5.19 4.20 -1.85 -1.40 115.11 121.65 3h3t h GLN 369 Ca 0.26 -0.26 0.03 0.00 0.06 0.00 0.00 58.65 58.74 3h3t h GLN 369 Cb 0.37 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.09 3h3t h GLN 369 CO -0.37 0.84 0.23 -0.22 -0.67 0.00 0.00 178.83 178.64 3h3t h LYS 370 N 0.43 0.44 -0.44 1.46 1.63 -1.82 -1.92 116.57 116.36 3h3t h LYS 370 Ca 0.08 -0.03 0.01 0.00 -0.85 0.00 0.00 60.65 59.86 3h3t h LYS 370 Cb 0.62 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.12 3h3t h LYS 370 CO 0.04 0.29 0.28 0.28 -3.45 0.00 0.00 179.45 176.89 3h3t h VAL 371 N 0.46 1.09 -0.72 2.00 2.07 -0.73 -1.45 116.25 118.97 3h3t h VAL 371 Ca 0.19 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.47 3h3t h VAL 371 Cb 0.08 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 3h3t h VAL 371 CO -0.12 0.10 0.27 -0.33 0.02 0.00 0.00 177.57 177.51 3h3t h GLU 372 N 0.57 1.07 -0.52 1.57 4.39 -1.14 -1.41 114.58 119.10 3h3t h GLU 372 Ca 0.17 -0.19 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 3h3t h GLU 372 Cb -0.04 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.41 3h3t h GLU 372 CO -0.05 0.88 0.20 1.49 -1.16 0.00 0.00 179.01 180.37 3h3t h GLU 373 N 1.04 0.79 -0.15 2.33 4.81 -0.92 0.79 114.58 123.27 3h3t h GLU 373 Ca 0.24 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 3h3t h GLU 373 Cb 0.22 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.47 3h3t h GLU 373 CO -0.02 0.70 -0.05 0.52 -0.73 0.00 0.00 179.01 179.44 3h3t h MET 374 N 0.71 0.29 -0.76 1.92 2.86 -1.16 -0.87 114.93 117.93 3h3t h MET 374 Ca 0.17 -0.12 0.06 0.00 -2.06 0.00 0.00 59.70 57.75 3h3t h MET 374 Cb 0.21 -0.01 -0.06 0.00 0.06 0.00 0.00 31.60 31.80 3h3t h MET 374 CO -0.01 0.59 0.45 0.28 1.06 0.00 0.00 176.91 179.28 3h3t h VAL 375 N -0.02 1.02 -0.22 -2.22 2.07 -1.17 0.49 116.25 116.19 3h3t h VAL 375 Ca 0.04 -0.29 -0.10 0.00 0.82 0.00 0.00 66.70 67.17 3h3t h VAL 375 Cb 0.48 0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 3h3t h VAL 375 CO 0.02 0.15 -0.24 -0.61 0.02 0.00 0.00 177.57 176.90 3h3t h GLN 376 N 0.84 0.56 -0.80 1.57 5.75 -0.80 -1.34 115.11 120.89 3h3t h GLN 376 Ca 0.33 -0.30 -0.02 0.00 -0.15 0.00 0.00 58.65 58.50 3h3t h GLN 376 Cb 0.16 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 28.69 3h3t h GLN 376 CO -0.17 0.90 0.41 -0.91 -2.65 0.00 0.00 178.83 176.41 3h3t h ASN 377 N 0.25 1.02 -0.56 -0.69 2.35 -0.83 0.75 115.58 117.88 3h3t h ASN 377 Ca 0.03 -0.12 -0.08 0.00 -0.55 0.00 0.00 56.30 55.59 3h3t h ASN 377 Cb 0.80 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.89 3h3t h ASN 377 CO 0.06 0.85 0.06 0.45 -1.65 0.00 0.00 177.43 177.20 3h3t h HIS 378 N 1.12 1.02 -0.34 1.19 3.86 -0.86 0.96 115.15 122.11 3h3t h HIS 378 Ca 0.28 -0.16 -0.06 0.00 -1.16 0.00 0.00 60.37 59.27 3h3t h HIS 378 Cb 0.07 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.25 3h3t h HIS 378 CO 0.01 0.91 -0.06 0.52 0.86 0.00 0.00 177.93 180.17 3h3t h MET 379 N 0.84 0.55 0.03 2.45 2.86 -0.50 0.49 114.93 121.65 3h3t h MET 379 Ca 0.17 -0.14 -0.09 0.00 -2.06 0.00 0.00 59.70 57.58 3h3t h MET 379 Cb 0.46 -0.07 0.01 0.00 0.06 0.00 0.00 31.60 32.06 3h3t h MET 379 CO 0.02 0.62 -0.36 1.15 1.06 0.00 0.00 176.91 179.40 3h3t h THR 380 N 0.51 1.57 0.00 2.22 2.02 -0.68 -3.41 112.91 115.15 3h3t h THR 380 Ca 0.10 -2.14 -0.37 0.00 0.77 0.00 0.00 66.41 64.78 3h3t h THR 380 Cb 0.42 2.93 -0.07 0.00 -1.74 0.00 0.00 68.15 69.69 3h3t h THR 380 CO 0.02 0.59 -2.36 -1.22 0.37 0.00 0.00 175.52 172.92 3h3t n TYR 381 N -4.42 0.10 0.65 3.16 4.02 0.32 -4.59 117.16 116.40 3h3t n TYR 381 Ca -0.11 0.03 0.13 0.00 -0.01 0.00 0.00 57.90 57.95 3h3t n TYR 381 Cb 0.58 -1.02 0.43 0.00 -0.02 0.00 0.00 39.34 39.31 3h3t n TYR 381 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3h3t n SER 382 N -2.91 0.73 -0.74 7.72 7.64 0.17 -2.67 113.62 123.55 3h3t n SER 382 Ca -0.35 0.57 0.12 0.00 1.01 0.00 0.00 58.87 60.22 3h3t n SER 382 Cb 1.11 -0.77 0.33 0.00 -1.01 0.00 0.00 64.21 63.87 3h3t n SER 382 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3h3t n LEU 383 N -2.19 2.24 -4.80 -3.43 4.77 -1.24 -4.90 117.00 107.45 3h3t n LEU 383 Ca 0.05 -0.89 -0.37 0.00 -0.03 0.00 0.00 56.01 54.77 3h3t n LEU 383 Cb 0.41 -0.11 -0.06 0.00 -2.33 0.00 0.00 43.42 41.33 3h3t n LEU 383 CO 0.29 0.45 0.53 -1.10 -1.33 0.00 0.00 177.39 176.23 3h3t s GLN 384 N -1.78 4.43 0.23 3.23 -0.21 -1.09 -5.00 119.66 119.47 3h3t s GLN 384 Ca 0.34 1.10 -0.30 0.00 0.02 0.00 0.00 55.36 56.53 3h3t s GLN 384 Cb 0.20 -2.88 -0.09 0.00 1.00 0.00 0.00 33.01 31.24 3h3t s GLN 384 CO 0.29 0.36 1.19 0.34 -2.12 0.00 0.00 175.29 175.35 3h3t s ASP 385 N -1.59 7.09 0.00 5.90 -1.08 -1.26 -4.92 116.67 120.81 3h3t s ASP 385 Ca 0.46 2.30 0.04 0.00 -0.52 0.00 0.00 52.55 54.83 3h3t s ASP 385 Cb -0.18 -2.62 0.03 0.00 -1.46 0.00 0.00 42.92 38.69 3h3t s ASP 385 CO 0.23 -0.33 0.62 1.33 0.52 0.00 0.00 175.17 177.53 3h3t n VAL 386 N 1.97 0.00 -0.29 1.11 0.24 -1.26 -4.43 118.33 115.67 3h3t n VAL 386 Ca 0.02 -0.50 -0.04 0.00 -2.04 0.00 0.00 64.34 61.79 3h3t n VAL 386 Cb 0.44 1.08 0.07 0.00 -1.47 0.00 0.00 33.84 33.97 3h3t n VAL 386 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3h3t h GLY 387 N 0.82 1.11 -1.53 7.63 0.00 -1.97 -2.68 103.07 106.44 3h3t h GLY 387 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 46.92 3h3t h GLY 387 CO 0.00 0.40 0.00 0.61 0.00 0.00 0.00 176.54 177.55 3h3t n GLY 388 N -1.32 2.64 3.59 4.60 0.00 -1.26 -4.90 105.19 108.55 3h3t n GLY 388 Ca 0.08 -0.45 -0.43 0.00 0.00 0.00 0.00 46.02 45.22 3h3t n GLY 388 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3h3t s ASP 389 N -1.00 6.64 0.00 1.61 -1.08 -1.01 -4.90 116.67 116.92 3h3t s ASP 389 Ca 0.28 0.46 0.19 0.00 -0.52 0.00 0.00 52.55 52.96 3h3t s ASP 389 Cb 0.14 -2.49 1.15 0.00 -1.46 0.00 0.00 42.92 40.27 3h3t s ASP 389 CO 0.19 -1.01 1.63 0.00 0.52 0.00 0.00 175.17 176.50 3h3t n ALA 390 N 7.14 2.43 0.87 3.66 0.00 -1.26 -2.02 120.51 131.32 3h3t n ALA 390 Ca 0.08 -0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.52 3h3t n ALA 390 Cb 0.48 -1.31 0.13 0.00 0.00 0.00 0.00 19.45 18.75 3h3t n ALA 390 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3h3t n ASN 391 N -0.87 0.63 -4.90 0.00 5.03 -1.26 -4.88 115.26 109.00 3h3t n ASN 391 Ca 0.15 -0.34 -0.23 0.00 0.87 0.00 0.00 54.58 55.03 3h3t n ASN 391 Cb 0.07 0.49 -0.03 0.00 -1.02 0.00 0.00 39.78 39.28 3h3t n ASN 391 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 3h3t s TRP 392 N -3.06 3.32 -0.05 3.10 0.52 -0.86 -4.54 118.94 117.37 3h3t s TRP 392 Ca 0.08 -0.02 0.02 0.00 0.02 0.00 0.00 56.10 56.20 3h3t s TRP 392 Cb 0.16 -1.53 0.02 0.00 -1.15 0.00 0.00 33.47 30.96 3h3t s TRP 392 CO 0.75 0.49 -0.08 -1.14 0.02 0.00 0.00 176.95 176.99 3h3t s GLN 393 N -3.67 1.21 -0.50 4.98 0.74 -0.25 -4.90 119.66 117.27 3h3t s GLN 393 Ca 0.33 -0.26 -0.28 0.00 0.05 0.00 0.00 55.36 55.20 3h3t s GLN 393 Cb -0.09 -1.08 0.02 0.00 1.10 0.00 0.00 33.01 32.95 3h3t s GLN 393 CO 0.27 -0.01 1.34 -1.17 -0.55 0.00 0.00 175.29 175.16 3h3t s LEU 394 N 0.71 3.51 -0.12 3.68 2.96 -1.26 -1.25 118.68 126.91 3h3t s LEU 394 Ca -0.12 0.48 0.19 0.00 -0.22 0.00 0.00 54.13 54.46 3h3t s LEU 394 Cb -0.14 -3.33 -0.28 0.00 0.50 0.00 0.00 46.19 42.94 3h3t s LEU 394 CO 0.02 -1.51 0.28 1.33 -1.32 0.00 0.00 176.35 175.15 3h3t n VAL 395 N 6.92 0.84 -3.75 1.68 0.24 -0.26 -4.96 118.33 119.04 3h3t n VAL 395 Ca 0.13 -0.71 -0.13 0.00 -2.04 0.00 0.00 64.34 61.59 3h3t n VAL 395 Cb 0.49 -0.30 -0.14 0.00 -1.47 0.00 0.00 33.84 32.42 3h3t n VAL 395 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3h3t s VAL 396 N -2.91 -0.04 0.01 3.34 1.01 -1.17 -5.04 120.40 115.60 3h3t s VAL 396 Ca -0.09 0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.05 3h3t s VAL 396 Cb 0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 36.38 36.19 3h3t s VAL 396 CO 0.86 0.06 -0.03 -0.70 0.00 0.00 0.00 175.10 175.29 3h3t s GLU 397 N 1.06 0.27 -0.30 2.72 2.12 -1.26 -0.73 118.70 122.57 3h3t s GLU 397 Ca -0.08 -0.30 -0.04 0.00 0.36 0.00 0.00 54.97 54.90 3h3t s GLU 397 Cb -0.10 -0.14 0.19 0.00 0.26 0.00 0.00 34.13 34.34 3h3t s GLU 397 CO -0.06 0.03 0.79 -1.21 -0.54 0.00 0.00 175.26 174.27 3h3t s GLU 398 N -0.59 0.40 7.44 4.30 0.41 -1.03 -5.05 118.70 124.57 3h3t s GLU 398 Ca -0.04 0.61 0.00 0.00 -0.41 0.00 0.00 54.97 55.13 3h3t s GLU 398 Cb -0.04 0.33 0.00 0.00 -1.78 0.00 0.00 34.13 32.63 3h3t s GLU 398 CO -0.00 -0.54 0.00 0.41 -0.49 0.00 0.00 175.26 174.64 3h3t n GLY 399 N 5.40 3.35 0.00 -1.39 0.00 -1.26 -1.70 105.19 109.59 3h3t n GLY 399 Ca -0.00 -0.19 0.15 0.00 0.00 0.00 0.00 46.02 45.98 3h3t n GLY 399 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h3t n GLU 400 N 13.92 0.55 -3.35 1.61 -0.58 -1.26 -4.87 120.64 126.66 3h3t n GLU 400 Ca 0.00 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.36 3h3t n GLU 400 Cb 0.00 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.31 3h3t n GLU 400 CO 0.00 0.00 0.00 1.41 -0.48 0.00 0.00 177.13 178.06 3h3t s MET 401 N -2.45 4.28 -0.10 3.49 1.75 -0.69 -3.99 119.30 121.59 3h3t s MET 401 Ca 0.33 0.35 0.02 0.00 -1.25 0.00 0.00 55.69 55.13 3h3t s MET 401 Cb 0.21 -3.47 0.01 0.00 2.84 0.00 0.00 34.83 34.42 3h3t s MET 401 CO 0.44 0.09 -0.14 0.15 -0.65 0.00 0.00 175.02 174.91 3h3t s LYS 402 N 0.85 2.07 -0.12 4.11 1.02 -0.27 -2.48 119.74 124.93 3h3t s LYS 402 Ca 0.23 -0.51 0.01 0.00 0.02 0.00 0.00 55.97 55.72 3h3t s LYS 402 Cb -0.15 -1.77 -0.01 0.00 -0.52 0.00 0.00 37.83 35.39 3h3t s LYS 402 CO 0.09 -0.05 -0.16 0.08 -0.92 0.00 0.00 175.35 174.39 3h3t s VAL 403 N 0.95 2.79 0.12 3.17 1.01 0.09 -1.09 120.40 127.44 3h3t s VAL 403 Ca -0.08 -0.76 0.06 0.00 0.00 0.00 0.00 61.98 61.21 3h3t s VAL 403 Cb -0.15 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 3h3t s VAL 403 CO -0.01 0.53 -0.15 -0.31 0.00 0.00 0.00 175.10 175.17 3h3t s TYR 404 N 0.35 1.49 0.11 5.22 2.02 0.21 -1.10 117.35 125.64 3h3t s TYR 404 Ca -0.13 -0.52 -0.03 0.00 -0.37 0.00 0.00 57.07 56.02 3h3t s TYR 404 Cb -0.16 -0.78 -0.03 0.00 -0.40 0.00 0.00 41.96 40.59 3h3t s TYR 404 CO 0.07 0.17 0.08 -0.98 -1.57 0.00 0.00 175.55 173.32 3h3t s ARG 405 N -2.56 0.87 -0.09 -0.62 1.70 -0.38 -0.89 118.95 116.98 3h3t s ARG 405 Ca 0.09 -1.30 0.02 0.00 -0.47 0.00 0.00 55.73 54.07 3h3t s ARG 405 Cb -0.06 0.26 0.01 0.00 -0.57 0.00 0.00 34.95 34.60 3h3t s ARG 405 CO 0.04 -0.25 -0.14 0.50 -1.08 0.00 0.00 175.30 174.37 3h3t s ARG 406 N -3.99 2.02 -0.37 3.89 3.52 -0.20 -1.09 118.95 122.74 3h3t s ARG 406 Ca 0.17 -0.50 -0.28 0.00 -0.13 0.00 0.00 55.73 54.99 3h3t s ARG 406 Cb 0.07 -1.69 0.02 0.00 -1.56 0.00 0.00 34.95 31.78 3h3t s ARG 406 CO -0.03 -0.02 1.05 -1.21 -0.81 0.00 0.00 175.30 174.29 3h3t s GLU 407 N 0.84 3.92 -0.02 5.12 2.02 -1.26 -3.10 118.70 126.23 3h3t s GLU 407 Ca -0.10 0.81 0.00 0.00 0.02 0.00 0.00 54.97 55.70 3h3t s GLU 407 Cb -0.15 -3.80 0.02 0.00 0.10 0.00 0.00 34.13 30.30 3h3t s GLU 407 CO 0.01 -1.03 0.01 0.08 0.02 0.00 0.00 175.26 174.35 3h3t s VAL 408 N 3.80 0.03 0.02 2.63 1.01 -1.26 -4.97 120.40 121.64 3h3t s VAL 408 Ca 0.44 0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.58 3h3t s VAL 408 Cb -0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 36.38 36.14 3h3t s VAL 408 CO 0.20 0.08 -0.12 -1.61 0.00 0.00 0.00 175.10 173.66 3h3t s GLU 409 N 0.77 0.86 -0.15 2.72 2.02 -1.26 -0.59 118.70 123.07 3h3t s GLU 409 Ca -0.07 -0.56 -0.04 0.00 0.02 0.00 0.00 54.97 54.32 3h3t s GLU 409 Cb -0.10 -0.83 0.05 0.00 0.10 0.00 0.00 34.13 33.36 3h3t s GLU 409 CO -0.02 0.21 0.07 -1.21 0.02 0.00 0.00 175.26 174.33 3h3t s GLU 410 N -0.72 0.20 -1.14 1.61 2.02 -0.51 -4.78 118.70 115.38 3h3t s GLU 410 Ca 0.02 -0.07 -0.05 0.00 0.02 0.00 0.00 54.97 54.89 3h3t s GLU 410 Cb -0.06 -1.63 0.01 0.00 0.10 0.00 0.00 34.13 32.55 3h3t s GLU 410 CO 0.00 -0.59 0.68 0.09 0.02 0.00 0.00 175.26 175.47 3h3t n ASN 411 N 5.23 -5.26 0.00 -0.19 5.03 -1.26 -2.45 115.26 116.35 3h3t n ASN 411 Ca -0.07 -0.31 0.00 0.00 0.87 0.00 0.00 54.58 55.07 3h3t n ASN 411 Cb 0.49 -3.99 0.00 0.00 -1.02 0.00 0.00 39.78 35.26 3h3t n ASN 411 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h3t n GLY 412 N -1.51 1.14 3.69 7.41 0.00 -1.26 -5.04 105.19 109.62 3h3t n GLY 412 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 3h3t n GLY 412 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3t s ILE 413 N -3.88 5.37 -0.24 -0.61 -1.09 -1.03 -5.04 121.20 114.68 3h3t s ILE 413 Ca 0.00 0.21 -0.29 0.00 -2.23 0.00 0.00 60.65 58.34 3h3t s ILE 413 Cb 0.00 -3.50 -0.02 0.00 -1.58 0.00 0.00 42.46 37.36 3h3t s ILE 413 CO 0.00 0.37 1.57 -0.69 -1.23 0.00 0.00 174.94 174.96 3h3t s VAL 414 N 0.82 3.76 -0.63 2.92 1.01 -1.26 -1.43 120.40 125.59 3h3t s VAL 414 Ca 0.08 0.86 0.05 0.00 0.00 0.00 0.00 61.98 62.97 3h3t s VAL 414 Cb -0.13 -3.78 0.06 0.00 0.00 0.00 0.00 36.38 32.53 3h3t s VAL 414 CO 0.02 -0.33 0.73 0.18 0.00 0.00 0.00 175.10 175.71 3h3t n LEU 415 N 8.35 1.59 0.00 3.92 4.77 0.24 -4.67 117.00 131.19 3h3t n LEU 415 Ca 0.18 -1.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.02 3h3t n LEU 415 Cb 0.45 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 3h3t n LEU 415 CO 0.65 0.35 0.00 0.47 -1.33 0.00 0.00 177.39 177.52 3h3t n ASP 416 N 0.25 0.00 -4.67 -1.43 8.00 -1.20 -4.38 116.55 113.13 3h3t n ASP 416 Ca 0.03 0.00 -0.44 0.00 0.71 0.00 0.00 54.79 55.10 3h3t n ASP 416 Cb 0.16 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.25 3h3t n ASP 416 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3h3t n PRO 417 N 0.00 1.93 -4.93 -0.24 -0.02 -1.18 -4.71 135.00 125.85 3h3t n PRO 417 Ca 0.00 0.68 -0.26 0.00 -2.02 0.00 0.00 63.50 61.90 3h3t n PRO 417 Cb 0.00 -2.25 -0.16 0.00 -0.02 0.00 0.00 33.50 31.07 3h3t n PRO 417 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3h3t s LEU 418 N -0.34 2.02 -0.01 2.45 0.20 -0.01 -1.03 118.68 121.96 3h3t s LEU 418 Ca 0.61 -0.35 0.01 0.00 0.69 0.00 0.00 54.13 55.08 3h3t s LEU 418 Cb -0.63 -1.00 0.01 0.00 -0.43 0.00 0.00 46.19 44.14 3h3t s LEU 418 CO 0.57 0.22 -0.01 -0.75 -0.29 0.00 0.00 176.35 176.09 3h3t s LYS 419 N -0.36 0.23 0.13 1.98 2.20 -0.07 -0.85 119.74 123.00 3h3t s LYS 419 Ca 0.05 -0.01 0.09 0.00 -0.36 0.00 0.00 55.97 55.74 3h3t s LYS 419 Cb -0.08 -0.31 -0.04 0.00 -1.51 0.00 0.00 37.83 35.88 3h3t s LYS 419 CO -0.00 -0.03 -0.21 0.00 -0.36 0.00 0.00 175.35 174.74 3h3t s ALA 420 N 0.44 2.03 0.06 3.13 0.00 0.16 0.64 121.76 128.22 3h3t s ALA 420 Ca -0.04 -1.39 0.06 0.00 0.00 0.00 0.00 51.96 50.59 3h3t s ALA 420 Cb -0.07 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.77 3h3t s ALA 420 CO -0.01 0.36 -0.17 0.95 0.00 0.00 0.00 175.76 176.89 3h3t s THR 421 N -1.44 1.38 0.07 0.00 -4.23 -0.25 -1.38 115.64 109.80 3h3t s THR 421 Ca 0.12 -1.25 -0.14 0.00 -1.18 0.00 0.00 61.69 59.23 3h3t s THR 421 Cb -0.09 -1.26 0.02 0.00 1.34 0.00 0.00 72.50 72.52 3h3t s THR 421 CO 0.06 -0.02 0.34 -2.28 -0.54 0.00 0.00 174.62 172.17 3h3t s HIS 422 N -1.02 -0.13 -0.11 3.99 2.46 -0.26 -1.11 115.29 119.12 3h3t s HIS 422 Ca 0.03 -0.08 -0.01 0.00 0.47 0.00 0.00 55.06 55.46 3h3t s HIS 422 Cb -0.09 0.14 0.04 0.00 -0.13 0.00 0.00 32.58 32.54 3h3t s HIS 422 CO 0.02 -0.58 -0.01 0.00 -2.47 0.00 0.00 174.74 171.70 3h3t s ALA 423 N -3.08 0.96 -0.21 1.58 0.00 -1.26 -0.06 121.76 119.69 3h3t s ALA 423 Ca -0.01 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 51.57 3h3t s ALA 423 Cb 0.01 -0.91 0.04 0.00 0.00 0.00 0.00 23.12 22.26 3h3t s ALA 423 CO -0.07 -0.63 -0.16 0.08 0.00 0.00 0.00 175.76 174.98 3h3t s VAL 424 N 1.86 2.11 0.34 0.00 1.01 0.81 -4.86 120.40 121.68 3h3t s VAL 424 Ca 0.03 -1.22 -0.28 0.00 0.00 0.00 0.00 61.98 60.52 3h3t s VAL 424 Cb -0.14 -2.03 -0.09 0.00 0.00 0.00 0.00 36.38 34.12 3h3t s VAL 424 CO -0.07 0.31 1.17 -0.54 0.00 0.00 0.00 175.10 175.97 3h3t s LYS 425 N 1.21 4.36 0.00 2.72 1.02 -1.26 -1.23 119.74 126.56 3h3t s LYS 425 Ca -0.01 1.90 0.00 0.00 