#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3q n THR 364 N 0.00 1.70 -0.79 2.61 -1.04 -1.26 -5.01 114.28 110.48 3h3q n THR 364 Ca 0.00 -0.52 -0.30 0.00 -2.04 0.00 0.00 64.05 61.19 3h3q n THR 364 Cb 0.00 -1.76 0.19 0.00 -1.82 0.00 0.00 70.33 66.94 3h3q n THR 364 CO 0.00 0.00 0.00 -1.38 -0.64 0.00 0.00 175.07 173.05 3h3q s HIS 365 N -2.52 1.72 -1.42 -1.42 -0.00 -1.26 -4.88 115.29 105.52 3h3q s HIS 365 Ca -0.26 1.39 0.25 0.00 -0.00 0.00 0.00 55.06 56.44 3h3q s HIS 365 Cb 0.07 -3.19 1.27 0.00 -0.00 0.00 0.00 32.58 30.73 3h3q s HIS 365 CO 0.71 -3.11 1.85 2.89 -0.00 0.00 0.00 174.74 177.07 3h3q n ARG 366 N -4.40 0.35 -0.21 -0.38 1.85 -1.26 -2.98 116.66 109.63 3h3q n ARG 366 Ca 0.07 0.05 0.09 0.00 -1.00 0.00 0.00 57.85 57.05 3h3q n ARG 366 Cb 0.54 -1.50 0.20 0.00 -1.05 0.00 0.00 32.46 30.65 3h3q n ARG 366 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3h3q n PHE 367 N -1.29 0.55 -0.33 2.89 3.72 -1.26 -4.61 117.46 117.13 3h3q n PHE 367 Ca 0.12 -0.38 -0.01 0.00 -0.05 0.00 0.00 57.45 57.13 3h3q n PHE 367 Cb 0.20 -0.01 0.13 0.00 -0.94 0.00 0.00 39.48 38.86 3h3q n PHE 367 CO 0.00 0.00 0.00 -0.39 -0.05 0.00 0.00 176.76 176.32 3h3q h VAL 368 N 3.23 1.13 -0.40 -4.37 -1.51 -1.90 -0.40 116.25 112.04 3h3q h VAL 368 Ca 0.00 -0.38 -0.08 0.00 -1.23 0.00 0.00 66.70 65.01 3h3q h VAL 368 Cb 0.83 -0.08 -0.01 0.00 -2.13 0.00 0.00 31.29 29.90 3h3q h VAL 368 CO 0.00 0.20 -0.07 1.56 -1.23 0.00 0.00 177.57 178.03 3h3q h GLN 369 N 1.11 0.75 -0.49 5.19 1.08 -1.87 -2.31 115.11 118.58 3h3q h GLN 369 Ca 0.36 -0.27 -0.07 0.00 -1.45 0.00 0.00 58.65 57.22 3h3q h GLN 369 Cb 0.04 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.40 3h3q h GLN 369 CO -0.13 0.87 0.03 -0.22 -0.95 0.00 0.00 178.83 178.44 3h3q h LYS 370 N 0.57 0.84 -0.33 1.46 1.63 -1.75 -2.33 116.57 116.65 3h3q h LYS 370 Ca 0.10 -0.25 0.07 0.00 -0.85 0.00 0.00 60.65 59.72 3h3q h LYS 370 Cb 0.58 -0.08 -0.07 0.00 -0.60 0.00 0.00 32.23 32.05 3h3q h LYS 370 CO 0.03 0.86 -0.13 0.28 -3.45 0.00 0.00 179.45 177.05 3h3q h VAL 371 N 0.70 0.57 -0.79 2.00 2.07 -1.01 -1.08 116.25 118.71 3h3q h VAL 371 Ca 0.14 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.61 3h3q h VAL 371 Cb 0.46 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 3h3q h VAL 371 CO 0.02 0.00 0.31 -0.33 0.02 0.00 0.00 177.57 177.59 3h3q h GLU 372 N -0.07 1.19 -0.44 1.57 4.39 -1.20 -0.90 114.58 119.13 3h3q h GLU 372 Ca 0.17 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 3h3q h GLU 372 Cb 0.32 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 3h3q h GLU 372 CO -0.38 0.97 0.25 1.49 -1.16 0.00 0.00 179.01 180.18 3h3q h GLU 373 N 1.16 0.62 -0.46 2.33 4.81 -1.23 0.18 114.58 121.98 3h3q h GLU 373 Ca 0.26 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.37 3h3q h GLU 373 Cb 0.23 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 3h3q h GLU 373 CO -0.02 0.49 0.09 0.52 -0.73 0.00 0.00 179.01 179.36 3h3q h MET 374 N 0.58 0.75 -0.74 1.92 2.86 -0.49 -0.31 114.93 119.50 3h3q h MET 374 Ca 0.16 -0.19 -0.06 0.00 -2.06 0.00 0.00 59.70 57.54 3h3q h MET 374 Cb 0.05 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.58 3h3q h MET 374 CO -0.03 0.76 0.21 0.28 1.06 0.00 0.00 176.91 179.20 3h3q h VAL 375 N 0.62 1.26 -0.26 -2.22 2.07 -1.09 -0.70 116.25 115.93 3h3q h VAL 375 Ca 0.14 -0.94 -0.19 0.00 0.82 0.00 0.00 66.70 66.54 3h3q h VAL 375 Cb 0.36 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 3h3q h VAL 375 CO 0.01 0.37 -0.57 -0.61 0.02 0.00 0.00 177.57 176.78 3h3q h GLN 376 N 1.11 0.83 -0.32 1.57 5.75 -0.78 -0.08 115.11 123.18 3h3q h GLN 376 Ca 0.24 -0.54 -0.04 0.00 -0.15 0.00 0.00 58.65 58.16 3h3q h GLN 376 Cb 0.33 0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.94 3h3q h GLN 376 CO -0.00 1.17 0.05 -0.91 -2.65 0.00 0.00 178.83 176.48 3h3q h ASN 377 N 0.63 0.52 -0.59 -0.69 2.35 -0.90 -0.54 115.58 116.36 3h3q h ASN 377 Ca 0.01 -0.26 0.06 0.00 -0.55 0.00 0.00 56.30 55.55 3h3q h ASN 377 Cb 1.18 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 39.36 3h3q h ASN 377 CO 0.12 0.65 0.30 0.45 -1.65 0.00 0.00 177.43 177.31 3h3q h HIS 378 N 0.36 0.55 -0.04 1.19 3.86 -1.09 0.23 115.15 120.21 3h3q h HIS 378 Ca 0.10 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.28 3h3q h HIS 378 Cb 0.36 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.66 3h3q h HIS 378 CO 0.02 0.25 -0.20 0.52 0.86 0.00 0.00 177.93 179.39 3h3q h MET 379 N 0.57 0.07 0.03 2.45 2.86 -0.72 -0.76 114.93 119.42 3h3q h MET 379 Ca 0.27 -0.02 -0.36 0.00 -2.06 0.00 0.00 59.70 57.54 3h3q h MET 379 Cb 0.19 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.79 3h3q h MET 379 CO -0.19 0.27 -2.17 0.25 1.06 0.00 0.00 176.91 176.13 3h3q n THR 380 N -4.27 1.56 -0.10 2.22 -2.24 -0.23 -4.50 114.28 106.71 3h3q n THR 380 Ca -0.02 -0.72 -0.11 0.00 -2.27 0.00 0.00 64.05 60.93 3h3q n THR 380 Cb 0.28 -1.15 -0.15 0.00 -2.10 0.00 0.00 70.33 67.20 3h3q n THR 380 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3h3q n TYR 381 N -3.13 0.00 0.71 4.78 4.01 0.77 -4.39 117.16 119.91 3h3q n TYR 381 Ca -0.33 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.54 3h3q n TYR 381 Cb 1.06 -0.99 0.40 0.00 -0.31 0.00 0.00 39.34 39.50 3h3q n TYR 381 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 3h3q n SER 382 N -2.80 0.62 -0.00 7.72 7.64 -0.30 -3.46 113.62 123.04 3h3q n SER 382 Ca -0.34 0.43 0.03 0.00 1.01 0.00 0.00 58.87 60.00 3h3q n SER 382 Cb 1.14 -0.50 -0.12 0.00 -1.01 0.00 0.00 64.21 63.71 3h3q n SER 382 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3h3q n LEU 383 N -2.04 0.38 -3.57 -3.43 4.77 -1.22 -4.95 117.00 106.93 3h3q n LEU 383 Ca 0.05 0.16 -0.39 0.00 -0.03 0.00 0.00 56.01 55.81 3h3q n LEU 383 Cb 0.41 0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.61 3h3q n LEU 383 CO 0.31 0.14 -0.04 1.67 -1.33 0.00 0.00 177.39 178.14 3h3q n GLN 384 N -2.63 0.00 -2.78 3.23 7.27 -1.22 -4.86 117.38 116.39 3h3q n GLN 384 Ca -0.12 0.00 -0.40 0.00 0.07 0.00 0.00 57.00 56.55 3h3q n GLN 384 Cb 0.79 -0.81 -0.06 0.00 2.41 0.00 0.00 30.24 32.57 3h3q n GLN 384 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 3h3q s ASP 385 N -0.81 7.57 0.00 1.69 2.15 -1.26 -4.95 116.67 121.06 3h3q s ASP 385 Ca 0.52 1.86 0.00 0.00 0.43 0.00 0.00 52.55 55.36 3h3q s ASP 385 Cb -0.74 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.30 3h3q s ASP 385 CO 0.46 0.11 0.32 0.52 -0.17 0.00 0.00 175.17 176.41 3h3q n VAL 386 N 1.84 0.00 0.01 1.11 0.31 -1.26 -4.64 118.33 115.70 3h3q n VAL 386 Ca -0.01 -0.50 -0.10 0.00 -0.01 0.00 0.00 64.34 63.71 3h3q n VAL 386 Cb 0.48 1.00 -0.05 0.00 -0.91 0.00 0.00 33.84 34.36 3h3q n VAL 386 