0.02 0.00 0.00 55.97 57.88 3h3t s LYS 425 Cb -0.16 -2.97 0.00 0.00 -0.52 0.00 0.00 37.83 34.19 3h3t s LYS 425 CO -0.10 -0.07 0.00 0.41 -0.92 0.00 0.00 175.35 174.67 3h3t n GLY 426 N 0.87 0.62 3.18 -3.33 0.00 -0.50 -4.93 105.19 101.10 3h3t n GLY 426 Ca 0.01 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 3h3t n GLY 426 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h3t s VAL 427 N -2.00 0.36 0.36 1.61 -7.23 -1.26 -4.86 120.40 107.38 3h3t s VAL 427 Ca 0.00 -1.92 0.08 0.00 -1.81 0.00 0.00 61.98 58.32 3h3t s VAL 427 Cb 0.00 -1.98 -0.03 0.00 0.56 0.00 0.00 36.38 34.92 3h3t s VAL 427 CO 0.00 -0.56 0.24 0.42 -0.31 0.00 0.00 175.10 174.89 3h3t s THR 428 N -3.87 3.12 0.35 5.32 -4.23 -1.26 -3.41 115.64 111.67 3h3t s THR 428 Ca 0.21 -1.51 0.07 0.00 -1.18 0.00 0.00 61.69 59.28 3h3t s THR 428 Cb 0.07 -3.06 0.14 0.00 1.34 0.00 0.00 72.50 70.98 3h3t s THR 428 CO 0.01 -0.14 1.87 1.23 -0.54 0.00 0.00 174.62 177.04 3h3t h GLY 429 N 1.34 0.36 1.01 3.99 0.00 -1.86 -2.26 103.07 105.64 3h3t h GLY 429 Ca -0.44 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 46.64 3h3t h GLY 429 CO 0.61 0.22 0.39 0.84 0.00 0.00 0.00 176.54 178.59 3h3t h HIS 430 N 0.31 1.00 -0.29 5.60 -0.00 -1.88 -0.91 115.15 118.98 3h3t h HIS 430 Ca 0.06 -0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 60.37 3h3t h HIS 430 Cb 0.43 -0.32 -0.01 0.00 -0.00 0.00 0.00 27.41 27.51 3h3t h HIS 430 CO 0.01 0.72 0.05 0.93 -0.00 0.00 0.00 177.93 179.64 3h3t h GLU 431 N 1.00 0.47 -0.46 5.26 5.08 -1.59 -0.31 114.58 124.02 3h3t h GLU 431 Ca 0.25 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.44 3h3t h GLU 431 Cb 0.05 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 3h3t h GLU 431 CO -0.04 0.57 0.07 0.28 -1.00 0.00 0.00 179.01 178.89 3h3t h VAL 432 N 0.29 1.25 -0.47 3.13 2.07 -1.34 -1.94 116.25 119.24 3h3t h VAL 432 Ca 0.09 -0.91 -0.09 0.00 0.82 0.00 0.00 66.70 66.61 3h3t h VAL 432 Cb 0.32 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3h3t h VAL 432 CO 0.00 0.32 -0.07 0.00 0.02 0.00 0.00 177.57 177.84 3h3t h ASN 434 N 0.75 -1.04 -0.49 0.00 -0.26 -0.84 -0.41 115.58 113.29 3h3t h ASN 434 Ca 0.13 0.12 -0.05 0.00 -0.56 0.00 0.00 56.30 55.94 3h3t h ASN 434 Cb 0.55 0.40 -0.03 0.00 -1.06 0.00 0.00 38.32 38.18 3h3t h ASN 434 CO 0.03 -0.43 0.13 1.88 -1.06 0.00 0.00 177.43 177.98 3h3t h TYR 435 N -0.57 0.87 -0.52 1.19 -1.99 -1.31 0.32 116.97 114.95 3h3t h TYR 435 Ca 0.03 -0.08 -0.08 0.00 2.00 0.00 0.00 58.73 60.60 3h3t h TYR 435 Cb 0.61 -0.25 -0.02 0.00 2.00 0.00 0.00 36.73 39.07 3h3t h TYR 435 CO -0.32 0.73 0.00 0.35 -0.00 0.00 0.00 178.16 178.92 3h3t h PHE 436 N 0.81 0.99 0.00 4.88 3.57 -1.13 -3.25 116.94 122.81 3h3t h PHE 436 Ca 0.18 -0.17 -0.16 0.00 3.53 0.00 0.00 57.97 61.35 3h3t h PHE 436 Cb 0.30 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 38.75 3h3t h PHE 436 CO 0.02 0.92 -0.99 2.35 -2.23 0.00 0.00 178.31 178.38 3h3t h TRP 437 N 0.78 0.00 -3.05 0.41 7.01 -0.78 -3.46 115.95 116.87 3h3t h TRP 437 Ca 0.15 0.00 -0.57 0.00 2.11 0.00 0.00 58.89 60.58 3h3t h TRP 437 Cb 0.52 0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 27.54 3h3t h TRP 437 CO 0.04 0.66 1.03 1.21 -2.79 0.00 0.00 178.44 178.59 3h3t s ASN 438 N -6.26 6.54 0.55 2.65 2.47 0.11 -4.89 114.94 116.11 3h3t s ASN 438 Ca 0.01 1.28 0.31 0.00 0.42 0.00 0.00 52.86 54.88 3h3t s ASN 438 Cb 0.08 -2.54 1.57 0.00 -1.45 0.00 0.00 41.25 38.92 3h3t s ASN 438 CO 0.79 -1.18 2.10 -0.37 -3.72 0.00 0.00 177.10 174.72 3h3t h VAL 439 N 6.08 0.38 0.00 -5.21 -1.51 -1.89 -2.98 116.25 111.11 3h3t h VAL 439 Ca -0.28 -0.47 0.00 0.00 -1.23 0.00 0.00 66.70 64.72 3h3t h VAL 439 Cb 1.11 1.33 0.00 0.00 -2.13 0.00 0.00 31.29 31.61 3h3t h VAL 439 CO 1.03 0.08 0.00 0.47 -1.23 0.00 0.00 177.57 177.92 3h3t n ASP 440 N -3.45 0.00 0.00 4.19 8.00 -1.26 -2.55 116.55 121.48 3h3t n ASP 440 Ca -0.01 0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.53 3h3t n ASP 440 Cb 0.23 -0.31 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 3h3t n ASP 440 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3h3t n VAL 441 N -1.31 0.16 -0.27 2.53 0.24 -1.13 -4.79 118.33 113.77 3h3t n VAL 441 Ca 0.09 -0.47 0.06 0.00 -2.04 0.00 0.00 64.34 61.99 3h3t n VAL 441 Cb 0.17 1.10 0.20 0.00 -1.47 0.00 0.00 33.84 33.85 3h3t n VAL 441 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3h3t h ARG 442 N 0.00 0.45 0.00 7.34 9.65 -1.54 -1.41 114.38 128.87 3h3t h ARG 442 Ca 0.00 -0.03 -0.04 0.00 -1.10 0.00 0.00 59.98 58.81 3h3t h ARG 442 Cb 0.22 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.69 3h3t h ARG 442 CO 0.00 0.30 -0.18 -0.91 2.80 0.00 0.00 179.97 181.98 3h3t h ASN 443 N 0.47 0.00 -0.94 -3.80 -0.26 -1.87 0.11 115.58 109.29 3h3t h ASN 443 Ca 0.44 0.00 0.04 0.00 -0.56 0.00 0.00 56.30 56.22 3h3t h ASN 443 Cb 0.68 0.00 -0.06 0.00 -1.06 0.00 0.00 38.32 37.88 3h3t h ASN 443 CO -0.41 0.18 0.62 0.44 -1.06 0.00 0.00 177.43 177.20 3h3t h ASP 444 N 0.00 1.01 0.00 5.81 3.32 -1.60 -3.35 116.42 121.60 3h3t h ASP 444 Ca -0.00 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 3h3t h ASP 444 Cb 0.79 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 3h3t h ASP 444 CO 0.02 0.68 -1.51 -2.67 -1.72 0.00 0.00 179.24 174.04 3h3t n TRP 445 N -4.45 0.00 -2.43 4.55 4.27 -0.94 -4.98 117.44 113.46 3h3t n TRP 445 Ca 0.13 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.31 3h3t n TRP 445 Cb 0.12 -0.35 -0.03 0.00 -1.36 0.00 0.00 31.31 29.69 3h3t n TRP 445 CO 0.00 0.00 0.00 -2.00 -2.29 0.00 0.00 177.69 173.40 3h3t s GLU 446 N -2.26 4.33 -0.03 -2.67 2.56 0.34 -4.78 118.70 116.18 3h3t s GLU 446 Ca -0.04 1.70 0.21 0.00 0.00 0.00 0.00 54.97 56.84 3h3t s GLU 446 Cb 0.03 -3.58 -0.28 0.00 2.00 0.00 0.00 34.13 32.29 3h3t s GLU 446 CO 0.33 -0.49 0.48 0.25 -0.56 0.00 0.00 175.26 175.27 3h3t n THR 447 N 4.71 0.35 1.10 -1.70 -2.24 -1.26 -4.57 114.28 110.67 3h3t n THR 447 Ca 0.11 -0.57 0.11 0.00 -2.27 0.00 0.00 64.05 61.43 3h3t n THR 447 Cb 0.46 -0.14 0.35 0.00 -2.10 0.00 0.00 70.33 68.89 3h3t n THR 447 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3h3t n THR 448 N -2.41 0.23 -3.34 4.28 -2.24 -1.26 -4.90 114.28 104.65 3h3t n THR 448 Ca -0.09 -0.40 -0.39 0.00 -2.27 0.00 0.00 64.05 60.90 3h3t n THR 448 Cb 0.68 0.50 -0.08 0.00 -2.10 0.00 0.00 70.33 69.33 3h3t n THR 448 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3h3t s ILE 449 N -1.77 5.15 -0.13 2.28 -1.09 -1.26 -0.58 121.20 123.80 3h3t s ILE 449 Ca 0.33 0.73 -0.23 0.00 -2.23 0.00 0.00 60.65 59.26 3h3t s ILE 449 Cb 0.18 -3.75 -0.26 0.00 -1.58 0.00 0.00 42.46 37.06 3h3t s ILE 449 CO 0.28 0.18 0.61 -0.08 -1.23 0.00 0.00 174.94 174.69 3h3t h GLU 450 N 7.78 0.11 -2.79 2.79 4.81 -0.73 -3.44 114.58 123.11 3h3t h GLU 450 Ca -0.33 -0.19 0.07 0.00 -0.13 0.00 0.00 59.36 58.79 3h3t h GLU 450 Cb 1.16 0.07 -0.09 0.00 0.63 0.00 0.00 28.75 30.52 3h3t h GLU 450 CO 0.70 1.09 0.30 0.54 -0.73 0.00 0.00 179.01 180.91 3h3t s ASN 451 N -6.70 -0.34 0.12 1.04 4.22 -1.04 -4.99 114.94 107.25 3h3t s ASN 451 Ca -0.21 -0.34 -0.23 0.00 -2.14 0.00 0.00 52.86 49.94 3h3t s ASN 451 Cb 0.02 0.61 0.06 0.00 1.28 0.00 0.00 41.25 43.22 3h3t s ASN 451 CO 0.71 -1.08 0.57 0.72 -2.04 0.00 0.00 177.10 175.98 3h3t s PHE 452 N -3.66 -0.50 0.13 1.54 -0.12 -1.26 -0.13 117.98 113.98 3h3t s PHE 452 Ca 0.08 0.39 -0.17 0.00 -0.05 0.00 0.00 56.93 57.18 3h3t s PHE 452 Cb -0.03 0.48 0.04 0.00 -0.63 0.00 0.00 43.02 42.88 3h3t s PHE 452 CO -0.01 -0.78 0.42 -3.38 -0.05 0.00 0.00 175.22 171.43 3h3t s HIS 453 N -3.29 -0.25 -0.22 3.49 -3.43 -0.05 -4.99 115.29 106.55 3h3t s HIS 453 Ca -0.01 -0.05 -0.25 0.00 -0.80 0.00 0.00 55.06 53.95 3h3t s HIS 453 Cb -0.00 0.29 -0.01 0.00 -1.43 0.00 0.00 32.58 31.43 3h3t s HIS 453 CO -0.09 -0.71 0.86 0.08 -2.00 0.00 0.00 174.74 172.88 3h3t s VAL 454 N -3.74 4.82 0.05 -5.38 1.01 -1.26 -1.21 120.40 114.70 3h3t s VAL 454 Ca 0.02 1.66 -0.15 0.00 0.00 0.00 0.00 61.98 63.51 3h3t s VAL 454 Cb 0.01 -4.15 -0.24 0.00 0.00 0.00 0.00 36.38 32.00 3h3t s VAL 454 CO -0.12 -0.06 1.15 0.58 0.00 0.00 0.00 175.10 176.65 3h3t h VAL 455 N 5.37 1.31 -2.01 2.92 2.07 -0.91 -3.48 116.25 121.53 3h3t h VAL 455 Ca -0.24 -2.24 -0.05 0.00 0.82 0.00 0.00 66.70 64.99 3h3t h VAL 455 Cb 1.10 2.48 -0.20 0.00 -1.52 0.00 0.00 31.29 33.14 3h3t h VAL 455 CO 0.88 0.68 0.16 -0.70 0.02 0.00 0.00 177.57 178.61 3h3t s GLU 456 N -3.24 0.96 -0.24 1.57 2.12 -1.18 -4.99 118.70 113.70 3h3t s GLU 456 Ca -0.11 0.57 -0.08 0.00 0.36 0.00 0.00 54.97 55.71 3h3t s GLU 456 Cb 0.06 0.46 -0.04 0.00 0.26 0.00 0.00 34.13 34.87 3h3t s GLU 456 CO 0.90 -0.23 0.10 0.99 -0.54 0.00 0.00 175.26 176.48 3h3t s THR 457 N -0.52 4.70 -0.13 -1.70 2.01 -1.26 -1.26 115.64 117.48 3h3t s THR 457 Ca -0.06 -0.05 0.18 0.00 0.31 0.00 0.00 61.69 62.07 3h3t s THR 457 Cb -0.02 -3.18 -0.23 0.00 0.01 0.00 0.00 72.50 69.07 3h3t s THR 457 CO 0.06 0.35 0.42 0.18 -0.69 0.00 0.00 174.62 174.95 3h3t n LEU 458 N 4.56 0.32 -3.72 4.42 4.77 -0.28 -5.02 117.00 122.04 3h3t n LEU 458 Ca -0.16 0.14 0.01 0.00 -0.03 0.00 0.00 56.01 55.98 3h3t n LEU 458 Cb 0.52 0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.85 3h3t n LEU 458 CO 0.33 0.28 1.04 0.00 -1.33 0.00 0.00 177.39 177.71 3h3t s ALA 459 N -2.85 -2.23 0.13 -1.18 0.00 -0.97 -4.78 121.76 109.89 3h3t s ALA 459 Ca -0.07 0.46 0.31 0.00 0.00 0.00 0.00 51.96 52.66 3h3t s ALA 459 Cb 0.09 0.51 1.65 0.00 0.00 0.00 0.00 23.12 25.37 3h3t s ALA 459 CO 0.84 -1.08 1.95 -0.44 0.00 0.00 0.00 175.76 177.03 3h3t h ASP 460 N 2.00 0.00 0.00 0.00 5.19 -2.02 -2.99 116.42 118.60 3h3t h ASP 460 Ca -0.28 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.13 3h3t h ASP 460 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 3h3t h ASP 460 CO 0.29 0.00 -0.03 -0.46 -3.12 0.00 0.00 179.24 175.93 3h3t n ASN 461 N -2.59 1.51 -3.61 6.45 6.94 -1.26 -5.04 115.26 117.66 3h3t n ASN 461 Ca -0.02 -1.95 -0.13 0.00 -0.02 0.00 0.00 54.58 52.46 3h3t n ASN 461 Cb 0.06 -0.08 -0.12 0.00 -2.36 0.00 0.00 39.78 37.29 3h3t n ASN 461 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3h3t s ALA 462 N -1.01 -0.66 0.29 -2.53 0.00 -1.13 -0.86 121.76 115.85 3h3t s ALA 462 Ca 0.05 0.94 0.03 0.00 0.00 0.00 0.00 51.96 52.97 3h3t s ALA 462 Cb 0.04 -1.17 -0.06 0.00 0.00 0.00 0.00 23.12 21.94 3h3t s ALA 462 CO 0.00 -0.79 0.07 0.96 0.00 0.00 0.00 175.76 176.00 3h3t s ILE 463 N 2.45 0.93 -0.18 0.00 -4.36 -0.39 -1.13 121.20 118.53 3h3t s ILE 463 Ca 0.03 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.41 3h3t s ILE 463 Cb -0.13 -2.69 0.00 0.00 1.25 0.00 0.00 42.46 40.89 3h3t s ILE 463 CO -0.10 -0.03 -0.13 -0.63 0.24 0.00 0.00 174.94 174.29 3h3t s ILE 464 N -3.49 2.75 0.01 8.37 1.01 -0.39 -0.07 121.20 129.40 3h3t s ILE 464 Ca 0.36 -0.73 0.02 0.00 0.00 0.00 0.00 60.65 60.31 3h3t s ILE 464 Cb 0.08 -2.19 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 3h3t s ILE 464 CO 0.14 0.50 -0.01 -0.63 0.00 0.00 0.00 174.94 174.93 3h3t s ILE 465 N 1.06 4.03 -0.10 2.92 1.01 0.82 -0.20 121.20 130.75 3h3t s ILE 465 Ca -0.01 -0.67 0.03 0.00 0.00 0.00 0.00 60.65 60.00 3h3t s ILE 465 Cb -0.15 -2.80 -0.01 0.00 0.01 0.00 0.00 42.46 39.51 3h3t s ILE 465 CO -0.03 0.36 -0.18 -0.47 0.00 0.00 0.00 174.94 174.61 3h3t s TYR 466 N -1.09 2.66 0.05 3.97 5.04 -0.35 -1.36 117.35 126.28 3h3t s TYR 466 Ca 0.20 -0.69 -0.06 0.00 -2.44 0.00 0.00 57.07 54.07 3h3t s TYR 466 Cb -0.11 -1.73 -0.01 0.00 0.35 0.00 0.00 41.96 40.45 3h3t s TYR 466 CO 0.10 -0.21 0.12 1.14 -1.34 0.00 0.00 175.55 175.36 3h3t s GLN 467 N 0.09 0.66 -0.01 4.97 -2.07 -0.56 -0.87 119.66 121.88 3h3t s GLN 467 Ca -0.08 -0.83 0.06 0.00 -1.82 0.00 0.00 55.36 52.68 3h3t s GLN 467 Cb -0.15 0.26 -0.03 0.00 -1.09 0.00 0.00 33.01 32.00 3h3t s GLN 467 CO 0.05 -0.18 -0.17 0.95 -1.32 0.00 0.00 175.29 174.63 3h3t s THR 468 N -3.02 2.85 0.05 3.63 -4.23 0.82 -1.22 115.64 114.51 3h3t s THR 468 Ca -0.01 -0.97 0.00 0.00 -1.18 0.00 0.00 61.69 59.53 3h3t s THR 468 Cb 0.01 -2.14 -0.04 0.00 1.34 0.00 0.00 72.50 71.67 3h3t s THR 468 CO -0.06 0.48 0.16 -1.00 -0.54 0.00 0.00 174.62 173.65 3h3t s HIS 469 N -0.81 3.41 0.78 3.99 3.76 -0.58 -0.05 115.29 125.79 3h3t s HIS 469 Ca 0.13 0.21 -0.14 0.00 -0.15 0.00 0.00 55.06 55.11 3h3t s HIS 469 Cb -0.10 -1.73 0.05 0.00 1.11 0.00 0.00 32.58 31.91 3h3t s HIS 469 CO 0.03 0.58 1.06 1.63 -0.85 0.00 0.00 174.74 177.18 3h3t n LYS 470 N 0.49 0.29 -2.14 1.40 5.02 0.25 -4.36 118.16 119.11 3h3t n LYS 470 Ca -0.07 0.17 -0.42 0.00 -2.02 0.00 0.00 58.31 55.96 3h3t n LYS 470 Cb 0.51 -2.31 -0.03 0.00 -0.02 0.00 0.00 35.03 33.18 3h3t n LYS 470 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3h3t s ARG 471 N -3.76 4.22 0.00 1.97 0.52 -1.26 -4.74 118.95 115.90 3h3t s ARG 471 Ca 0.72 2.03 0.10 0.00 -0.52 0.00 0.00 55.73 58.07 3h3t s ARG 471 Cb -0.31 -3.80 0.02 0.00 0.52 0.00 0.00 34.95 31.38 3h3t s ARG 471 CO 0.52 -0.74 0.68 1.33 0.02 0.00 0.00 175.30 177.11 3h3t n VAL 472 N 5.18 0.00 -4.07 3.52 0.24 -1.26 -4.93 118.33 117.00 3h3t n VAL 472 Ca 0.15 -0.43 -0.09 0.00 -2.04 0.00 0.00 64.34 61.93 3h3t n VAL 472 Cb 0.43 1.14 -0.09 0.00 -1.47 0.00 0.00 33.84 33.85 3h3t n VAL 472 CO 0.00 0.00 0.00 -1.66 -2.14 0.00 0.00 176.83 173.03 3h3t s TRP 473 N -1.20 0.65 -0.75 6.34 -2.14 -1.26 -4.93 118.94 115.65 3h3t s TRP 473 Ca 0.09 -1.05 -0.26 0.00 2.66 0.00 0.00 56.10 57.54 3h3t s TRP 473 Cb 0.08 -0.33 0.00 0.00 -3.10 0.00 0.00 33.47 30.12 3h3t s TRP 473 CO 0.21 -0.55 1.60 -2.14 -2.66 0.00 0.00 176.95 173.41 3h3t s PRO 474 N -4.00 2.95 0.05 3.25 0.02 -1.26 -4.80 135.00 131.22 3h3t s PRO 474 Ca 0.19 -0.04 -0.25 0.00 0.02 0.00 0.00 61.00 60.92 3h3t s PRO 474 Cb 0.06 -4.51 0.08 0.00 0.02 0.00 0.00 34.50 30.16 3h3t s PRO 474 CO -0.01 -2.52 1.14 0.00 -0.33 0.00 0.00 177.00 175.28 3h3t n ALA 475 N 11.12 -3.15 -1.49 -1.55 0.00 -1.26 -5.14 120.51 119.04 3h3t n ALA 475 Ca 0.18 -0.84 -0.35 0.00 0.00 0.00 0.00 53.44 52.42 3h3t n ALA 475 Cb 0.50 0.28 0.09 0.00 0.00 0.00 0.00 19.45 20.32 3h3t n ALA 475 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3h3t s SER 476 N -3.58 4.29 0.64 0.00 0.15 -1.26 -4.89 113.70 109.04 3h3t s SER 476 Ca 0.26 2.49 -0.15 0.00 0.70 0.00 0.00 55.95 59.25 3h3t s SER 476 Cb -0.01 -2.60 -0.01 0.00 -1.71 0.00 0.00 66.02 61.68 3h3t s SER 476 CO 0.01 -2.21 1.09 -1.10 1.20 0.00 0.00 173.24 172.23 3h3t s GLN 477 N -3.68 3.00 -0.16 5.44 -0.21 -1.26 -4.77 119.66 118.02 3h3t s GLN 477 Ca 0.78 1.30 -0.08 0.00 0.02 0.00 0.00 55.36 57.38 3h3t s GLN 477 Cb -0.33 -1.98 -0.04 0.00 1.00 0.00 0.00 33.01 31.65 3h3t s GLN 477 CO 0.43 -1.08 0.11 1.03 -2.12 0.00 0.00 175.29 173.66 3h3t s ARG 478 N -4.14 3.80 0.43 2.91 3.00 -1.26 -0.54 118.95 123.15 3h3t s ARG 478 Ca 0.65 -0.24 0.08 0.00 0.00 0.00 0.00 55.73 56.22 3h3t s ARG 478 Cb -0.18 -3.24 -0.01 0.00 0.00 0.00 0.00 34.95 31.51 3h3t s ARG 478 CO 0.40 0.48 0.41 0.16 0.00 0.00 0.00 175.30 176.76 3h3t s ASP 479 N -0.20 5.10 -0.08 0.23 1.47 0.66 -1.53 116.67 122.32 3h3t s ASP 479 Ca 0.10 -0.73 -0.13 0.00 1.18 0.00 0.00 52.55 52.96 3h3t s ASP 479 Cb -0.12 -0.52 0.03 0.00 -0.34 0.00 0.00 42.92 41.97 3h3t s ASP 479 CO 0.01 -0.70 0.34 0.54 0.68 0.00 0.00 175.17 176.04 3h3t s VAL 480 N -2.48 0.02 -0.19 2.11 0.11 -0.36 -1.23 120.40 118.38 3h3t s VAL 480 Ca 0.49 -0.19 -0.03 0.00 -2.93 0.00 0.00 61.98 59.32 3h3t s VAL 480 Cb -0.04 -0.54 0.06 0.00 -1.53 0.00 0.00 36.38 34.33 3h3t s VAL 480 CO 0.28 -0.10 0.03 -0.22 -3.33 0.00 0.00 175.10 171.77 3h3t s LEU 481 N -0.42 1.16 -0.00 2.54 2.96 -1.26 -1.49 118.68 122.16 3h3t s LEU 481 Ca -0.05 -0.79 -0.03 0.00 -0.22 0.00 0.00 54.13 53.04 3h3t s LEU 481 Cb -0.04 -0.59 -0.00 0.00 0.50 0.00 0.00 46.19 46.06 3h3t s LEU 481 CO 0.02 -0.30 0.05 -0.72 -1.32 0.00 0.00 176.35 174.08 3h3t s TYR 482 N 1.86 0.08 -0.08 5.38 -0.85 -0.46 -1.60 117.35 121.67 3h3t s TYR 482 Ca -0.01 -0.16 -0.29 0.00 -0.52 0.00 0.00 