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3h3q h GLY 387 N 0.00 0.03 -2.49 2.92 0.00 -1.96 -3.01 103.07 98.56 3h3q h GLY 387 Ca 0.00 0.05 -0.04 0.00 0.00 0.00 0.00 47.33 47.34 3h3q h GLY 387 CO 0.00 -0.06 0.03 0.61 0.00 0.00 0.00 176.54 177.13 3h3q n GLY 388 N -1.17 3.74 3.59 4.60 0.00 -1.26 -4.89 105.19 109.81 3h3q n GLY 388 Ca -0.05 -1.02 -0.43 0.00 0.00 0.00 0.00 46.02 44.53 3h3q n GLY 388 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3h3q s ASP 389 N -1.52 6.64 0.06 1.61 -1.08 -1.14 -4.94 116.67 116.30 3h3q s ASP 389 Ca 0.48 0.47 0.21 0.00 -0.52 0.00 0.00 52.55 53.18 3h3q s ASP 389 Cb 0.38 -2.47 0.85 0.00 -1.46 0.00 0.00 42.92 40.22 3h3q s ASP 389 CO 0.11 -0.96 1.65 0.00 0.52 0.00 0.00 175.17 176.49 3h3q n ALA 390 N 7.01 1.88 1.28 3.66 0.00 -1.26 -1.50 120.51 131.58 3h3q n ALA 390 Ca 0.08 -0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.62 3h3q n ALA 390 Cb 0.48 -1.34 0.59 0.00 0.00 0.00 0.00 19.45 19.19 3h3q n ALA 390 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3h3q n ASN 391 N -1.69 0.30 -4.56 0.00 4.13 -1.26 -4.82 115.26 107.36 3h3q n ASN 391 Ca 0.04 -0.24 -0.34 0.00 1.68 0.00 0.00 54.58 55.72 3h3q n ASN 391 Cb 0.24 -0.15 -0.12 0.00 -1.54 0.00 0.00 39.78 38.21 3h3q n ASN 391 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 3h3q s TRP 392 N -2.66 2.90 -0.08 3.10 0.52 -0.56 -4.31 118.94 117.85 3h3q s TRP 392 Ca 0.23 -0.02 0.05 0.00 0.02 0.00 0.00 56.10 56.39 3h3q s TRP 392 Cb 0.20 -1.71 -0.00 0.00 -1.15 0.00 0.00 33.47 30.81 3h3q s TRP 392 CO 0.51 0.30 -0.24 -1.14 0.02 0.00 0.00 176.95 176.40 3h3q s GLN 393 N -0.76 2.76 -0.44 4.98 0.74 -0.69 -4.82 119.66 121.43 3h3q s GLN 393 Ca 0.12 -0.87 -0.29 0.00 0.05 0.00 0.00 55.36 54.37 3h3q s GLN 393 Cb -0.11 -2.19 0.01 0.00 1.10 0.00 0.00 33.01 31.82 3h3q s GLN 393 CO 0.01 0.26 1.40 -1.17 -0.55 0.00 0.00 175.29 175.24 3h3q s LEU 394 N 0.14 3.55 -0.05 3.68 2.96 -1.26 -1.47 118.68 126.23 3h3q s LEU 394 Ca -0.12 0.72 0.17 0.00 -0.22 0.00 0.00 54.13 54.67 3h3q s LEU 394 Cb -0.16 -3.46 -0.25 0.00 0.50 0.00 0.00 46.19 42.82 3h3q s LEU 394 CO 0.06 -1.48 0.31 1.33 -1.32 0.00 0.00 176.35 175.26 3h3q n VAL 395 N 7.05 0.22 -3.76 1.68 0.24 0.62 -4.94 118.33 119.43 3h3q n VAL 395 Ca 0.16 -0.45 -0.15 0.00 -2.04 0.00 0.00 64.34 61.86 3h3q n VAL 395 Cb 0.48 -0.03 -0.16 0.00 -1.47 0.00 0.00 33.84 32.66 3h3q n VAL 395 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3h3q s VAL 396 N -3.03 -0.06 0.02 3.34 1.01 -1.02 -4.99 120.40 115.67 3h3q s VAL 396 Ca -0.07 0.23 0.04 0.00 0.00 0.00 0.00 61.98 62.18 3h3q s VAL 396 Cb 0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 36.38 36.34 3h3q s VAL 396 CO 0.70 0.09 -0.12 -0.70 0.00 0.00 0.00 175.10 175.08 3h3q s GLU 397 N 1.18 0.83 -0.30 2.72 2.12 -1.26 -0.76 118.70 123.23 3h3q s GLU 397 Ca -0.08 -0.57 -0.10 0.00 0.36 0.00 0.00 54.97 54.58 3h3q s GLU 397 Cb -0.13 -0.80 0.18 0.00 0.26 0.00 0.00 34.13 33.64 3h3q s GLU 397 CO -0.04 0.21 0.95 -2.00 -0.54 0.00 0.00 175.26 173.84 3h3q s GLU 398 N -0.77 0.27 6.27 4.30 2.12 -0.32 -5.01 118.70 125.56 3h3q s GLU 398 Ca 0.01 0.44 0.00 0.00 0.36 0.00 0.00 54.97 55.79 3h3q s GLU 398 Cb -0.06 0.24 0.00 0.00 0.26 0.00 0.00 34.13 34.57 3h3q s GLU 398 CO 0.00 -0.32 0.00 0.41 -0.54 0.00 0.00 175.26 174.81 3h3q n GLY 399 N 5.43 2.37 0.00 -1.50 0.00 -1.26 -1.61 105.19 108.61 3h3q n GLY 399 Ca -0.04 -0.43 0.14 0.00 0.00 0.00 0.00 46.02 45.70 3h3q n GLY 399 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h3q n GLU 400 N 13.38 0.75 -3.28 1.61 -0.58 -1.26 -4.82 120.64 126.43 3h3q n GLU 400 Ca 0.00 0.01 -0.38 0.00 -0.42 0.00 0.00 57.16 56.36 3h3q n GLU 400 Cb 0.00 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.31 3h3q n GLU 400 CO 0.00 0.00 0.00 1.41 -0.48 0.00 0.00 177.13 178.06 3h3q s MET 401 N -2.19 4.31 0.01 3.49 1.75 -0.63 -3.95 119.30 122.09 3h3q s MET 401 Ca 0.38 0.47 0.04 0.00 -1.25 0.00 0.00 55.69 55.33 3h3q s MET 401 Cb 0.20 -3.47 -0.01 0.00 2.84 0.00 0.00 34.83 34.39 3h3q s MET 401 CO 0.37 0.08 -0.11 0.15 -0.65 0.00 0.00 175.02 174.86 3h3q s LYS 402 N 0.88 0.83 -0.11 4.11 1.02 -0.57 -1.17 119.74 124.73 3h3q s LYS 402 Ca 0.26 -0.51 -0.00 0.00 0.02 0.00 0.00 55.97 55.74 3h3q s LYS 402 Cb -0.15 -0.79 0.02 0.00 -0.52 0.00 0.00 37.83 36.39 3h3q s LYS 402 CO 0.11 0.21 -0.08 0.08 -0.92 0.00 0.00 175.35 174.74 3h3q s VAL 403 N -0.52 1.02 0.20 3.17 1.01 0.06 -1.36 120.40 123.98 3h3q s VAL 403 Ca 0.02 -0.30 0.08 0.00 0.00 0.00 0.00 61.98 61.78 3h3q s VAL 403 Cb -0.06 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 3h3q s VAL 403 CO 0.00 0.36 -0.01 -0.31 0.00 0.00 0.00 175.10 175.15 3h3q s TYR 404 N 1.60 2.80 0.01 5.22 2.02 0.21 -0.28 117.35 128.93 3h3q s TYR 404 Ca 0.03 -0.16 -0.01 0.00 -0.37 0.00 0.00 57.07 56.55 3h3q s TYR 404 Cb -0.13 -1.33 -0.01 0.00 -0.40 0.00 0.00 41.96 40.09 3h3q s TYR 404 CO -0.07 0.54 0.00 -0.98 -1.57 0.00 0.00 175.55 173.47 3h3q s ARG 405 N -3.12 0.26 -0.19 -0.62 1.70 -0.54 -0.92 118.95 115.52 3h3q s ARG 405 Ca 0.28 -0.43 -0.06 0.00 -0.47 0.00 0.00 55.73 55.06 3h3q s ARG 405 Cb -0.09 0.10 -0.03 0.00 -0.57 0.00 0.00 34.95 34.36 3h3q s ARG 405 CO 0.19 -0.05 0.02 0.50 -1.08 0.00 0.00 175.30 174.88 3h3q s ARG 406 N -1.09 3.71 -0.44 3.89 3.52 0.02 -1.70 118.95 126.85 3h3q s ARG 406 Ca -0.12 -0.48 -0.29 0.00 -0.13 0.00 0.00 55.73 54.72 3h3q s ARG 406 Cb -0.07 -3.11 0.02 0.00 -1.56 0.00 0.00 34.95 30.23 3h3q s ARG 406 CO -0.00 0.09 1.18 -1.21 -0.81 0.00 0.00 175.30 174.54 3h3q s GLU 407 N 0.82 3.75 -0.02 5.12 2.02 -1.26 -3.13 118.70 126.00 3h3q s GLU 407 Ca 0.01 0.70 0.02 0.00 0.02 0.00 0.00 54.97 55.72 3h3q s GLU 407 Cb -0.14 -3.90 0.01 0.00 0.10 0.00 0.00 34.13 30.19 3h3q s GLU 407 CO 0.02 -1.35 -0.05 0.08 0.02 0.00 0.00 175.26 173.98 3h3q s VAL 408 N 4.51 0.50 0.02 2.63 1.01 -1.26 -4.96 120.40 122.84 3h3q s VAL 408 Ca 0.50 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 62.31 3h3q s VAL 408 Cb -0.09 -0.46 -0.01 0.00 0.00 0.00 0.00 36.38 35.81 3h3q s VAL 408 CO 0.30 0.17 -0.12 -1.83 0.00 0.00 0.00 175.10 173.62 3h3q s GLU 409 N 0.26 0.86 -0.15 2.72 4.04 -1.26 -0.28 118.70 124.90 3h3q s GLU 409 Ca -0.03 -0.57 0.00 0.00 0.04 0.00 0.00 54.97 54.42 3h3q s GLU 409 Cb -0.07 -0.83 0.02 0.00 0.02 0.00 0.00 34.13 33.27 3h3q s GLU 409 CO -0.00 0.22 -0.12 -1.21 -1.84 0.00 0.00 175.26 172.30 3h3q s GLU 410 N -0.72 2.12 -1.19 -4.83 2.02 -0.51 -4.79 118.70 110.80 3h3q s GLU 410 Ca 0.02 -0.52 -0.04 0.00 0.02 0.00 0.00 54.97 54.44 3h3q s GLU 410 Cb -0.06 -2.03 0.00 0.00 0.10 0.00 0.00 34.13 32.14 3h3q s GLU 410 CO 0.00 -0.26 0.59 0.09 0.02 0.00 0.00 175.26 175.71 3h3q n ASN 411 N 4.80 -5.25 0.00 -0.19 5.03 -1.26 -2.06 115.26 116.32 3h3q n ASN 411 Ca -0.16 -0.27 0.00 0.00 0.87 0.00 0.00 54.58 55.02 3h3q n ASN 411 Cb 0.50 -4.04 0.00 0.00 -1.02 0.00 0.00 39.78 35.22 3h3q n ASN 411 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h3q n GLY 412 N -1.45 0.53 3.66 7.41 0.00 -1.26 -5.01 105.19 109.08 3h3q n GLY 412 Ca -0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 3h3q n GLY 412 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3q s ILE 413 N -2.56 5.14 -0.14 -0.61 1.09 -0.88 -4.78 121.20 118.46 3h3q s ILE 413 Ca 0.00 0.86 -0.29 0.00 -1.10 0.00 0.00 60.65 60.11 3h3q s ILE 413 Cb 0.00 -3.80 -0.02 0.00 -1.06 0.00 0.00 42.46 37.58 3h3q s ILE 413 CO 0.00 0.20 1.22 -0.69 -0.10 0.00 0.00 174.94 175.57 3h3q s VAL 414 N 1.55 4.33 -0.58 2.92 1.01 -1.26 -1.42 120.40 126.93 3h3q s VAL 414 Ca 0.22 1.62 0.05 0.00 0.00 0.00 0.00 61.98 63.87 3h3q s VAL 414 Cb -0.15 -4.04 0.03 0.00 0.00 0.00 0.00 36.38 32.21 3h3q s VAL 414 CO 0.09 -0.10 0.58 0.18 0.00 0.00 0.00 175.10 175.85 3h3q n LEU 415 N 6.19 1.22 0.00 3.92 4.77 0.62 -4.46 117.00 129.25 3h3q n LEU 415 Ca 0.13 -0.91 0.00 0.00 -0.03 0.00 0.00 56.01 55.20 3h3q n LEU 415 Cb 0.45 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 3h3q n LEU 415 CO 0.55 0.26 0.00 0.47 -1.33 0.00 0.00 177.39 177.34 3h3q n ASP 416 N 0.04 0.00 -4.66 -1.43 9.92 -1.03 -4.42 116.55 114.97 3h3q n ASP 416 Ca 0.03 0.00 -0.43 0.00 -0.53 0.00 0.00 54.79 53.86 3h3q n ASP 416 Cb 0.12 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.60 3h3q n ASP 416 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 3h3q n PRO 417 N 0.00 1.83 -4.82 -0.24 -0.02 -1.18 -4.73 135.00 125.84 3h3q n PRO 417 Ca 0.00 0.64 -0.27 0.00 -2.02 0.00 0.00 63.50 61.86 3h3q n PRO 417 Cb 0.00 -2.17 -0.16 0.00 -0.02 0.00 0.00 33.50 31.15 3h3q n PRO 417 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3h3q s LEU 418 N -0.60 1.85 -0.09 2.45 0.20 -0.76 -0.80 118.68 120.93 3h3q s LEU 418 Ca 0.57 -0.37 0.01 0.00 0.69 0.00 0.00 54.13 55.03 3h3q s LEU 418 Cb -0.60 -1.00 0.02 0.00 -0.43 0.00 0.00 46.19 44.18 3h3q s LEU 418 CO 0.61 0.11 -0.11 -0.75 -0.29 0.00 0.00 176.35 175.93 3h3q s LYS 419 N 0.30 1.68 0.01 1.98 2.20 -0.10 -0.96 119.74 124.85 3h3q s LYS 419 Ca -0.10 -0.36 0.06 0.00 -0.36 0.00 0.00 55.97 55.21 3h3q s LYS 419 Cb -0.14 -1.53 -0.03 0.00 -1.51 0.00 0.00 37.83 34.62 3h3q s LYS 419 CO 0.04 -0.11 -0.17 0.00 -0.36 0.00 0.00 175.35 174.75 3h3q s ALA 420 N 1.14 2.61 0.03 3.13 0.00 0.81 0.67 121.76 130.15 3h3q s ALA 420 Ca -0.05 -1.12 0.09 0.00 0.00 0.00 0.00 51.96 50.87 3h3q s ALA 420 Cb -0.14 -0.81 -0.03 0.00 0.00 0.00 0.00 23.12 22.14 3h3q s ALA 420 CO -0.02 0.57 -0.25 0.95 0.00 0.00 0.00 175.76 177.00 3h3q s THR 421 N -0.86 2.04 0.16 0.00 -4.23 -0.46 0.19 115.64 112.48 3h3q s THR 421 Ca 0.14 -1.29 -0.09 0.00 -1.18 0.00 0.00 61.69 59.26 3h3q s THR 421 Cb -0.11 -1.74 -0.01 0.00 1.34 0.00 0.00 72.50 71.99 3h3q s THR 421 CO 0.04 0.39 0.28 -2.28 -0.54 0.00 0.00 174.62 172.50 3h3q s HIS 422 N -0.76 0.37 -0.05 3.99 2.46 0.22 -1.51 115.29 120.01 3h3q s HIS 422 Ca 0.11 -0.74 -0.02 0.00 0.47 0.00 0.00 55.06 54.88 3h3q s HIS 422 Cb -0.10 -0.05 0.04 0.00 -0.13 0.00 0.00 32.58 32.34 3h3q s HIS 422 CO 0.01 -0.71 0.10 0.00 -2.47 0.00 0.00 174.74 171.67 3h3q s ALA 423 N -3.96 0.05 -0.18 1.58 0.00 -1.25 -0.23 121.76 117.77 3h3q s ALA 423 Ca 0.16 0.36 0.01 0.00 0.00 0.00 0.00 51.96 52.49 3h3q s ALA 423 Cb 0.03 -0.63 0.03 0.00 0.00 0.00 0.00 23.12 22.55 3h3q s ALA 423 CO -0.01 -0.45 -0.16 0.08 0.00 0.00 0.00 175.76 175.22 3h3q s VAL 424 N 2.02 1.84 0.32 0.00 1.01 0.14 -4.77 120.40 120.97 3h3q s VAL 424 Ca 0.02 -0.92 -0.27 0.00 0.00 0.00 0.00 61.98 60.80 3h3q s VAL 424 Cb -0.12 -1.75 -0.09 0.00 0.00 0.00 0.00 36.38 34.41 3h3q s VAL 424 CO -0.04 0.39 1.04 -0.75 0.00 0.00 0.00 175.10 175.74 3h3q s LYS 425 N 1.35 4.49 0.00 2.72 2.20 -1.26 -0.42 119.74 128.82 3h3q s LYS 425 Ca 0.03 1.59 0.00 0.00 -0.36 0.00 0.00 55.97 57.22 3h3q s LYS 425 Cb -0.14 -2.91 0.00 0.00 -1.51 0.00 0.00 37.83 33.27 3h3q s LYS 425 CO -0.11 0.14 0.00 0.41 -0.36 0.00 0.00 175.35 175.43 3h3q n GLY 426 N 0.83 0.73 3.15 5.54 0.00 -0.33 -4.91 105.19 110.19 3h3q n GLY 426 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 3h3q n GLY 426 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h3q s VAL 427 N -2.18 0.74 0.38 1.61 -7.23 -1.25 -4.88 120.40 107.58 3h3q s VAL 427 Ca 0.00 -1.70 0.04 0.00 -1.81 0.00 0.00 61.98 58.51 3h3q s VAL 427 Cb 0.00 -1.40 -0.01 0.00 0.56 0.00 0.00 36.38 35.54 3h3q s VAL 427 CO 0.00 -0.70 0.54 0.42 -0.31 0.00 0.00 175.10 175.06 3h3q s THR 428 N -2.88 4.10 0.24 5.32 -4.23 -1.26 -3.14 115.64 113.80 3h3q s THR 428 Ca 0.06 -0.80 -0.05 0.00 -1.18 0.00 0.00 61.69 59.72 3h3q s THR 428 Cb 0.00 -3.46 0.19 0.00 1.34 0.00 0.00 72.50 70.57 3h3q s THR 428 CO -0.02 -0.24 1.83 1.23 -0.54 0.00 0.00 174.62 176.88 3h3q h GLY 429 N 0.71 1.22 0.90 3.99 0.00 -1.85 -1.59 103.07 106.45 3h3q h GLY 429 Ca -0.46 -0.61 0.02 0.00 0.00 0.00 0.00 47.33 46.28 3h3q h GLY 429 CO 0.55 0.58 0.32 0.84 0.00 0.00 0.00 176.54 178.83 3h3q h HIS 430 N 1.12 0.60 -0.33 5.60 -0.00 -1.87 -1.28 115.15 118.99 3h3q h HIS 430 Ca 0.27 0.02 -0.03 0.00 -0.00 0.00 0.00 60.37 60.63 3h3q h HIS 430 Cb 0.14 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 27.34 3h3q h HIS 430 CO 0.01 0.35 0.10 0.93 -0.00 0.00 0.00 177.93 179.33 3h3q h GLU 431 N 0.64 0.51 -0.47 5.26 5.08 -1.65 -0.66 114.58 123.29 3h3q h GLU 431 Ca 0.21 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.42 3h3q h GLU 431 Cb -0.00 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 3h3q h GLU 431 CO -0.08 0.55 0.15 0.28 -1.00 0.00 0.00 179.01 178.90 3h3q h VAL 432 N 0.38 1.23 -0.52 3.13 2.07 -1.11 -1.35 116.25 120.07 3h3q h VAL 432 Ca 0.11 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 3h3q h VAL 432 Cb 0.25 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3h3q h VAL 432 CO -0.00 0.28 0.26 0.00 0.02 0.00 0.00 177.57 178.12 3h3q h ASN 434 N 0.69 -0.53 -0.80 0.00 -0.26 -0.80 -1.12 115.58 112.76 3h3q h ASN 434 Ca 0.18 0.08 -0.01 0.00 -0.56 0.00 0.00 56.30 55.99 3h3q h ASN 434 Cb 0.09 0.22 -0.04 0.00 -1.06 0.00 0.00 38.32 37.54 3h3q h ASN 434 CO -0.02 -0.25 0.48 1.88 -1.06 0.00 0.00 177.43 178.46 3h3q h TYR 435 N -0.30 1.06 -0.56 1.19 -1.99 -1.24 -1.42 116.97 113.72 3h3q h TYR 435 Ca 0.05 -0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.73 3h3q h TYR 435 Cb 0.37 -0.35 -0.03 0.00 2.00 0.00 0.00 36.73 38.72 3h3q h TYR 435 CO -0.23 0.71 0.15 0.35 -0.00 0.00 0.00 178.16 179.14 3h3q h PHE 436 N 1.11 0.88 0.05 4.88 3.57 -0.46 -3.28 116.94 123.69 3h3q h PHE 436 Ca 0.29 -0.08 -0.31 0.00 