57.07 56.09 3h3t s TYR 482 Cb -0.17 -0.07 -0.02 0.00 0.38 0.00 0.00 41.96 42.08 3h3t s TYR 482 CO -0.08 -0.16 0.98 -1.17 -1.52 0.00 0.00 175.55 173.60 3h3t s LEU 483 N -0.89 4.28 -0.17 -3.49 0.20 0.30 -0.12 118.68 118.79 3h3t s LEU 483 Ca -0.10 1.54 -0.00 0.00 0.69 0.00 0.00 54.13 56.25 3h3t s LEU 483 Cb -0.06 -3.53 0.00 0.00 -0.43 0.00 0.00 46.19 42.18 3h3t s LEU 483 CO 0.00 -0.38 -0.14 -0.55 -0.29 0.00 0.00 176.35 174.99 3h3t s SER 484 N 1.07 3.70 -0.02 3.68 0.15 0.90 -1.81 113.70 121.37 3h3t s SER 484 Ca 0.48 -0.48 0.02 0.00 0.70 0.00 0.00 55.95 56.67 3h3t s SER 484 Cb -0.19 -1.58 0.00 0.00 -1.71 0.00 0.00 66.02 62.54 3h3t s SER 484 CO 0.20 0.05 -0.07 0.54 1.20 0.00 0.00 173.24 175.16 3h3t s VAL 485 N 1.02 0.64 -0.21 4.45 0.11 -0.30 -1.26 120.40 124.85 3h3t s VAL 485 Ca -0.01 -0.28 -0.05 0.00 -2.93 0.00 0.00 61.98 58.71 3h3t s VAL 485 Cb -0.15 -0.58 -0.02 0.00 -1.53 0.00 0.00 36.38 34.10 3h3t s VAL 485 CO -0.03 0.21 -0.00 -0.51 -3.33 0.00 0.00 175.10 171.43 3h3t s ILE 486 N 0.23 3.87 0.10 7.04 2.07 -0.04 -1.70 121.20 132.77 3h3t s ILE 486 Ca -0.03 -0.34 0.03 0.00 -1.41 0.00 0.00 60.65 58.90 3h3t s ILE 486 Cb -0.08 -2.75 -0.04 0.00 0.13 0.00 0.00 42.46 39.72 3h3t s ILE 486 CO 0.00 0.42 -0.09 -0.13 -1.91 0.00 0.00 174.94 173.23 3h3t s ARG 487 N 1.10 0.84 -0.16 3.50 1.81 -0.34 -4.87 118.95 120.83 3h3t s ARG 487 Ca 0.02 -1.19 -0.02 0.00 -1.72 0.00 0.00 55.73 52.82 3h3t s ARG 487 Cb -0.14 -0.46 -0.01 0.00 -0.45 0.00 0.00 34.95 33.89 3h3t s ARG 487 CO 0.01 0.06 -0.09 0.21 -0.68 0.00 0.00 175.30 174.81 3h3t s LYS 488 N -3.00 3.41 -0.42 3.54 2.20 -1.26 -1.58 119.74 122.63 3h3t s LYS 488 Ca 0.07 -0.65 -0.18 0.00 -0.36 0.00 0.00 55.97 54.84 3h3t s LYS 488 Cb -0.01 -2.78 0.02 0.00 -1.51 0.00 0.00 37.83 33.55 3h3t s LYS 488 CO -0.01 0.09 0.51 0.42 -0.36 0.00 0.00 175.35 176.00 3h3t s ILE 489 N 0.69 5.00 0.26 5.43 -1.09 0.17 -5.01 121.20 126.65 3h3t s ILE 489 Ca -0.05 -0.11 -0.31 0.00 -2.23 0.00 0.00 60.65 57.95 3h3t s ILE 489 Cb -0.15 -4.08 -0.13 0.00 -1.58 0.00 0.00 42.46 36.52 3h3t s ILE 489 CO 0.02 -0.45 1.45 -0.81 -1.23 0.00 0.00 174.94 173.92 3h3t n PRO 490 N 5.83 2.20 -2.07 2.79 -0.04 -1.26 -2.42 135.00 140.03 3h3t n PRO 490 Ca -0.05 0.78 -0.39 0.00 -0.04 0.00 0.00 63.50 63.80 3h3t n PRO 490 Cb 0.48 -2.47 -0.01 0.00 -0.04 0.00 0.00 33.50 31.46 3h3t n PRO 490 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h3t s ALA 491 N -0.07 3.27 -0.64 0.55 0.00 -1.26 -4.87 121.76 118.74 3h3t s ALA 491 Ca 0.67 1.22 0.06 0.00 0.00 0.00 0.00 51.96 53.91 3h3t s ALA 491 Cb -0.61 -3.48 0.02 0.00 0.00 0.00 0.00 23.12 19.05 3h3t s ALA 491 CO 0.50 -0.79 0.56 1.28 0.00 0.00 0.00 175.76 177.31 3h3t n LEU 492 N 0.18 1.14 -4.70 0.00 4.77 -1.26 -4.97 117.00 112.16 3h3t n LEU 492 Ca 0.03 -0.84 -0.23 0.00 -0.03 0.00 0.00 56.01 54.94 3h3t n LEU 492 Cb 0.44 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 3h3t n LEU 492 CO 0.56 0.24 -0.26 0.42 -1.33 0.00 0.00 177.39 177.02 3h3t s THR 493 N -0.86 3.40 0.14 -5.08 -4.23 -1.26 -5.06 115.64 102.69 3h3t s THR 493 Ca 0.06 -1.77 -0.10 0.00 -1.18 0.00 0.00 61.69 58.70 3h3t s THR 493 Cb 0.05 -2.97 -0.08 0.00 1.34 0.00 0.00 72.50 70.84 3h3t s THR 493 CO 0.13 -0.30 1.42 1.05 -0.54 0.00 0.00 174.62 176.39 3h3t h GLU 494 N 1.70 0.83 0.00 3.99 4.11 -2.03 -3.31 114.58 119.87 3h3t h GLU 494 Ca -0.45 -0.53 0.00 0.00 0.07 0.00 0.00 59.36 58.46 3h3t h GLU 494 Cb 1.25 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.56 3h3t h GLU 494 CO 0.62 1.16 -1.62 0.09 0.07 0.00 0.00 179.01 179.32 3h3t n ASN 495 N -4.00 0.90 -4.74 3.06 5.03 -1.26 -4.99 115.26 109.26 3h3t n ASN 495 Ca -0.04 -0.18 -0.41 0.00 0.87 0.00 0.00 54.58 54.82 3h3t n ASN 495 Cb 0.62 1.65 -0.03 0.00 -1.02 0.00 0.00 39.78 41.01 3h3t n ASN 495 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 3h3t s ASP 496 N -3.78 6.93 0.31 6.41 1.01 -1.25 -4.95 116.67 121.37 3h3t s ASP 496 Ca -0.04 2.37 -0.28 0.00 0.71 0.00 0.00 52.55 55.31 3h3t s ASP 496 Cb 0.12 -2.61 -0.13 0.00 1.01 0.00 0.00 42.92 41.31 3h3t s ASP 496 CO 0.74 -0.49 1.13 -2.65 0.21 0.00 0.00 175.17 174.11 3h3t n PRO 497 N 2.55 1.70 -2.08 8.23 -0.02 -1.26 -4.77 135.00 139.35 3h3t n PRO 497 Ca 0.06 0.60 -0.34 0.00 -2.02 0.00 0.00 63.50 61.79 3h3t n PRO 497 Cb 0.43 -2.06 0.02 0.00 -0.02 0.00 0.00 33.50 31.87 3h3t n PRO 497 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3h3t s GLU 498 N -1.71 3.18 -0.13 -0.52 2.02 -1.26 -4.62 118.70 115.66 3h3t s GLU 498 Ca 0.57 1.49 0.01 0.00 0.02 0.00 0.00 54.97 57.06 3h3t s GLU 498 Cb -0.64 -1.99 -0.01 0.00 0.10 0.00 0.00 34.13 31.59 3h3t s GLU 498 CO 0.61 -0.97 -0.16 0.99 0.02 0.00 0.00 175.26 175.75 3h3t s THR 499 N -2.03 2.74 -0.08 3.63 2.01 -1.01 -4.04 115.64 116.85 3h3t s THR 499 Ca 0.70 -0.77 -0.02 0.00 0.31 0.00 0.00 61.69 61.91 3h3t s THR 499 Cb -0.22 -2.13 -0.03 0.00 0.01 0.00 0.00 72.50 70.12 3h3t s THR 499 CO 0.32 0.53 0.02 0.26 -0.69 0.00 0.00 174.62 175.06 3h3t s TRP 500 N 0.49 3.21 -0.04 4.92 0.52 -0.44 0.46 118.94 128.05 3h3t s TRP 500 Ca -0.11 0.22 -0.03 0.00 0.02 0.00 0.00 56.10 56.21 3h3t s TRP 500 Cb -0.16 -1.79 0.02 0.00 -1.15 0.00 0.00 33.47 30.39 3h3t s TRP 500 CO 0.05 0.50 0.10 -1.50 0.02 0.00 0.00 176.95 176.12 3h3t s ILE 501 N -0.94 -0.03 -0.19 2.03 2.07 -0.62 0.12 121.20 123.64 3h3t s ILE 501 Ca 0.15 0.09 -0.04 0.00 -1.41 0.00 0.00 60.65 59.44 3h3t s ILE 501 Cb -0.11 -0.16 -0.02 0.00 0.13 0.00 0.00 42.46 42.29 3h3t s ILE 501 CO 0.04 0.04 -0.04 -0.69 -1.91 0.00 0.00 174.94 172.38 3h3t s VAL 502 N 0.59 3.60 -0.17 4.00 1.01 -0.49 -1.20 120.40 127.75 3h3t s VAL 502 Ca -0.04 -0.43 -0.04 0.00 0.00 0.00 0.00 61.98 61.46 3h3t s VAL 502 Cb -0.06 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 3h3t s VAL 502 CO -0.02 0.44 -0.03 0.00 0.00 0.00 0.00 175.10 175.49 3h3t s ASN 504 N 0.57 3.83 -0.07 0.00 0.02 0.38 -1.15 114.94 118.51 3h3t s ASN 504 Ca -0.02 -0.66 -0.09 0.00 -1.02 0.00 0.00 52.86 51.07 3h3t s ASN 504 Cb -0.14 -1.61 0.02 0.00 0.02 0.00 0.00 41.25 39.54 3h3t s ASN 504 CO 0.02 -0.05 0.23 0.72 0.02 0.00 0.00 177.10 178.05 3h3t s PHE 505 N 1.35 -0.22 0.39 2.20 -0.12 -0.75 0.61 117.98 121.44 3h3t s PHE 505 Ca 0.03 0.52 -0.27 0.00 -0.05 0.00 0.00 56.93 57.17 3h3t s PHE 505 Cb -0.15 0.07 -0.09 0.00 -0.63 0.00 0.00 43.02 42.23 3h3t s PHE 505 CO -0.08 -0.17 1.32 -1.12 -0.05 0.00 0.00 175.22 175.12 3h3t s SER 506 N -0.16 6.38 0.27 1.98 0.01 -0.84 -0.54 113.70 120.80 3h3t s SER 506 Ca -0.03 2.69 0.02 0.00 1.31 0.00 0.00 55.95 59.94 3h3t s SER 506 Cb -0.03 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.52 3h3t s SER 506 CO 0.01 -0.81 0.15 0.68 0.41 0.00 0.00 173.24 173.68 3h3t s VAL 507 N -1.23 0.24 0.35 3.43 -7.23 -0.63 -4.78 120.40 110.55 3h3t s VAL 507 Ca 0.55 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.78 3h3t s VAL 507 Cb -0.39 -2.53 -0.01 0.00 0.56 0.00 0.00 36.38 34.01 3h3t s VAL 507 CO 0.51 0.00 0.50 -1.81 -0.31 0.00 0.00 175.10 173.99 3h3t s ASP 508 N -3.30 5.95 -0.29 4.85 1.01 -1.26 -4.67 116.67 118.96 3h3t s ASP 508 Ca 0.38 -0.11 -0.18 0.00 0.71 0.00 0.00 52.55 53.34 3h3t s ASP 508 Cb 0.06 -1.28 0.16 0.00 1.01 0.00 0.00 42.92 42.87 3h3t s ASP 508 CO 0.16 -0.47 1.09 -2.28 0.21 0.00 0.00 175.17 173.89 3h3t s HIS 509 N -2.23 -0.39 0.56 4.23 2.46 -1.26 -5.05 115.29 113.61 3h3t s HIS 509 Ca 0.45 0.82 0.24 0.00 0.47 0.00 0.00 55.06 57.04 3h3t s HIS 509 Cb -0.10 0.29 1.51 0.00 -0.13 0.00 0.00 32.58 34.16 3h3t s HIS 509 CO 0.32 -0.19 2.12 -0.44 -2.47 0.00 0.00 174.74 174.07 3h3t h ASP 510 N 5.28 0.00 1.23 9.88 3.32 -2.01 -1.41 116.42 132.71 3h3t h ASP 510 Ca -0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.77 3h3t h ASP 510 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3h3t h ASP 510 CO 0.19 0.00 0.00 -1.20 -1.72 0.00 0.00 179.24 176.51 3h3t n SER 511 N -4.15 0.50 -3.21 6.45 7.64 -1.26 -4.09 113.62 115.49 3h3t n SER 511 Ca 0.01 0.55 -0.23 