3.53 0.00 0.00 57.97 61.40 3h3q h PHE 436 Cb -0.04 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 38.41 3h3q h PHE 436 CO 0.00 0.73 -1.73 2.35 -2.23 0.00 0.00 178.31 177.43 3h3q h TRP 437 N 0.83 0.19 -2.71 0.41 7.01 -1.02 -3.47 115.95 117.18 3h3q h TRP 437 Ca 0.18 -0.14 -0.57 0.00 2.11 0.00 0.00 58.89 60.48 3h3q h TRP 437 Cb 0.28 -0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.31 3h3q h TRP 437 CO 0.02 1.26 1.15 1.21 -2.79 0.00 0.00 178.44 179.29 3h3q s ASN 438 N -6.49 6.32 0.49 2.65 2.47 -0.55 -4.86 114.94 114.97 3h3q s ASN 438 Ca -0.10 1.66 0.32 0.00 0.42 0.00 0.00 52.86 55.17 3h3q s ASN 438 Cb 0.08 -2.53 1.38 0.00 -1.45 0.00 0.00 41.25 38.73 3h3q s ASN 438 CO 0.81 -1.30 1.95 -0.37 -3.72 0.00 0.00 177.10 174.48 3h3q h VAL 439 N 6.19 0.00 0.00 -5.21 -1.51 -1.90 -2.92 116.25 110.90 3h3q h VAL 439 Ca -0.35 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 64.74 3h3q h VAL 439 Cb 1.16 1.31 0.00 0.00 -2.13 0.00 0.00 31.29 31.63 3h3q h VAL 439 CO 1.00 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 177.81 3h3q n ASP 440 N -2.87 0.54 -0.19 4.19 8.00 -1.26 -2.36 116.55 122.60 3h3q n ASP 440 Ca 0.01 0.60 0.02 0.00 0.71 0.00 0.00 54.79 56.13 3h3q n ASP 440 Cb 0.26 -0.73 0.04 0.00 -0.02 0.00 0.00 41.12 40.66 3h3q n ASP 440 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3h3q n VAL 441 N -2.06 0.49 -0.25 2.53 0.24 -1.11 -4.79 118.33 113.38 3h3q n VAL 441 Ca 0.04 -0.74 0.02 0.00 -2.04 0.00 0.00 64.34 61.61 3h3q n VAL 441 Cb 0.27 0.80 0.14 0.00 -1.47 0.00 0.00 33.84 33.59 3h3q n VAL 441 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3h3q h ARG 442 N 0.75 0.59 0.00 7.34 9.65 -1.49 -1.20 114.38 130.01 3h3q h ARG 442 Ca 0.00 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 3h3q h ARG 442 Cb 0.37 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.82 3h3q h ARG 442 CO 0.00 0.39 0.00 0.09 2.80 0.00 0.00 179.97 183.25 3h3q n ASN 443 N -4.86 0.00 0.24 -3.80 5.03 -1.26 -0.95 115.26 109.65 3h3q n ASN 443 Ca 0.11 0.26 0.13 0.00 0.87 0.00 0.00 54.58 55.95 3h3q n ASN 443 Cb 0.28 -0.41 0.45 0.00 -1.02 0.00 0.00 39.78 39.08 3h3q n ASN 443 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 3h3q h ASP 444 N 0.00 0.00 0.00 6.41 3.32 -1.56 -3.40 116.42 121.19 3h3q h ASP 444 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3h3q h ASP 444 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3h3q h ASP 444 CO 0.00 0.11 -0.43 -2.67 -1.72 0.00 0.00 179.24 174.53 3h3q n TRP 445 N -3.19 0.00 -2.27 4.55 4.27 -0.92 -5.07 117.44 114.81 3h3q n TRP 445 Ca 0.01 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.21 3h3q n TRP 445 Cb 0.43 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.35 3h3q n TRP 445 CO 0.00 0.00 0.00 -2.00 -2.29 0.00 0.00 177.69 173.40 3h3q s GLU 446 N -1.43 4.38 0.00 -2.67 2.56 -0.13 -4.78 118.70 116.64 3h3q s GLU 446 Ca 0.00 1.96 0.00 0.00 0.00 0.00 0.00 54.97 56.93 3h3q s GLU 446 Cb 0.00 -3.26 0.00 0.00 2.00 0.00 0.00 34.13 32.87 3h3q s GLU 446 CO 0.00 -0.31 0.49 0.25 -0.56 0.00 0.00 175.26 175.13 3h3q n THR 447 N 3.52 0.06 0.37 -1.70 -2.24 -1.26 -4.73 114.28 108.29 3h3q n THR 447 Ca 0.09 -0.48 0.08 0.00 -2.27 0.00 0.00 64.05 61.47 3h3q n THR 447 Cb 0.44 1.06 0.12 0.00 -2.10 0.00 0.00 70.33 69.85 3h3q n THR 447 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3h3q n THR 448 N -0.03 0.34 -4.01 4.28 -2.24 -1.26 -4.95 114.28 106.42 3h3q n THR 448 Ca 0.00 -0.67 -0.36 0.00 -2.27 0.00 0.00 64.05 60.75 3h3q n THR 448 Cb 0.04 1.06 -0.07 0.00 -2.10 0.00 0.00 70.33 69.26 3h3q n THR 448 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3h3q s ILE 449 N -1.25 5.19 -0.10 2.28 1.01 -1.26 -0.87 121.20 126.19 3h3q s ILE 449 Ca 0.25 0.06 -0.04 0.00 0.00 0.00 0.00 60.65 60.92 3h3q s ILE 449 Cb 0.15 -3.26 -0.01 0.00 0.01 0.00 0.00 42.46 39.35 3h3q s ILE 449 CO 0.22 0.60 -0.09 -0.08 0.00 0.00 0.00 174.94 175.59 3h3q h GLU 450 N 4.94 0.00 -4.35 2.79 4.81 -0.71 -3.42 114.58 118.64 3h3q h GLU 450 Ca -0.54 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 58.54 3h3q h GLU 450 Cb 1.22 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.45 3h3q h GLU 450 CO 0.58 0.00 -0.68 -0.80 -0.73 0.00 0.00 179.01 177.38 3h3q s ASN 451 N -5.26 0.59 0.11 1.04 0.01 -1.24 -5.00 114.94 105.19 3h3q s ASN 451 Ca -0.07 -1.04 -0.21 0.00 -0.71 0.00 0.00 52.86 50.83 3h3q s ASN 451 Cb 0.01 0.20 0.05 0.00 0.41 0.00 0.00 41.25 41.92 3h3q s ASN 451 CO 0.11 -0.60 0.51 0.72 -1.51 0.00 0.00 177.10 176.33 3h3q s PHE 452 N -3.88 -0.40 0.14 2.20 -0.12 -1.26 -0.80 117.98 113.85 3h3q s PHE 452 Ca 0.11 0.25 -0.13 0.00 -0.05 0.00 0.00 56.93 57.11 3h3q s PHE 452 Cb 0.07 0.39 0.02 0.00 -0.63 0.00 0.00 43.02 42.87 3h3q s PHE 452 CO -0.07 -0.73 0.35 -3.38 -0.05 0.00 0.00 175.22 171.34 3h3q s HIS 453 N -3.29 0.03 -0.22 3.49 -3.43 -0.21 -4.98 115.29 106.68 3h3q s HIS 453 Ca -0.01 -0.38 -0.21 0.00 -0.80 0.00 0.00 55.06 53.66 3h3q s HIS 453 Cb 0.00 0.15 -0.02 0.00 -1.43 0.00 0.00 32.58 31.28 3h3q s HIS 453 CO -0.09 -0.72 0.65 0.08 -2.00 0.00 0.00 174.74 172.67 3h3q s VAL 454 N -3.87 4.99 -0.05 -5.38 1.01 -1.26 -1.52 120.40 114.32 3h3q s VAL 454 Ca 0.08 1.21 -0.20 0.00 0.00 0.00 0.00 61.98 63.07 3h3q s VAL 454 Cb 0.02 -3.96 -0.31 0.00 0.00 0.00 0.00 36.38 32.13 3h3q s VAL 454 CO -0.07 0.06 0.84 0.58 0.00 0.00 0.00 175.10 176.51 3h3q h VAL 455 N 5.29 1.38 -2.86 2.92 2.07 -1.28 -3.48 116.25 120.29 3h3q h VAL 455 Ca -0.29 -2.53 -0.12 0.00 0.82 0.00 0.00 66.70 64.58 3h3q h VAL 455 Cb 1.13 3.08 -0.22 0.00 -1.52 0.00 0.00 31.29 33.76 3h3q h VAL 455 CO 0.78 0.73 -0.25 -0.70 0.02 0.00 0.00 177.57 178.15 3h3q s GLU 456 N -2.46 0.56 -0.31 1.57 2.12 -1.19 -4.99 118.70 114.00 3h3q s GLU 456 Ca -0.14 0.24 -0.12 0.00 0.36 0.00 0.00 54.97 55.32 3h3q s GLU 456 Cb 0.02 0.26 -0.03 0.00 0.26 0.00 0.00 34.13 34.64 3h3q s GLU 456 CO 0.83 -0.11 0.21 0.99 -0.54 0.00 0.00 175.26 176.64 3h3q s THR 457 N -0.44 5.23 -0.13 -1.70 2.01 -1.26 -0.06 115.64 119.28 3h3q s THR 457 Ca -0.06 -0.05 -0.09 0.00 0.31 0.00 0.00 61.69 61.80 3h3q s THR 457 Cb -0.04 -3.59 -0.25 0.00 0.01 0.00 0.00 72.50 68.64 3h3q s THR 457 CO 0.02 0.12 0.34 0.18 -0.69 0.00 0.00 174.62 174.59 3h3q n LEU 458 N 5.07 2.53 0.00 4.42 4.77 0.62 -4.99 117.00 129.43 3h3q n LEU 458 Ca -0.13 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 3h3q n LEU 458 Cb 0.51 -1.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.50 3h3q n LEU 458 CO 0.35 0.77 0.00 0.00 -1.33 0.00 0.00 177.39 177.18 3h3q n ALA 459 N -3.07 0.00 0.22 -1.18 0.00 -0.90 -4.61 120.51 110.97 3h3q n ALA 459 Ca -0.32 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.18 3h3q n ALA 459 Cb 0.99 0.00 0.52 0.00 0.00 0.00 0.00 19.45 20.96 3h3q n ALA 459 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3h3q h ASP 460 N 0.00 0.00 -0.23 0.00 3.45 -2.01 -3.17 116.42 114.45 3h3q h ASP 460 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3h3q h ASP 460 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 3h3q h ASP 460 CO 0.00 0.23 0.00 -0.46 -1.57 0.00 0.00 179.24 177.44 3h3q n ASN 461 N -4.01 2.65 -3.70 6.45 6.94 -1.26 -5.00 115.26 117.33 3h3q n ASN 461 Ca -0.02 -2.03 -0.11 0.00 -0.02 0.00 0.00 54.58 52.40 3h3q n ASN 461 Cb 0.30 -0.17 -0.12 0.00 -2.36 0.00 0.00 39.78 37.44 3h3q n ASN 461 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3h3q s ALA 462 N -1.05 -0.81 0.08 -2.53 0.00 -1.20 -1.35 121.76 114.91 3h3q s ALA 462 Ca 0.16 1.25 -0.05 0.00 0.00 0.00 0.00 51.96 53.32 3h3q s ALA 462 Cb 0.09 -0.86 -0.02 0.00 0.00 0.00 0.00 23.12 22.33 3h3q s ALA 462 CO 0.11 -0.33 0.10 0.96 0.00 0.00 0.00 175.76 176.59 3h3q s ILE 463 N 1.58 0.16 -0.08 0.00 -4.36 -0.77 -0.27 121.20 117.47 3h3q s ILE 463 Ca -0.07 -1.51 0.01 0.00 -0.26 0.00 0.00 60.65 58.81 3h3q s ILE 463 Cb -0.10 -1.51 -0.03 0.00 1.25 0.00 0.00 42.46 42.07 3h3q s ILE 463 CO -0.11 -0.75 -0.08 -0.63 0.24 0.00 0.00 174.94 173.62 3h3q s ILE 464 N -3.91 3.59 -0.03 8.37 1.01 0.92 -0.13 121.20 131.02 3h3q s ILE 464 Ca 0.08 -0.51 0.04 0.00 0.00 0.00 0.00 60.65 60.26 3h3q s ILE 464 Cb 0.06 -2.47 -0.00 0.00 0.01 0.00 0.00 42.46 40.06 3h3q s ILE 464 CO -0.09 0.58 -0.14 -0.63 0.00 0.00 0.00 174.94 174.67 3h3q s ILE 465 N -0.63 1.19 -0.09 2.92 1.01 0.13 -0.71 121.20 125.02 3h3q s ILE 465 Ca 0.09 -0.59 -0.01 0.00 0.00 0.00 0.00 60.65 60.14 3h3q s ILE 465 Cb -0.11 -1.03 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 3h3q s ILE 465 CO 0.02 0.35 -0.02 -0.47 0.00 0.00 0.00 174.94 174.82 3h3q s TYR 466 N 0.06 3.10 0.13 3.97 5.04 -0.57 -1.12 117.35 127.95 3h3q s TYR 466 Ca -0.03 0.10 -0.23 0.00 -2.44 0.00 0.00 57.07 54.48 3h3q s TYR 466 Cb -0.10 -1.79 0.06 0.00 0.35 0.00 0.00 41.96 40.48 3h3q s TYR 466 CO 0.01 0.38 0.57 1.14 -1.34 0.00 0.00 175.55 176.31 3h3q s GLN 467 N -0.72 1.20 -0.06 4.97 -2.07 -0.68 -1.04 119.66 121.26 3h3q s GLN 467 Ca 0.11 -0.42 0.05 0.00 -1.82 0.00 0.00 55.36 53.28 3h3q s GLN 467 Cb -0.12 0.55 -0.02 0.00 -1.09 0.00 0.00 33.01 32.34 3h3q s GLN 467 CO 0.02 -0.50 -0.21 0.95 -1.32 0.00 0.00 175.29 174.23 3h3q s THR 468 N -3.41 2.42 0.00 3.63 -4.23 0.02 -1.93 115.64 112.14 3h3q s THR 468 Ca -0.00 -0.94 -0.01 0.00 -1.18 0.00 0.00 61.69 59.56 3h3q s THR 468 Cb -0.00 -1.92 -0.04 0.00 1.34 0.00 0.00 72.50 71.88 3h3q s THR 468 CO -0.10 0.57 0.14 -1.00 -0.54 0.00 0.00 174.62 173.69 3h3q s HIS 469 N -0.25 3.44 0.83 3.99 3.76 0.00 -0.01 115.29 127.05 3h3q s HIS 469 Ca -0.00 0.28 -0.14 0.00 -0.15 0.00 0.00 55.06 55.05 3h3q s HIS 469 Cb -0.13 -1.78 0.05 0.00 1.11 0.00 0.00 32.58 31.82 3h3q s HIS 469 CO 0.03 0.60 0.83 1.63 -0.85 0.00 0.00 174.74 176.98 3h3q n LYS 470 N 0.95 0.05 -1.44 1.40 5.02 -0.05 -4.38 118.16 119.71 3h3q n LYS 470 Ca -0.11 0.08 -0.39 0.00 -2.02 0.00 0.00 58.31 55.87 3h3q n LYS 470 Cb 0.52 -2.14 -0.02 0.00 -0.02 0.00 0.00 35.03 33.38 3h3q n LYS 470 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3h3q n ARG 471 N -2.31 3.04 0.08 1.97 1.74 -1.26 -4.62 116.66 115.30 3h3q n ARG 471 Ca 0.11 -2.30 0.10 0.00 -0.77 0.00 0.00 57.85 54.99 3h3q n ARG 471 Cb 0.51 -3.00 0.42 0.00 -1.02 0.00 0.00 32.46 29.36 3h3q n ARG 471 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 3h3q n VAL 472 N 4.49 0.91 -4.07 1.55 0.24 -1.26 -4.71 118.33 115.48 3h3q n VAL 472 Ca 0.62 0.25 -0.26 0.00 -2.04 0.00 0.00 64.34 62.91 3h3q n VAL 472 Cb 0.31 -1.11 -0.05 0.00 -1.47 0.00 0.00 33.84 31.51 3h3q n VAL 472 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 3h3q s TRP 473 N -3.19 3.18 -1.19 6.34 0.51 -1.26 -4.94 118.94 118.38 3h3q s TRP 473 Ca 0.05 -0.01 -0.15 0.00 -2.12 0.00 0.00 56.10 53.87 3h3q s TRP 473 Cb 0.09 -1.53 -0.05 0.00 -0.81 0.00 0.00 33.47 31.17 3h3q s TRP 473 CO 0.33 0.52 2.21 -0.35 -0.51 0.00 0.00 176.95 179.16 3h3q n PRO 474 N -0.35 2.43 -2.81 4.98 -0.04 -1.26 -4.82 135.00 133.12 3h3q n PRO 474 Ca -0.08 -2.16 -0.02 0.00 -0.04 0.00 0.00 63.50 61.19 3h3q n PRO 474 Cb 0.55 -3.00 0.01 0.00 -0.04 0.00 0.00 33.50 31.02 3h3q n PRO 474 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h3q n ALA 475 N 5.99 -1.47 -1.53 0.55 0.00 -1.26 -4.77 120.51 118.02 3h3q n ALA 475 Ca 0.54 -0.63 -0.34 0.00 0.00 0.00 0.00 53.44 53.00 3h3q n ALA 475 Cb 0.34 0.39 0.06 0.00 0.00 0.00 0.00 19.45 20.24 3h3q n ALA 475 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3h3q s SER 476 N -2.39 4.85 0.35 0.00 0.01 -1.26 -4.95 113.70 110.30 3h3q s SER 476 Ca 0.13 2.23 -0.29 0.00 1.31 0.00 0.00 55.95 59.33 3h3q s SER 476 Cb -0.02 -2.58 -0.11 0.00 0.21 0.00 0.00 66.02 63.52 3h3q s SER 476 CO 0.04 -1.82 1.51 -1.58 0.41 0.00 0.00 173.24 171.80 3h3q s GLN 477 N -3.79 4.13 0.06 12.44 0.74 -1.26 -4.74 119.66 127.23 3h3q s GLN 477 Ca 0.72 2.55 -0.05 0.00 0.05 0.00 0.00 55.36 58.64 3h3q s GLN 477 Cb -0.26 -2.99 -0.05 0.00 1.10 0.00 0.00 33.01 30.81 3h3q s GLN 477 CO 0.40 -0.54 0.29 1.03 -0.55 0.00 0.00 175.29 175.91 3h3q s ARG 478 N -1.62 3.56 0.38 1.67 3.00 -1.26 -0.49 118.95 124.20 3h3q s ARG 478 Ca 0.56 -0.16 0.04 0.00 0.00 0.00 0.00 55.73 56.17 3h3q s ARG 478 Cb -0.46 -3.00 -0.06 0.00 0.00 0.00 0.00 34.95 31.43 3h3q s ARG 478 CO 0.58 0.59 0.05 0.16 0.00 0.00 0.00 175.30 176.68 3h3q s ASP 479 N -2.10 3.04 -0.11 0.23 -4.77 -0.04 -0.82 116.67 112.10 3h3q s ASP 479 Ca 0.33 -1.45 -0.17 0.00 -3.30 0.00 0.00 52.55 47.96 3h3q s ASP 479 Cb -0.13 -0.01 0.04 0.00 -1.09 0.00 0.00 42.92 41.73 3h3q s ASP 479 CO 0.21 -0.64 0.44 -0.69 0.70 0.00 0.00 175.17 175.19 3h3q s VAL 480 N -3.08 0.02 -0.09 2.11 1.01 -0.81 -0.28 120.40 119.28 3h3q s VAL 480 Ca 0.31 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.14 3h3q s VAL 480 Cb 0.07 -0.68 0.03 0.00 0.00 0.00 0.00 36.38 35.80 3h3q s VAL 480 CO 0.15 -0.07 -0.04 -0.22 0.00 0.00 0.00 175.10 174.91 3h3q s LEU 481 N -0.38 0.95 -0.03 3.92 2.96 -1.26 -1.69 118.68 123.15 3h3q s LEU 481 Ca -0.05 -0.19 -0.12 0.00 -0.22 0.00 0.00 54.13 53.55 3h3q s LEU 481 Cb -0.03 -0.63 0.02 0.00 0.50 0.00 0.00 46.19 46.05 3h3q s LEU 481 CO 0.03 -0.14 0.25 -0.72 -1.32 0.00 0.00 176.35 174.45 3h3q s TYR 482 N 1.71 -0.14 0.13 5.38 -0.85 -0.27 -1.86 117.35 121.45 3h3q s TYR 482 Ca 0.03 0.25 -0.30 0.00 -0.52 0.00 0.00 57.07 56.53 3h3q s TYR 482 Cb -0.13 0.06 -0.06 0.00 0.38 0.00 0.00 41.96 42.21 3h3q s TYR 482 CO -0.06 -0.31 0.94 -1.17 -1.52 0.00 0.00 175.55 173.43 3h3q s LEU 483 N -1.06 4.53 -0.14 -3.49 0.20 -0.06 0.18 118.68 