0.00 1.01 0.00 0.00 58.87 60.21 3h3t n SER 511 Cb 0.28 -0.69 -0.06 0.00 -1.01 0.00 0.00 64.21 62.73 3h3t n SER 511 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h3t n ALA 512 N -1.68 2.80 -1.66 -0.43 0.00 -0.53 -5.10 120.51 113.91 3h3t n ALA 512 Ca 0.06 -3.74 -0.31 0.00 0.00 0.00 0.00 53.44 49.44 3h3t n ALA 512 Cb 0.38 -0.85 0.04 0.00 0.00 0.00 0.00 19.45 19.02 3h3t n ALA 512 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3h3t s PRO 513 N -1.86 3.13 0.83 0.00 0.04 -1.25 -4.62 135.00 131.27 3h3t s PRO 513 Ca 0.38 0.89 -0.16 0.00 0.04 0.00 0.00 61.00 62.15 3h3t s PRO 513 Cb 0.21 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.68 3h3t s PRO 513 CO -0.09 -0.95 0.05 1.28 0.04 0.00 0.00 177.00 177.34 3h3t n LEU 514 N -3.02 -1.87 -4.09 -3.56 4.77 -1.26 -5.01 117.00 102.95 3h3t n LEU 514 Ca 0.07 0.42 -0.11 0.00 -0.03 0.00 0.00 56.01 56.36 3h3t n LEU 514 Cb 0.54 -1.05 -0.07 0.00 -2.33 0.00 0.00 43.42 40.51 3h3t n LEU 514 CO 0.56 -4.26 -0.00 0.54 -1.33 0.00 0.00 177.39 172.90 3h3t s ASN 515 N -1.44 0.06 0.00 -1.43 2.20 -1.26 -5.06 114.94 108.01 3h3t s ASN 515 Ca 0.55 -1.15 0.22 0.00 -0.94 0.00 0.00 52.86 51.54 3h3t s ASN 515 Cb -0.28 0.50 0.65 0.00 -2.00 0.00 0.00 41.25 40.11 3h3t s ASN 515 CO 0.68 -1.02 1.50 -0.46 -2.94 0.00 0.00 177.10 174.87 3h3t n ASN 516 N -0.38 2.23 -0.11 3.54 6.94 -1.26 -4.10 115.26 122.12 3h3t n ASN 516 Ca 0.00 -1.79 -0.15 0.00 -0.02 0.00 0.00 54.58 52.62 3h3t n ASN 516 Cb 0.64 -0.13 -0.13 0.00 -2.36 0.00 0.00 39.78 37.79 3h3t n ASN 516 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3h3t n ARG 517 N 0.70 0.67 -4.90 -3.83 1.74 -1.26 -4.97 116.66 104.81 3h3t n ARG 517 Ca 0.17 0.11 -0.31 0.00 -0.77 0.00 0.00 57.85 57.05 3h3t n ARG 517 Cb 0.43 -1.54 -0.14 0.00 -1.02 0.00 0.00 32.46 30.19 3h3t n ARG 517 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h3t s VAL 519 N -0.80 4.63 -0.43 0.00 1.01 0.30 -4.65 120.40 120.47 3h3t s VAL 519 Ca 0.12 1.99 -0.26 0.00 0.00 0.00 0.00 61.98 63.84 3h3t s VAL 519 Cb -0.10 -4.27 0.02 0.00 0.00 0.00 0.00 36.38 32.03 3h3t s VAL 519 CO 0.02 0.21 0.93 -0.60 0.00 0.00 0.00 175.10 175.66 3h3t s ARG 520 N 0.62 3.65 0.56 2.72 6.06 -1.26 -0.25 118.95 131.05 3h3t s ARG 520 Ca 0.51 0.31 -0.07 0.00 -2.50 0.00 0.00 55.73 53.98 3h3t s ARG 520 Cb -0.23 -3.88 -0.02 0.00 0.06 0.00 0.00 34.95 30.88 3h3t s ARG 520 CO 0.29 -1.12 0.89 0.00 -2.50 0.00 0.00 175.30 172.86 3h3t s ALA 521 N 3.66 3.28 -0.06 6.12 0.00 -0.37 -4.44 121.76 129.95 3h3t s ALA 521 Ca 0.37 -0.47 0.05 0.00 0.00 0.00 0.00 51.96 51.91 3h3t s ALA 521 Cb -0.11 -2.72 -0.00 0.00 0.00 0.00 0.00 23.12 20.29 3h3t s ALA 521 CO 0.24 -0.61 -0.20 0.15 0.00 0.00 0.00 175.76 175.34 3h3t s LYS 522 N -4.94 2.13 0.16 0.00 -0.14 -0.40 -4.60 119.74 111.95 3h3t s LYS 522 Ca 0.52 -0.70 0.07 0.00 -1.36 0.00 0.00 55.97 54.49 3h3t s LYS 522 Cb -0.11 -1.79 -0.04 0.00 -1.68 0.00 0.00 37.83 34.21 3h3t s LYS 522 CO 0.47 0.25 -0.14 0.96 -0.76 0.00 0.00 175.35 176.13 3h3t s ILE 523 N 0.08 1.49 -0.29 2.17 -4.36 -1.26 0.00 121.20 119.03 3h3t s ILE 523 Ca -0.07 -1.96 -0.00 0.00 -0.26 0.00 0.00 60.65 58.36 3h3t s ILE 523 Cb -0.13 -1.79 0.14 0.00 1.25 0.00 0.00 42.46 41.93 3h3t s ILE 523 CO 0.04 -0.52 0.31 0.21 0.24 0.00 0.00 174.94 175.21 3h3t s ASN 524 N -2.88 1.56 0.08 4.36 2.47 -0.22 -1.98 114.94 118.33 3h3t s ASN 524 Ca 0.15 -0.74 0.07 0.00 0.42 0.00 0.00 52.86 52.76 3h3t s ASN 524 Cb -0.02 0.56 -0.03 0.00 -1.45 0.00 0.00 41.25 40.31 3h3t s ASN 524 CO 0.04 -0.38 -0.18 -0.69 -3.72 0.00 0.00 177.10 172.17 3h3t s VAL 525 N 2.36 1.43 -0.03 -5.21 1.01 0.20 -1.78 120.40 118.38 3h3t s VAL 525 Ca 0.10 -1.35 -0.05 0.00 0.00 0.00 0.00 61.98 60.68 3h3t s VAL 525 Cb -0.14 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 34.94 3h3t s VAL 525 CO -0.32 -0.07 0.11 0.00 0.00 0.00 0.00 175.10 174.82 3h3t s ALA 526 N -1.11 -0.27 -0.17 5.51 0.00 -0.62 -0.47 121.76 124.62 3h3t s ALA 526 Ca 0.03 0.14 -0.01 0.00 0.00 0.00 0.00 51.96 52.13 3h3t s ALA 526 Cb -0.10 -0.09 -0.00 0.00 0.00 0.00 0.00 23.12 22.93 3h3t s ALA 526 CO 0.03 -0.11 -0.13 1.41 0.00 0.00 0.00 175.76 176.96 3h3t s MET 527 N -0.44 3.25 -0.15 0.00 1.75 0.34 -1.07 119.30 122.97 3h3t s MET 527 Ca -0.05 -0.72 0.01 0.00 -1.25 0.00 0.00 55.69 53.68 3h3t s MET 527 Cb -0.03 -2.72 0.01 0.00 2.84 0.00 0.00 34.83 34.93 3h3t s MET 527 CO 0.00 -0.04 -0.20 0.42 -0.65 0.00 0.00 175.02 174.56 3h3t s ILE 528 N 0.98 2.23 -0.01 10.11 1.01 0.12 -1.39 121.20 134.26 3h3t s ILE 528 Ca -0.02 -0.91 0.06 0.00 0.00 0.00 0.00 60.65 59.78 3h3t s ILE 528 Cb -0.15 -1.92 -0.02 0.00 0.01 0.00 0.00 42.46 40.39 3h3t s ILE 528 CO -0.02 0.54 -0.19 0.00 0.00 0.00 0.00 174.94 175.27 3h3t s GLN 530 N -0.49 1.01 -0.25 0.00 -0.21 -0.70 -1.33 119.66 117.69 3h3t s GLN 530 Ca 0.07 -0.50 -0.12 0.00 0.02 0.00 0.00 55.36 54.84 3h3t s GLN 530 Cb -0.07 -0.98 -0.05 0.00 1.00 0.00 0.00 33.01 32.91 3h3t s GLN 530 CO -0.01 0.26 0.22 0.99 -2.12 0.00 0.00 175.29 174.64 3h3t s THR 531 N -0.38 5.30 -0.24 -0.19 2.01 -1.26 -0.69 115.64 120.19 3h3t s THR 531 Ca 0.04 0.29 -0.15 0.00 0.31 0.00 0.00 61.69 62.18 3h3t s THR 531 Cb -0.05 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 3h3t s THR 531 CO -0.00 0.28 0.36 -0.76 -0.69 0.00 0.00 174.62 173.81 3h3t s LEU 532 N 1.45 4.09 -0.13 4.42 1.43 0.39 -4.67 118.68 125.65 3h3t s LEU 532 Ca 0.10 0.35 -0.01 0.00 -1.03 0.00 0.00 54.13 53.54 3h3t s LEU 532 Cb -0.15 -2.42 -0.02 0.00 0.03 0.00 0.00 46.19 43.63 3h3t s LEU 532 CO 0.08 -0.12 -0.11 -0.69 0.23 0.00 0.00 176.35 175.74 3h3t s VAL 533 N 1.71 3.27 -0.27 -1.59 1.01 -1.26 -1.81 120.40 121.46 3h3t s VAL 533 Ca 0.16 -0.59 -0.00 0.00 0.00 0.00 0.00 61.98 61.55 3h3t s VAL 533 Cb -0.15 -2.39 0.08 0.00 0.00 0.00 0.00 36.38 33.93 3h3t s VAL 533 CO 0.09 0.52 0.04 -0.94 0.00 0.00 0.00 175.10 174.81 3h3t s SER 534 N 0.28 3.88 0.25 3.32 1.04 0.51 -5.03 113.70 117.95 3h3t s SER 534 Ca -0.08 -1.44 -0.08 0.00 0.48 0.00 0.00 55.95 54.83 3h3t s SER 534 Cb -0.15 -0.99 -0.07 0.00 0.10 0.00 0.00 66.02 64.91 3h3t s SER 534 CO 0.05 -0.35 -0.09 -2.65 0.98 0.00 0.00 173.24 171.18 3h3t n PRO 535 N 4.76 0.00 -0.10 4.02 -0.02 -1.26 -4.53 135.00 137.87 3h3t n PRO 535 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 3h3t n PRO 535 Cb 0.43 -0.44 0.00 0.00 -0.02 0.00 0.00 33.50 33.47 3h3t n PRO 535 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3h3t n PRO 536 N 0.72 1.87 -2.57 0.52 -0.04 -1.26 -5.01 135.00 129.23 3h3t n PRO 536 Ca 0.03 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.07 3h3t n PRO 536 Cb 0.21 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.65 3h3t n PRO 536 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3h3t s GLU 537 N 1.00 3.43 0.85 0.54 1.03 -1.26 -4.94 118.70 119.35 3h3t s GLU 537 Ca 0.00 0.15 0.00 0.00 0.03 0.00 0.00 54.97 55.15 3h3t s GLU 537 Cb 0.00 -4.06 0.00 0.00 -0.80 0.00 0.00 34.13 29.27 3h3t s GLU 537 CO 0.00 -1.80 0.00 0.41 -1.33 0.00 0.00 175.26 172.54 3h3t n GLY 538 N 5.14 0.65 1.79 -3.83 0.00 -1.26 -4.18 105.19 103.50 3h3t n GLY 538 Ca 0.07 -1.52 -0.03 0.00 0.00 0.00 0.00 46.02 44.54 3h3t n GLY 538 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3h3t n ASN 539 N 0.73 4.58 -4.91 1.61 3.02 -1.26 -5.00 115.26 114.03 3h3t n ASN 539 Ca 0.00 -3.24 -0.28 0.00 -0.03 0.00 0.00 54.58 51.04 3h3t n ASN 539 Cb 0.00 -0.71 0.03 0.00 -0.61 0.00 0.00 39.78 38.49 3h3t n ASN 539 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3h3t s GLN 540 N -2.99 2.94 0.68 3.52 -0.21 -1.26 -5.06 119.66 117.27 3h3t s GLN 540 Ca 0.53 0.17 -0.13 0.00 0.02 0.00 0.00 55.36 55.95 3h3t s GLN 540 Cb 0.43 -2.19 0.01 0.00 1.00 0.00 0.00 33.01 32.25 3h3t s GLN 540 CO 0.12 -0.79 1.08 -1.21 -2.12 0.00 0.00 175.29 172.37 3h3t s GLU 541 N -5.10 2.84 0.13 2.91 8.01 -1.26 -4.79 118.70 121.44 3h3t s GLU 541 Ca 0.55 1.16 -0.33 0.00 0.01 0.00 0.00 54.97 56.36 3h3t s GLU 541 Cb -0.11 -1.97 -0.12 0.00 -4.31 0.00 0.00 34.13 27.62 3h3t s GLU 541 CO 0.47 -1.19 1.73 -0.89 0.01 0.00 0.00 175.26 175.39 3h3t n ILE 542 N -2.80 0.19 -3.37 -1.63 2.08 -1.26 -4.84 119.36 107.73 3h3t n ILE 542 Ca 0.09 -0.03 -0.22 0.00 0.56 0.00 0.00 62.75 63.15 3h3t n ILE 542 Cb 0.53 -1.85 0.02 0.00 -0.75 0.00 0.00 39.64 37.59 3h3t n ILE 542 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 3h3t s SER 543 N 1.93 5.01 0.00 4.38 1.04 -1.26 -4.94 113.70 119.85 3h3t s SER 543 Ca 0.81 -0.91 0.04 0.00 0.48 0.00 0.00 55.95 56.37 3h3t s SER 543 Cb -0.59 0.10 0.22 0.00 0.10 0.00 0.00 66.02 65.85 3h3t s SER 543 CO 0.38 -1.10 0.62 0.54 0.98 0.00 0.00 173.24 174.67 3h3t n ARG 544 N -1.95 0.40 0.00 4.02 1.74 -1.26 -2.40 116.66 117.21 3h3t n ARG 544 Ca 0.08 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.25 3h3t n ARG 544 Cb 0.62 -1.14 0.05 0.00 -1.02 0.00 0.00 32.46 30.97 3h3t n ARG 544 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3h3t n ASP 545 N -0.64 2.35 -0.54 0.55 10.43 -1.26 -3.39 116.55 124.04 3h3t n ASP 545 Ca 0.03 -1.68 0.06 0.00 2.57 0.00 0.00 54.79 55.77 3h3t n ASP 545 Cb 0.01 0.15 0.08 0.00 1.84 0.00 0.00 41.12 43.21 3h3t n ASP 545 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3h3t n ASN 546 N 0.72 2.30 -4.33 -2.24 3.02 -1.01 -4.98 115.26 108.74 3h3t n ASN 546 Ca 0.10 -1.65 -0.29 0.00 -0.03 0.00 0.00 54.58 52.71 3h3t n ASN 546 Cb 0.46 -0.07 -0.14 0.00 -0.61 0.00 0.00 39.78 39.41 3h3t n ASN 546 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 3h3t s ILE 547 N -1.00 2.04 -0.08 2.41 -4.36 -1.25 -0.37 121.20 118.59 3h3t s ILE 547 Ca 0.17 -1.38 -0.04 0.00 -0.26 0.00 0.00 60.65 59.14 3h3t s ILE 547 Cb 0.11 -1.76 0.04 0.00 1.25 0.00 0.00 42.46 42.11 3h3t s ILE 547 CO 0.16 0.31 0.19 -0.22 0.24 0.00 0.00 174.94 175.62 3h3t s LEU 548 N -1.30 0.58 -0.26 0.37 2.96 -0.75 -1.42 118.68 118.86 3h3t s LEU 548 Ca 0.11 0.41 -0.10 0.00 -0.22 0.00 0.00 54.13 54.33 3h3t s LEU 548 Cb -0.10 0.55 -0.04 0.00 0.50 0.00 0.00 46.19 47.09 3h3t s LEU 548 CO 0.02 -0.16 0.15 0.00 -1.32 0.00 0.00 176.35 175.05 3h3t s LYS 550 N 1.59 4.15 -0.05 0.00 1.02 0.13 -0.13 119.74 126.45 3h3t s LYS 550 Ca 0.07 0.31 0.05 0.00 0.02 0.00 0.00 55.97 56.41 3h3t s LYS 550 Cb -0.15 -3.58 -0.02 0.00 -0.52 0.00 0.00 37.83 33.56 3h3t s LYS 550 CO 0.08 -0.17 -0.19 0.42 -0.92 0.00 0.00 175.35 174.57 3h3t s ILE 551 N 1.70 2.64 -0.12 2.17 1.01 0.92 -1.71 121.20 127.80 3h3t s ILE 551 Ca 0.21 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 60.00 3h3t s ILE 551 Cb -0.15 -2.00 0.02 0.00 0.01 0.00 0.00 42.46 40.34 3h3t s ILE 551 CO 0.09 0.58 -0.14 -0.89 0.00 0.00 0.00 174.94 174.58 3h3t s THR 552 N -0.57 1.45 -0.14 2.92 2.01 -0.25 -1.10 115.64 119.95 3h3t s THR 552 Ca 0.08 -0.59 0.01 0.00 0.31 0.00 0.00 61.69 61.50 3h3t s THR 552 Cb -0.11 -1.35 0.02 0.00 0.01 0.00 0.00 72.50 71.07 3h3t s THR 552 CO 0.01 0.43 -0.17 -0.47 -0.69 0.00 0.00 174.62 173.73 3h3t s TYR 553 N 1.22 2.35 -0.02 4.92 5.04 -0.48 0.16 117.35 130.55 3h3t s TYR 553 Ca -0.02 -1.26 0.08 0.00 -2.44 0.00 0.00 57.07 53.43 3h3t s TYR 553 Cb -0.14 -1.67 -0.02 0.00 0.35 0.00 0.00 41.96 40.49 3h3t s TYR 553 CO -0.05 -0.64 -0.25 0.14 -1.34 0.00 0.00 175.55 173.41 3h3t s VAL 554 N 1.18 1.98 -0.04 3.14 -7.23 -0.23 -0.67 120.40 118.53 3h3t s VAL 554 Ca -0.00 -1.09 -0.00 0.00 -1.81 0.00 0.00 61.98 59.08 3h3t s VAL 554 Cb -0.14 -1.65 0.03 0.00 0.56 0.00 0.00 36.38 35.18 3h3t s VAL 554 CO -0.07 0.55 -0.00 0.00 -0.31 0.00 0.00 175.10 175.26 3h3t s ALA 555 N -0.60 0.47 -0.29 1.32 0.00 -0.03 -1.59 121.76 121.03 3h3t s ALA 555 Ca 0.10 0.06 0.03 0.00 0.00 0.00 0.00 51.96 52.15 3h3t s ALA 555 Cb -0.10 -0.46 0.08 0.00 0.00 0.00 0.00 23.12 22.64 3h3t s ALA 555 CO -0.01 -0.18 -0.04 -0.80 0.00 0.00 0.00 175.76 174.72 3h3t s ASN 556 N 1.31 4.52 -0.07 0.00 0.01 -0.73 -0.83 114.94 119.15 3h3t s ASN 556 Ca -0.05 -1.67 0.05 0.00 -0.71 0.00 0.00 52.86 50.48 3h3t s ASN 556 Cb -0.13 -1.54 -0.01 0.00 0.41 0.00 0.00 41.25 39.98 3h3t s ASN 556 CO -0.02 -0.27 -0.23 -0.69 -1.51 0.00 0.00 177.10 174.38 3h3t s VAL 557 N 1.06 1.95 -0.47 1.60 1.01 -1.26 -1.05 120.40 123.23 3h3t s VAL 557 Ca -0.01 -0.99 -0.16 0.00 0.00 0.00 0.00 61.98 60.82 3h3t s VAL 557 Cb -0.19 -1.66 0.06 0.00 0.00 0.00 0.00 36.38 34.59 3h3t s VAL 557 CO -0.07 0.54 0.40 0.21 0.00 0.00 0.00 175.10 176.19 3h3t s ASN 558 N 0.01 6.15 0.42 3.32 3.84 0.10 -4.65 114.94 124.14 3h3t s ASN 558 Ca -0.08 -1.23 0.29 0.00 0.21 0.00 0.00 52.86 52.05 3h3t s ASN 558 Cb -0.15 -2.19 1.52 0.00 -0.55 0.00 0.00 41.25 39.88 3h3t s ASN 558 CO 0.05 -0.64 1.88 -0.65 -2.79 0.00 0.00 177.10 174.95 3h3t h PRO 559 N 8.76 0.00 -0.13 0.43 0.11 -1.83 -1.06 132.00 138.28 3h3t h PRO 559 Ca -0.28 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.84 3h3t h PRO 559 Cb 1.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3h3t h PRO 559 CO 0.86 0.00 -0.04 0.41 -0.21 0.00 0.00 178.00 179.02 3h3t n GLY 560 N -1.02 -2.35 7.00 -0.55 0.00 -1.26 -4.29 105.19 102.71 3h3t n GLY 560 Ca -0.01 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.55 3h3t n GLY 560 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h3t n GLY 561 N -2.30 3.06 3.19 -0.02 0.00 -1.26 -4.71 105.19 103.15 3h3t n GLY 561 Ca -0.00 -0.29 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 3h3t n GLY 561 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3h3t s TRP 562 N 0.00 -0.30 0.04 1.61 -0.00 -1.26 -5.09 118.94 113.94 3h3t s TRP 562 Ca 0.00 0.70 -0.22 0.00 -0.00 0.00 0.00 56.10 56.59 3h3t s TRP 562 Cb 0.00 0.11 0.05 0.00 -0.00 0.00 0.00 33.47 33.62 3h3t s TRP 562 CO 0.00 -0.20 0.50 0.00 -0.00 0.00 0.00 176.95 177.25 3h3t s ALA 563 N -0.11 -1.27 0.29 5.86 0.00 -1.26 -5.08 121.76 120.19 3h3t s ALA 563 Ca -0.02 0.56 -0.30 0.00 0.00 0.00 0.00 51.96 52.19 3h3t s ALA 563 Cb -0.03 0.36 -0.12 0.00 0.00 0.00 0.00 23.12 23.34 3h3t s ALA 563 CO 0.01 -0.49 1.58 -2.30 0.00 0.00 0.00 175.76 174.56 3h3t n PRO 564 N 0.45 2.63 -0.07 0.00 -0.02 -1.26 -4.87 135.00 131.86 3h3t n PRO 564 Ca -0.18 0.94 -0.07 0.00 -2.02 0.00 0.00 63.50 62.16 3h3t n PRO 564 Cb 0.60 -2.71 -0.01 0.00 -0.02 0.00 0.00 33.50 31.37 3h3t n PRO 564 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h3t h ALA 565 N 4.77 0.07 -0.65 3.55 0.00 -1.99 -1.03 119.26 123.98 3h3t h ALA 565 Ca -0.47 0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.57 3h3t h ALA 565 Cb 1.23 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 19.34 3h3t h ALA 565 CO 0.79 -0.55 0.43 0.66 0.00 0.00 0.00 179.25 180.59 3h3t h SER 566 N -0.11 0.70 -0.10 0.00 4.64 -1.99 -1.25 113.55 115.44 3h3t h SER 566 Ca 0.15 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.44 3h3t h SER 566 Cb 0.34 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3h3t h SER 566 CO -0.36 0.50 -0.00 0.58 -0.87 0.00 0.00 176.83 176.68 3h3t h VAL 567 N 0.82 1.26 -0.30 0.95 2.07 -1.72 -1.98 116.25 117.35 3h3t h VAL 567 Ca 0.25 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 3h3t h VAL 567 Cb -0.01 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 3h3t h VAL 567 CO -0.06 0.23 0.14 -0.07 0.02 0.00 0.00 177.57 177.83 3h3t h LEU 568 N -0.11 0.37 -0.24 2.57 3.38 -0.73 -2.22 115.31 118.33 3h3t h LEU 568 Ca 0.03 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 3h3t h LEU 568 Cb 0.36 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3h3t h LEU 568 CO 0.01 0.32 -0.69 0.03 0.09 0.00 0.00 178.44 178.19 3h3t h ARG 569 N 0.42 0.00 0.01 1.13 3.08 -1.09 -2.06 114.38 115.87 3h3t h ARG 569 Ca 0.11 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.96 3h3t h ARG 569 Cb 0.05 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 3h3t h ARG 569 CO -0.01 0.69 -0.94 0.00 -1.07 0.00 0.00 179.97 178.64 3h3t h ALA 570 N 1.31 0.46 0.03 0.04 0.00 -0.79 -2.57 119.26 117.74 3h3t h ALA 570 Ca -0.01 -0.82 -0.24 0.00 0.00 0.00 0.00 54.91 53.84 3h3t h ALA 570 Cb 1.43 