118.84 3h3q s LEU 483 Ca -0.11 1.80 0.00 0.00 0.69 0.00 0.00 54.13 56.50 3h3q s LEU 483 Cb -0.05 -3.56 0.03 0.00 -0.43 0.00 0.00 46.19 42.17 3h3q s LEU 483 CO 0.03 -0.01 -0.11 -0.55 -0.29 0.00 0.00 176.35 175.41 3h3q s SER 484 N -0.25 2.58 -0.03 3.68 0.15 0.82 -1.61 113.70 119.03 3h3q s SER 484 Ca 0.45 -0.46 0.02 0.00 0.70 0.00 0.00 55.95 56.66 3h3q s SER 484 Cb -0.24 -1.06 0.01 0.00 -1.71 0.00 0.00 66.02 63.02 3h3q s SER 484 CO 0.30 -0.09 -0.09 0.54 1.20 0.00 0.00 173.24 175.10 3h3q s VAL 485 N 1.56 0.80 -0.18 4.45 0.11 -0.22 -1.84 120.40 125.09 3h3q s VAL 485 Ca 0.04 -0.36 -0.04 0.00 -2.93 0.00 0.00 61.98 58.69 3h3q s VAL 485 Cb -0.13 -0.72 -0.02 0.00 -1.53 0.00 0.00 36.38 33.97 3h3q s VAL 485 CO -0.10 0.26 -0.03 -0.51 -3.33 0.00 0.00 175.10 171.39 3h3q s ILE 486 N 0.27 3.84 0.04 7.04 2.07 -0.46 -1.26 121.20 132.73 3h3q s ILE 486 Ca -0.05 -0.36 0.01 0.00 -1.41 0.00 0.00 60.65 58.84 3h3q s ILE 486 Cb -0.10 -2.71 -0.02 0.00 0.13 0.00 0.00 42.46 39.76 3h3q s ILE 486 CO 0.01 0.46 -0.06 -0.13 -1.91 0.00 0.00 174.94 173.31 3h3q s ARG 487 N 0.74 0.45 -0.13 3.50 0.52 0.08 -4.84 118.95 119.27 3h3q s ARG 487 Ca -0.01 -0.73 -0.04 0.00 -0.52 0.00 0.00 55.73 54.43 3h3q s ARG 487 Cb -0.14 -0.12 -0.03 0.00 0.52 0.00 0.00 34.95 35.17 3h3q s ARG 487 CO 0.02 0.00 0.02 0.21 0.02 0.00 0.00 175.30 175.58 3h3q s LYS 488 N -1.65 3.41 -0.32 3.54 2.20 -1.26 -1.02 119.74 124.64 3h3q s LYS 488 Ca -0.11 -0.38 -0.08 0.00 -0.36 0.00 0.00 55.97 55.04 3h3q s LYS 488 Cb -0.09 -2.96 0.02 0.00 -1.51 0.00 0.00 37.83 33.28 3h3q s LYS 488 CO -0.01 0.52 0.11 0.42 -0.36 0.00 0.00 175.35 176.03 3h3q s ILE 489 N -0.35 4.08 0.72 5.43 -1.09 0.41 -4.97 121.20 125.42 3h3q s ILE 489 Ca 0.08 -0.78 -0.15 0.00 -2.23 0.00 0.00 60.65 57.56 3h3q s ILE 489 Cb -0.12 -3.17 0.03 0.00 -1.58 0.00 0.00 42.46 37.62 3h3q s ILE 489 CO 0.02 -0.02 1.22 -2.84 -1.23 0.00 0.00 174.94 172.09 3h3q s PRO 490 N 1.50 2.18 0.31 2.79 0.02 -1.26 -1.14 135.00 139.40 3h3q s PRO 490 Ca 0.02 1.82 -0.16 0.00 0.02 0.00 0.00 61.00 62.70 3h3q s PRO 490 Cb -0.18 -1.83 -0.09 0.00 0.02 0.00 0.00 34.50 32.42 3h3q s PRO 490 CO 0.03 -1.82 0.75 0.00 -0.33 0.00 0.00 177.00 175.63 3h3q s ALA 491 N -1.87 3.32 0.16 -1.55 0.00 -1.26 -4.76 121.76 115.80 3h3q s ALA 491 Ca 0.76 0.08 -0.02 0.00 0.00 0.00 0.00 51.96 52.78 3h3q s ALA 491 Cb -0.31 -2.80 0.02 0.00 0.00 0.00 0.00 23.12 20.03 3h3q s ALA 491 CO 0.44 0.32 1.40 -0.07 0.00 0.00 0.00 175.76 177.85 3h3q h LEU 492 N 2.41 0.47 -8.76 0.00 3.38 -1.89 -3.45 115.31 107.47 3h3q h LEU 492 Ca -0.48 -0.33 -0.31 0.00 0.09 0.00 0.00 57.88 56.84 3h3q h LEU 492 Cb 1.18 -0.14 -0.15 0.00 0.09 0.00 0.00 40.66 41.64 3h3q h LEU 492 CO 0.65 1.09 -0.64 0.42 0.09 0.00 0.00 178.44 180.06 3h3q s THR 493 N -3.50 0.57 -1.07 0.22 -4.23 -1.26 -5.04 115.64 101.33 3h3q s THR 493 Ca -0.05 -1.99 0.21 0.00 -1.18 0.00 0.00 61.69 58.68 3h3q s THR 493 Cb 0.10 -2.39 0.21 0.00 1.34 0.00 0.00 72.50 71.76 3h3q s THR 493 CO 0.85 -0.22 1.68 -0.62 -0.54 0.00 0.00 174.62 175.77 3h3q n GLU 494 N -0.35 0.05 0.02 3.99 1.02 -1.26 -2.00 120.64 122.11 3h3q n GLU 494 Ca -0.03 0.13 0.08 0.00 -0.02 0.00 0.00 57.16 57.32 3h3q n GLU 494 Cb 0.65 -1.50 0.34 0.00 -0.02 0.00 0.00 31.44 30.91 3h3q n GLU 494 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3h3q n ASN 495 N -1.46 0.10 -4.45 1.62 5.03 -1.26 -4.87 115.26 109.97 3h3q n ASN 495 Ca 0.06 0.53 -0.29 0.00 0.87 0.00 0.00 54.58 55.74 3h3q n ASN 495 Cb 0.24 -0.55 -0.12 0.00 -1.02 0.00 0.00 39.78 38.33 3h3q n ASN 495 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 3h3q s ASP 496 N -3.20 3.67 0.45 6.41 1.01 -0.85 -5.12 116.67 119.05 3h3q s ASP 496 Ca 0.07 -0.63 -0.23 0.00 0.71 0.00 0.00 52.55 52.46 3h3q s ASP 496 Cb 0.10 -0.42 -0.08 0.00 1.01 0.00 0.00 42.92 43.53 3h3q s ASP 496 CO 0.29 0.18 1.16 -2.16 0.21 0.00 0.00 175.17 174.85 3h3q s PRO 497 N -2.11 3.82 0.66 8.23 0.04 -1.26 -4.84 135.00 139.54 3h3q s PRO 497 Ca 0.16 1.77 -0.16 0.00 0.04 0.00 0.00 61.00 62.82 3h3q s PRO 497 Cb -0.10 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 31.99 3h3q s PRO 497 CO 0.09 -0.50 1.13 -1.21 0.04 0.00 0.00 177.00 176.55 3h3q s GLU 498 N -2.64 2.74 -0.15 4.56 2.02 -1.26 -4.47 118.70 119.50 3h3q s GLU 498 Ca 0.62 1.49 0.00 0.00 0.02 0.00 0.00 54.97 57.11 3h3q s GLU 498 Cb -0.28 -1.93 -0.01 0.00 0.10 0.00 0.00 34.13 32.01 3h3q s GLU 498 CO 0.35 -1.32 -0.14 0.99 0.02 0.00 0.00 175.26 175.16 3h3q s THR 499 N -2.20 2.81 -0.11 3.63 2.01 -0.29 -4.32 115.64 117.17 3h3q s THR 499 Ca 0.69 -0.73 -0.04 0.00 0.31 0.00 0.00 61.69 61.93 3h3q s THR 499 Cb -0.23 -2.18 -0.03 0.00 0.01 0.00 0.00 72.50 70.06 3h3q s THR 499 CO 0.40 0.52 0.03 0.26 -0.69 0.00 0.00 174.62 175.14 3h3q s TRP 500 N 0.65 3.23 0.00 4.92 0.52 -0.40 0.15 118.94 128.01 3h3q s TRP 500 Ca -0.08 0.19 0.01 0.00 0.02 0.00 0.00 56.10 56.24 3h3q s TRP 500 Cb -0.16 -1.87 -0.00 0.00 -1.15 0.00 0.00 33.47 30.29 3h3q s TRP 500 CO 0.02 0.42 -0.03 -1.50 0.02 0.00 0.00 176.95 175.89 3h3q s ILE 501 N -0.61 0.21 -0.19 2.03 2.07 -0.19 -0.27 121.20 124.25 3h3q s ILE 501 Ca 0.11 -0.17 -0.02 0.00 -1.41 0.00 0.00 60.65 59.16 3h3q s ILE 501 Cb -0.12 -0.19 -0.00 0.00 0.13 0.00 0.00 42.46 42.28 3h3q s ILE 501 CO 0.02 0.02 -0.10 -0.69 -1.91 0.00 0.00 174.94 172.28 3h3q s VAL 502 N -0.16 2.99 -0.14 4.00 1.01 -0.80 -0.74 120.40 126.56 3h3q s VAL 502 Ca -0.00 -0.64 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 3h3q s VAL 502 Cb -0.02 -2.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 3h3q s VAL 502 CO -0.00 0.47 0.00 0.00 0.00 0.00 0.00 175.10 175.57 3h3q s ASN 504 N -0.01 4.50 0.03 0.00 0.02 0.20 -1.05 114.94 118.63 3h3q s ASN 504 Ca 0.03 -1.31 0.02 0.00 -1.02 0.00 0.00 52.86 50.58 3h3q s ASN 504 Cb -0.13 -1.60 -0.02 0.00 0.02 0.00 0.00 41.25 39.53 3h3q s ASN 504 CO 0.02 -0.20 -0.06 0.72 0.02 0.00 0.00 177.10 177.60 3h3q s PHE 505 N 1.16 0.55 0.34 2.20 -0.12 -0.63 -0.31 117.98 121.17 3h3q s PHE 505 Ca -0.07 -0.37 -0.29 0.00 -0.05 0.00 0.00 56.93 56.16 3h3q s PHE 505 Cb -0.19 -0.34 -0.10 0.00 -0.63 0.00 0.00 43.02 41.75 3h3q s PHE 505 CO -0.04 -0.07 1.36 -1.12 -0.05 0.00 0.00 175.22 175.30 3h3q s SER 506 N -1.09 6.65 0.22 1.98 0.01 -0.49 -0.88 113.70 120.10 3h3q s SER 506 Ca -0.07 2.79 -0.00 0.00 1.31 0.00 0.00 55.95 59.98 3h3q s SER 506 Cb -0.07 -2.65 -0.04 0.00 0.21 0.00 0.00 66.02 63.46 3h3q s SER 506 CO 0.00 -0.63 0.12 0.68 0.41 0.00 0.00 173.24 173.82 3h3q s VAL 507 N -1.09 0.20 0.20 3.43 -7.23 -0.78 -4.78 120.40 110.35 3h3q s VAL 507 Ca 0.50 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.71 3h3q s VAL 507 Cb -0.42 -2.55 -0.03 0.00 0.56 0.00 0.00 36.38 33.94 3h3q s VAL 507 CO 0.55 0.00 0.33 -1.81 -0.31 0.00 0.00 175.10 173.86 3h3q s ASP 508 N -3.22 6.33 -0.11 4.85 1.01 -1.26 -4.59 116.67 119.67 3h3q s ASP 508 Ca 0.39 0.14 -0.24 0.00 0.71 0.00 0.00 52.55 53.55 3h3q s ASP 508 Cb 0.07 -1.89 0.06 0.00 1.01 0.00 0.00 42.92 42.16 3h3q s ASP 508 CO 0.13 -0.02 0.57 -2.28 0.21 0.00 0.00 175.17 173.79 3h3q s HIS 509 N -1.87 -0.56 0.23 4.23 2.46 -1.26 -5.06 115.29 113.46 3h3q s HIS 509 Ca 0.35 1.15 -0.05 0.00 0.47 0.00 0.00 55.06 56.97 3h3q s HIS 509 Cb -0.10 0.27 0.23 0.00 -0.13 0.00 0.00 32.58 32.85 3h3q s HIS 509 CO 0.29 -0.45 1.73 -0.44 -2.47 0.00 0.00 174.74 173.41 3h3q h ASP 510 N 4.06 0.92 0.00 9.88 3.32 -2.01 -2.89 116.42 129.70 3h3q h ASP 510 Ca -0.28 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.56 3h3q h ASP 510 Cb 1.16 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.47 3h3q h ASP 510 CO 0.29 0.93 0.00 -1.20 -1.72 0.00 0.00 179.24 177.54 3h3q n SER 511 N -4.22 0.00 -3.04 6.45 7.64 -1.26 -3.85 113.62 115.34 3h3q n SER 511 Ca 0.04 -1.49 -0.19 0.00 1.01 0.00 0.00 58.87 58.24 3h3q n SER 511 Cb 0.29 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.46 3h3q n SER 511 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h3q n ALA 512 N -0.72 1.14 -1.02 -0.43 0.00 -1.09 -5.12 120.51 113.27 3h3q n ALA 512 Ca 0.10 -2.73 -0.28 0.00 0.00 0.00 0.00 53.44 50.52 3h3q n ALA 512 Cb 0.05 -0.99 0.20 0.00 0.00 0.00 0.00 19.45 18.70 3h3q n ALA 512 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3h3q s PRO 513 N -0.58 0.04 0.08 0.00 0.02 -1.25 -4.60 135.00 128.72 3h3q s PRO 513 Ca 0.34 0.58 -0.37 0.00 0.02 0.00 0.00 61.00 61.57 3h3q s PRO 513 Cb 0.19 -1.69 -0.17 0.00 0.02 0.00 0.00 34.50 32.86 3h3q s PRO 513 CO -0.15 -3.01 1.31 1.28 -0.33 0.00 0.00 177.00 176.10 3h3q n LEU 514 N -4.38 1.49 -4.79 -5.54 4.77 -1.26 -4.94 117.00 102.35 3h3q n LEU 514 Ca 0.05 1.12 -0.30 0.00 -0.03 0.00 0.00 56.01 56.85 3h3q n LEU 514 Cb 0.57 -1.17 0.10 0.00 -2.33 0.00 0.00 43.42 40.59 3h3q n LEU 514 CO 0.57 -1.13 0.71 0.21 -1.33 0.00 0.00 177.39 176.42 3h3q s ASN 515 N 0.42 4.22 -0.04 -1.43 3.84 -1.26 -5.01 114.94 115.67 3h3q s ASN 515 Ca 0.84 1.24 0.18 0.00 0.21 0.00 0.00 52.86 55.33 3h3q s ASN 515 Cb -0.98 -1.94 -0.27 0.00 -0.55 0.00 0.00 41.25 37.51 3h3q s ASN 515 CO 0.48 -2.14 0.35 0.59 -2.79 0.00 0.00 177.10 173.59 3h3q n ASN 516 N -3.53 0.92 -0.04 -4.21 3.02 -1.26 -4.56 115.26 105.60 3h3q n ASN 516 Ca 0.07 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.47 3h3q n ASN 516 Cb 0.57 1.70 -0.14 0.00 -0.61 0.00 0.00 39.78 41.30 3h3q n ASN 516 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3h3q n ARG 517 N -2.18 0.69 -3.96 3.52 1.74 -1.26 -4.96 116.66 110.25 3h3q n ARG 517 Ca -0.06 0.22 -0.33 0.00 -0.77 0.00 0.00 57.85 56.91 3h3q n ARG 517 Cb 0.54 -1.69 -0.05 0.00 -1.02 0.00 0.00 32.46 30.24 3h3q n ARG 517 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h3q s VAL 519 N -1.34 4.98 -0.50 0.00 1.01 0.36 -4.57 120.40 120.34 3h3q s VAL 519 Ca 0.28 1.67 -0.25 0.00 0.00 0.00 0.00 61.98 63.68 3h3q s VAL 519 Cb -0.13 -4.14 0.03 0.00 0.00 0.00 0.00 36.38 32.14 3h3q s VAL 519 CO 0.20 0.21 0.93 -0.60 0.00 0.00 0.00 175.10 175.84 3h3q s ARG 520 N 0.91 3.45 0.60 2.72 6.06 -1.26 -0.87 118.95 130.57 3h3q s ARG 520 Ca 0.43 -0.00 -0.15 0.00 -2.50 0.00 0.00 55.73 53.50 3h3q s ARG 520 Cb -0.19 -3.98 -0.03 0.00 0.06 0.00 0.00 34.95 30.81 3h3q s ARG 520 CO 0.22 -1.33 1.06 0.00 -2.50 0.00 0.00 175.30 172.75 3h3q s ALA 521 N 3.84 2.72 -0.08 6.12 0.00 0.62 -4.44 121.76 130.54 3h3q s ALA 521 Ca 0.34 0.39 0.04 0.00 0.00 0.00 0.00 51.96 52.73 3h3q s ALA 521 Cb -0.11 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.78 3h3q s ALA 521 CO 0.24 -0.86 -0.20 0.15 0.00 0.00 0.00 175.76 175.08 3h3q s LYS 522 N -4.12 2.54 0.14 0.00 -0.14 -0.49 -4.57 119.74 113.10 3h3q s LYS 522 Ca 0.64 -0.72 0.10 0.00 -1.36 0.00 0.00 55.97 54.62 3h3q s LYS 522 Cb -0.16 -1.98 -0.04 0.00 -1.68 0.00 0.00 37.83 33.97 3h3q s LYS 522 CO 0.38 0.14 -0.22 0.96 -0.76 0.00 0.00 175.35 175.85 3h3q s ILE 523 N 0.40 1.98 -0.22 2.17 -4.36 -1.26 0.04 121.20 119.95 3h3q s ILE 523 Ca -0.16 -1.77 -0.03 0.00 -0.26 0.00 0.00 60.65 58.43 3h3q s ILE 523 Cb -0.17 -1.83 0.07 0.00 1.25 0.00 0.00 42.46 41.78 3h3q s ILE 523 CO 0.07 -0.09 0.05 0.21 0.24 0.00 0.00 174.94 175.42 3h3q s ASN 524 N -2.25 3.15 0.03 4.36 2.47 0.13 -1.40 114.94 121.43 3h3q s ASN 524 Ca 0.13 -1.00 0.04 0.00 0.42 0.00 0.00 52.86 52.45 3h3q s ASN 524 Cb -0.09 -0.62 -0.02 0.00 -1.45 0.00 0.00 41.25 39.07 3h3q s ASN 524 CO 0.06 -0.33 -0.12 -0.69 -3.72 0.00 0.00 177.10 172.30 3h3q s VAL 525 N 1.83 0.91 -0.05 -5.21 1.01 0.58 -0.79 120.40 118.68 3h3q s VAL 525 Ca 0.02 -0.86 -0.04 0.00 0.00 0.00 0.00 61.98 61.09 3h3q s VAL 525 Cb -0.17 -0.83 0.02 0.00 0.00 0.00 0.00 36.38 35.39 3h3q s VAL 525 CO -0.13 -0.02 0.12 0.00 0.00 0.00 0.00 175.10 175.08 3h3q s ALA 526 N -0.78 -0.29 -0.35 5.51 0.00 -0.43 -0.63 121.76 124.78 3h3q s ALA 526 Ca 0.00 0.38 -0.07 0.00 0.00 0.00 0.00 51.96 52.27 3h3q s ALA 526 Cb -0.07 -0.23 0.04 0.00 0.00 0.00 0.00 23.12 22.86 3h3q s ALA 526 CO 0.01 -0.07 0.13 1.41 0.00 0.00 0.00 175.76 177.24 3h3q s MET 527 N 0.21 2.62 -0.19 0.00 -2.45 -0.04 -0.84 119.30 118.60 3h3q s MET 527 Ca -0.01 -1.22 -0.03 0.00 -1.25 0.00 0.00 55.69 53.18 3h3q s MET 527 Cb -0.02 -3.52 -0.01 0.00 1.25 0.00 0.00 34.83 32.53 3h3q s MET 527 CO -0.01 -0.71 -0.07 0.42 1.05 0.00 0.00 175.02 175.70 3h3q s ILE 528 N 1.41 3.27 -0.03 10.11 1.01 0.31 -1.91 121.20 135.37 3h3q s ILE 528 Ca -0.01 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.12 3h3q s ILE 528 Cb -0.20 -2.45 0.00 0.00 0.01 0.00 0.00 42.46 39.82 3h3q s ILE 528 CO 0.03 0.46 -0.09 0.00 0.00 0.00 0.00 174.94 175.34 3h3q s GLN 530 N 0.25 1.51 -0.18 0.00 -0.21 -0.71 -1.28 119.66 119.05 3h3q s GLN 530 Ca -0.04 -0.55 -0.16 0.00 0.02 0.00 0.00 55.36 54.63 3h3q s GLN 530 Cb -0.09 -1.36 -0.04 0.00 1.00 0.00 0.00 33.01 32.51 3h3q s GLN 530 CO 0.01 0.25 0.38 0.99 -2.12 0.00 0.00 175.29 174.80 3h3q s THR 531 N -0.06 5.23 -0.14 -0.19 2.01 -1.26 -0.89 115.64 120.34 3h3q s THR 531 Ca -0.01 0.69 -0.10 0.00 0.31 0.00 0.00 61.69 62.59 3h3q s THR 531 Cb -0.09 -3.71 -0.05 0.00 0.01 0.00 0.00 72.50 68.66 3h3q s THR 531 CO 0.01 0.29 0.19 -0.76 -0.69 0.00 0.00 174.62 173.66 3h3q s LEU 532 N 1.03 4.33 0.02 4.42 1.43 0.27 -4.73 118.68 125.44 3h3q s LEU 532 Ca 0.19 0.46 0.07 0.00 -1.03 0.00 0.00 54.13 53.82 3h3q s LEU 532 Cb -0.14 -2.17 -0.03 0.00 0.03 0.00 0.00 46.19 43.87 3h3q s LEU 532 CO 0.07 0.29 -0.20 0.68 0.23 0.00 0.00 176.35 177.42 3h3q s VAL 533 N -0.42 2.58 -0.42 -1.59 -7.23 -1.26 -1.80 120.40 110.26 3h3q s VAL 533 