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3h3t h ALA 570 CO 0.09 1.10 -1.01 -0.39 0.00 0.00 0.00 179.25 179.04 3h3t h VAL 571 N 0.02 1.42 0.05 0.00 -1.51 -1.32 -1.79 116.25 113.11 3h3t h VAL 571 Ca -0.02 -2.57 0.03 0.00 -1.23 0.00 0.00 66.70 62.90 3h3t h VAL 571 Cb 1.64 2.53 -0.04 0.00 -2.13 0.00 0.00 31.29 33.29 3h3t h VAL 571 CO 0.13 0.76 -0.28 0.00 -1.23 0.00 0.00 177.57 176.96 3h3t h ALA 572 N 0.70 -0.42 -0.00 5.19 0.00 -1.40 0.36 119.26 123.69 3h3t h ALA 572 Ca -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3h3t h ALA 572 Cb 1.67 0.47 -0.00 0.00 0.00 0.00 0.00 17.79 19.93 3h3t h ALA 572 CO 0.17 -0.79 0.00 0.87 0.00 0.00 0.00 179.25 179.50 3h3t h LYS 573 N -0.45 0.00 0.00 0.00 1.57 -1.36 -2.22 116.57 114.12 3h3t h LYS 573 Ca 0.05 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 3h3t h LYS 573 Cb 0.51 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 3h3t h LYS 573 CO -0.21 0.00 -0.26 -0.09 -0.57 0.00 0.00 179.45 178.32 3h3t h ARG 574 N 0.00 0.01 0.08 3.15 2.43 -0.89 -3.40 114.38 115.76 3h3t h ARG 574 Ca 0.00 -0.01 -0.26 0.00 -0.81 0.00 0.00 59.98 58.90 3h3t h ARG 574 Cb 0.01 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 3h3t h ARG 574 CO -0.00 1.01 -1.22 0.93 -1.51 0.00 0.00 179.97 179.17 3h3t h GLU 575 N -0.98 0.16 -0.12 0.20 4.39 -0.07 -3.03 114.58 115.14 3h3t h GLU 575 Ca -0.07 -0.28 -0.05 0.00 0.34 0.00 0.00 59.36 59.30 3h3t h GLU 575 Cb 1.08 0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.83 3h3t h GLU 575 CO -0.04 1.10 -0.13 1.88 -1.16 0.00 0.00 179.01 180.66 3h3t h TYR 576 N 0.04 0.36 -0.22 4.33 0.05 -1.60 -2.07 116.97 117.87 3h3t h TYR 576 Ca -0.12 -0.11 -0.00 0.00 0.05 0.00 0.00 58.73 58.55 3h3t h TYR 576 Cb 1.91 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 39.57 3h3t h TYR 576 CO 0.04 0.71 0.13 -1.35 -1.05 0.00 0.00 178.16 176.65 3h3t h PRO 577 N -0.10 0.29 -0.59 4.88 0.11 -1.78 -1.81 132.00 133.01 3h3t h PRO 577 Ca 0.02 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 66.20 3h3t h PRO 577 Cb 0.66 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 31.63 3h3t h PRO 577 CO 0.03 0.23 0.19 -0.22 -0.21 0.00 0.00 178.00 178.03 3h3t h LYS 578 N 0.27 0.35 -0.69 1.05 3.64 -1.54 -1.38 116.57 118.25 3h3t h LYS 578 Ca 0.08 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 3h3t h LYS 578 Cb 0.02 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 3h3t h LYS 578 CO -0.01 0.23 0.46 0.35 -2.27 0.00 0.00 179.45 178.20 3h3t h PHE 579 N 0.36 0.87 -0.32 1.91 3.57 -1.18 -2.82 116.94 119.32 3h3t h PHE 579 Ca 0.30 0.02 -0.15 0.00 3.53 0.00 0.00 57.97 61.67 3h3t h PHE 579 Cb 0.39 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 3h3t h PHE 579 CO -0.19 0.55 -0.40 -0.07 -2.23 0.00 0.00 178.31 175.96 3h3t h LEU 580 N 0.94 0.84 -0.02 0.59 3.38 -0.43 0.23 115.31 120.84 3h3t h LEU 580 Ca 0.25 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 3h3t h LEU 580 Cb -0.11 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.40 3h3t h LEU 580 CO -0.05 1.14 0.00 0.50 0.09 0.00 0.00 178.44 180.12 3h3t h LYS 581 N 0.64 0.04 -0.36 1.13 3.64 -1.31 -1.45 116.57 118.90 3h3t h LYS 581 Ca 0.05 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.33 3h3t h LYS 581 Cb 0.96 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.77 3h3t h LYS 581 CO 0.09 0.26 -0.13 -0.09 -2.27 0.00 0.00 179.45 177.32 3h3t h ARG 582 N -0.20 0.72 -0.37 1.90 2.43 -1.50 -1.83 114.38 115.53 3h3t h ARG 582 Ca 0.01 -0.29 -0.15 0.00 -0.81 0.00 0.00 59.98 58.73 3h3t h ARG 582 Cb 0.24 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 3h3t h ARG 582 CO 0.00 0.89 -0.34 0.35 -1.51 0.00 0.00 179.97 179.36 3h3t h PHE 583 N 0.51 1.07 -0.03 2.20 3.57 -0.54 -0.96 116.94 122.76 3h3t h PHE 583 Ca 0.09 -0.31 -0.10 0.00 3.53 0.00 0.00 57.97 61.18 3h3t h PHE 583 Cb 0.65 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 3h3t h PHE 583 CO 0.05 1.12 -0.43 1.79 -2.23 0.00 0.00 178.31 178.62 3h3t h THR 584 N 0.70 1.31 -0.13 4.41 1.35 -1.32 -2.38 112.91 116.86 3h3t h THR 584 Ca 0.06 -1.51 -0.15 0.00 -0.55 0.00 0.00 66.41 64.26 3h3t h THR 584 Cb 0.93 1.77 0.01 0.00 -1.73 0.00 0.00 68.15 69.13 3h3t h THR 584 CO 0.09 0.44 -0.51 0.28 -0.25 0.00 0.00 175.52 175.56 3h3t h SER 585 N 0.06 0.67 -0.64 5.36 0.02 -1.10 -2.27 113.55 115.65 3h3t h SER 585 Ca 0.00 -0.62 0.13 0.00 -0.84 0.00 0.00 61.79 60.46 3h3t h SER 585 Cb 0.79 -0.20 -0.09 0.00 0.14 0.00 0.00 62.40 63.04 3h3t h SER 585 CO 0.06 1.18 0.12 0.22 -1.14 0.00 0.00 176.83 177.26 3h3t h TYR 586 N 0.20 0.18 -0.58 3.45 3.20 -1.11 0.18 116.97 122.49 3h3t h TYR 586 Ca -0.03 0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.77 3h3t h TYR 586 Cb 1.14 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 39.42 3h3t h TYR 586 CO 0.11 -0.07 -0.07 0.28 -1.64 0.00 0.00 178.16 176.77 3h3t h VAL 587 N 0.24 1.27 -0.75 1.81 2.07 -1.24 -1.13 116.25 118.50 3h3t h VAL 587 Ca 0.34 -1.23 0.04 0.00 0.82 0.00 0.00 66.70 66.67 3h3t h VAL 587 Cb 0.53 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 3h3t h VAL 587 CO -0.45 0.44 0.50 1.56 0.02 0.00 0.00 177.57 179.63 3h3t h GLN 588 N 0.95 0.88 -0.23 1.57 4.20 -0.72 -2.84 115.11 118.92 3h3t h GLN 588 Ca 0.16 -0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.66 3h3t h GLN 588 Cb 0.64 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 3h3t h GLN 588 CO 0.04 0.59 -0.48 0.93 -0.67 0.00 0.00 178.83 179.23 3h3t h GLU 589 N 0.91 0.63 0.00 1.46 5.08 0.17 -2.67 114.58 120.15 3h3t h GLU 589 Ca 0.30 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3h3t h GLU 589 Cb 0.06 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3h3t h GLU 589 CO -0.09 0.97 -0.14 0.87 -1.00 0.00 0.00 179.01 179.62 3h3t h LYS 590 N 0.50 0.00 0.00 2.33 1.79 -1.17 -3.34 116.57 116.68 3h3t h LYS 590 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3h3t h LYS 590 Cb 1.03 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.68 3h3t h LYS 590 CO 0.10 0.00 -1.66 0.25 -1.08 0.00 0.00 179.45 177.05 3h3t n THR 591 N -2.91 0.00 -1.63 -0.16 -2.24 -1.08 -4.92 114.28 101.34 3h3t n THR 591 Ca 0.04 -0.35 -0.57 0.00 -2.27 0.00 0.00 64.05 60.89 3h3t n THR 591 Cb 0.52 0.19 -0.07 0.00 -2.10 0.00 0.00 70.33 68.87 3h3t n THR 591 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h3t n ALA 592 N -2.01 -1.33 -1.66 6.98 0.00 -1.01 -1.13 120.51 120.36 3h3t n ALA 592 Ca -0.03 0.49 -0.19 0.00 0.00 0.00 0.00 53.44 53.71 3h3t n ALA 592 Cb 0.40 -2.03 -0.07 0.00 0.00 0.00 0.00 19.45 17.75 3h3t n ALA 592 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h3t n GLY 593 N 3.02 1.56 3.87 0.00 0.00 -1.26 -4.99 105.19 107.39 3h3t n GLY 593 Ca 0.23 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.03 3h3t n GLY 593 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h3t s LYS 594 N -3.80 3.10 0.67 1.61 1.02 -0.28 -5.09 119.74 116.96 3h3t s LYS 594 Ca 0.00 -0.93 -0.17 0.00 0.02 0.00 0.00 55.97 54.89 3h3t s LYS 594 Cb 0.00 -2.69 -0.02 0.00 -0.52 0.00 0.00 37.83 34.60 3h3t s LYS 594 CO 0.00 0.42 0.95 -2.30 -0.92 0.00 0.00 175.35 173.50 3h3t n PRO 595 N -1.14 0.69 -3.29 -1.68 -0.02 -1.26 -4.94 135.00 123.36 3h3t n PRO 595 Ca -0.08 0.28 -0.39 0.00 -2.02 0.00 0.00 63.50 61.29 3h3t n PRO 595 Cb 0.57 -2.19 -0.07 0.00 -0.02 0.00 0.00 33.50 31.80 3h3t n PRO 595 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3h3t s ILE 596 N -1.66 5.14 -0.59 4.25 1.01 -1.26 -5.03 121.20 123.05 3h3t s ILE 596 Ca 0.75 0.89 -0.18 0.00 0.00 0.00 0.00 60.65 62.11 3h3t s ILE 596 Cb -0.38 -3.81 0.11 0.00 0.01 0.00 0.00 42.46 38.39 3h3t s ILE 596 CO 0.48 0.21 0.66 -0.22 0.00 0.00 0.00 174.94 176.07 3h3t s LEU 597 N 1.45 5.61 0.00 2.97 2.96 -1.26 -5.16 118.68 125.25 3h3t s LEU 597 Ca 0.23 -1.55 0.26 0.00 -0.22 0.00 0.00 54.13 52.85 3h3t s LEU 597 Cb -0.15 -2.28 1.57 0.00 0.50 0.00 0.00 46.19 45.83 3h3t s LEU 597 CO 0.09 -1.05 1.92 0.49 -1.32 0.00 0.00 176.35 176.49