Ca 0.14 -1.15 0.02 0.00 -1.81 0.00 0.00 61.98 59.18 3h3q s VAL 533 Cb -0.12 -2.03 0.15 0.00 0.56 0.00 0.00 36.38 34.93 3h3q s VAL 533 CO 0.03 0.42 0.28 -0.55 -0.31 0.00 0.00 175.10 174.97 3h3q s SER 534 N -1.17 2.92 0.48 4.85 0.15 0.05 -5.02 113.70 115.96 3h3q s SER 534 Ca 0.13 -2.70 -0.23 0.00 0.70 0.00 0.00 55.95 53.86 3h3q s SER 534 Cb -0.10 -0.71 -0.07 0.00 -1.71 0.00 0.00 66.02 63.43 3h3q s SER 534 CO 0.03 -0.24 1.21 -2.84 1.20 0.00 0.00 173.24 172.60 3h3q s PRO 535 N 0.37 3.61 0.70 5.44 0.02 -1.26 -4.68 135.00 139.20 3h3q s PRO 535 Ca 0.22 1.87 -0.11 0.00 0.02 0.00 0.00 61.00 63.01 3h3q s PRO 535 Cb -0.15 -2.37 0.01 0.00 0.02 0.00 0.00 34.50 32.02 3h3q s PRO 535 CO -0.06 -0.70 1.07 -1.25 -0.33 0.00 0.00 177.00 175.72 3h3q s PRO 536 N -2.75 2.89 0.23 5.54 0.04 -1.26 -4.99 135.00 134.69 3h3q s PRO 536 Ca 0.65 0.77 0.11 0.00 0.04 0.00 0.00 61.00 62.57 3h3q s PRO 536 Cb -0.31 -2.00 0.15 0.00 0.04 0.00 0.00 34.50 32.38 3h3q s PRO 536 CO 0.37 -1.09 1.48 1.49 0.04 0.00 0.00 177.00 179.30 3h3q h GLU 537 N -0.70 0.00 0.00 4.56 4.81 -1.94 -3.48 114.58 117.83 3h3q h GLU 537 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 3h3q h GLU 537 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 3h3q h GLU 537 CO 0.59 0.72 0.00 0.41 -0.73 0.00 0.00 179.01 180.01 3h3q n GLY 538 N 0.77 1.13 0.31 1.92 0.00 -1.26 -4.95 105.19 103.10 3h3q n GLY 538 Ca -0.00 -0.83 0.13 0.00 0.00 0.00 0.00 46.02 45.32 3h3q n GLY 538 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3h3q n ASN 539 N 0.00 0.95 -4.85 1.61 5.03 -1.26 -4.95 115.26 111.78 3h3q n ASN 539 Ca 0.00 -1.40 -0.34 0.00 0.87 0.00 0.00 54.58 53.72 3h3q n ASN 539 Cb 0.00 -0.02 -0.06 0.00 -1.02 0.00 0.00 39.78 38.68 3h3q n ASN 539 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 3h3q s GLN 540 N -1.96 3.98 0.47 3.52 1.11 -1.26 -5.09 119.66 120.43 3h3q s GLN 540 Ca 0.38 0.53 -0.20 0.00 0.01 0.00 0.00 55.36 56.08 3h3q s GLN 540 Cb 0.20 -2.72 -0.09 0.00 -1.01 0.00 0.00 33.01 29.39 3h3q s GLN 540 CO 0.32 0.34 1.00 -1.21 0.01 0.00 0.00 175.29 175.74 3h3q s GLU 541 N -2.47 3.96 0.16 2.91 2.02 -1.26 -4.83 118.70 119.19 3h3q s GLU 541 Ca 0.45 1.21 -0.33 0.00 0.02 0.00 0.00 54.97 56.33 3h3q s GLU 541 Cb -0.13 -2.13 -0.16 0.00 0.10 0.00 0.00 34.13 31.81 3h3q s GLU 541 CO 0.20 -0.28 1.09 -0.89 0.02 0.00 0.00 175.26 175.39 3h3q n ILE 542 N -0.97 0.93 -4.31 -1.63 5.41 -1.26 -4.93 119.36 112.59 3h3q n ILE 542 Ca 0.08 -0.23 -0.15 0.00 1.00 0.00 0.00 62.75 63.45 3h3q n ILE 542 Cb 0.53 -0.67 -0.04 0.00 -0.71 0.00 0.00 39.64 38.75 3h3q n ILE 542 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3h3q n SER 543 N 1.94 1.76 0.11 4.38 3.41 -1.26 -5.01 113.62 118.94 3h3q n SER 543 Ca 0.16 -2.14 0.12 0.00 -0.26 0.00 0.00 58.87 56.75 3h3q n SER 543 Cb 0.23 0.39 0.47 0.00 -0.26 0.00 0.00 64.21 65.04 3h3q n SER 543 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3h3q n ARG 544 N -0.55 0.19 0.05 4.33 1.74 -1.26 -1.18 116.66 119.98 3h3q n ARG 544 Ca -0.06 0.36 0.11 0.00 -0.77 0.00 0.00 57.85 57.49 3h3q n ARG 544 Cb 0.32 -1.83 0.44 0.00 -1.02 0.00 0.00 32.46 30.37 3h3q n ARG 544 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3h3q n ASP 545 N -2.19 0.29 -1.17 0.55 8.00 -1.26 -3.06 116.55 117.72 3h3q n ASP 545 Ca 0.03 0.55 0.10 0.00 0.71 0.00 0.00 54.79 56.19 3h3q n ASP 545 Cb 0.27 -0.62 0.27 0.00 -0.02 0.00 0.00 41.12 41.02 3h3q n ASP 545 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3h3q n ASN 546 N -1.80 3.67 -4.19 -2.24 5.03 -0.32 -4.95 115.26 110.46 3h3q n ASN 546 Ca 0.04 -1.99 -0.16 0.00 0.87 0.00 0.00 54.58 53.34 3h3q n ASN 546 Cb 0.26 -0.41 -0.11 0.00 -1.02 0.00 0.00 39.78 38.50 3h3q n ASN 546 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.26 175.70 3h3q s ILE 547 N -1.03 1.05 -0.19 2.41 -4.36 -1.17 -0.77 121.20 117.13 3h3q s ILE 547 Ca 0.42 -1.63 -0.08 0.00 -0.26 0.00 0.00 60.65 59.10 3h3q s ILE 547 Cb 0.22 -1.37 0.08 0.00 1.25 0.00 0.00 42.46 42.63 3h3q s ILE 547 CO 0.29 -0.50 0.42 -0.22 0.24 0.00 0.00 174.94 175.17 3h3q s LEU 548 N -2.39 -0.40 -0.24 0.37 2.96 -0.74 -1.19 118.68 117.06 3h3q s LEU 548 Ca 0.06 0.95 -0.17 0.00 -0.22 0.00 0.00 54.13 54.75 3h3q s LEU 548 Cb -0.04 1.35 -0.03 0.00 0.50 0.00 0.00 46.19 47.97 3h3q s LEU 548 CO 0.01 -0.22 0.45 0.00 -1.32 0.00 0.00 176.35 175.28 3h3q s LYS 550 N 1.86 4.20 -0.08 0.00 -0.14 -0.07 0.29 119.74 125.80 3h3q s LYS 550 Ca 0.20 0.34 0.04 0.00 -1.36 0.00 0.00 55.97 55.19 3h3q s LYS 550 Cb -0.15 -3.54 -0.01 0.00 -1.68 0.00 0.00 37.83 32.45 3h3q s LYS 550 CO 0.09 -0.08 -0.21 0.42 -0.76 0.00 0.00 175.35 174.82 3h3q s ILE 551 N 1.41 2.43 -0.16 2.17 1.01 0.68 -1.73 121.20 127.01 3h3q s ILE 551 Ca 0.22 -0.91 -0.00 0.00 0.00 0.00 0.00 60.65 59.96 3h3q s ILE 551 Cb -0.15 -1.94 -0.01 0.00 0.01 0.00 0.00 42.46 40.37 3h3q s ILE 551 CO 0.09 0.56 -0.13 -0.89 0.00 0.00 0.00 174.94 174.57 3h3q s THR 552 N 0.00 2.88 -0.16 2.92 2.01 0.19 -0.61 115.64 122.88 3h3q s THR 552 Ca -0.07 -0.70 0.01 0.00 0.31 0.00 0.00 61.69 61.24 3h3q s THR 552 Cb -0.15 -2.23 0.02 0.00 0.01 0.00 0.00 72.50 70.15 3h3q s THR 552 CO 0.05 0.51 -0.17 -0.47 -0.69 0.00 0.00 174.62 173.84 3h3q s TYR 553 N 0.76 2.45 -0.05 4.92 6.14 0.13 0.11 117.35 131.82 3h3q s TYR 553 Ca -0.05 -1.39 0.05 0.00 0.64 0.00 0.00 57.07 56.31 3h3q s TYR 553 Cb -0.15 -1.74 -0.02 0.00 0.42 0.00 0.00 41.96 40.47 3h3q s TYR 553 CO 0.01 -0.71 -0.18 0.14 0.64 0.00 0.00 175.55 175.45 3h3q s VAL 554 N 1.32 2.75 -0.06 3.14 -7.23 -0.02 -0.14 120.40 120.15 3h3q s VAL 554 Ca 0.03 -0.84 -0.01 0.00 -1.81 0.00 0.00 61.98 59.36 3h3q s VAL 554 Cb -0.13 -2.05 0.03 0.00 0.56 0.00 0.00 36.38 34.78 3h3q s VAL 554 CO -0.10 0.58 -0.01 0.00 -0.31 0.00 0.00 175.10 175.26 3h3q s ALA 555 N -0.59 0.70 -0.27 1.32 0.00 -0.14 -1.31 121.76 121.46 3h3q s ALA 555 Ca 0.09 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 51.95 3h3q s ALA 555 Cb -0.11 -0.65 0.06 0.00 0.00 0.00 0.00 23.12 22.41 3h3q s ALA 555 CO 0.01 -0.33 -0.07 -0.80 0.00 0.00 0.00 175.76 174.56 3h3q s ASN 556 N 1.67 4.60 -0.13 0.00 -0.87 0.03 -1.82 114.94 118.41 3h3q s ASN 556 Ca 0.00 -1.35 0.02 0.00 -1.57 0.00 0.00 52.86 49.96 3h3q s ASN 556 Cb -0.13 -1.61 0.00 0.00 -0.02 0.00 0.00 41.25 39.50 3h3q s ASN 556 CO -0.04 -0.21 -0.19 -0.69 -2.57 0.00 0.00 177.10 173.39 3h3q s VAL 557 N 1.15 2.36 -0.36 1.60 1.01 -1.26 0.21 120.40 125.11 3h3q s VAL 557 Ca -0.08 -0.89 -0.13 0.00 0.00 0.00 0.00 61.98 60.88 3h3q s VAL 557 Cb -0.20 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 3h3q s VAL 557 CO -0.04 0.54 0.26 0.21 0.00 0.00 0.00 175.10 176.07 3h3q s ASN 558 N 0.65 6.07 0.31 3.32 3.84 0.11 -4.61 114.94 124.62 3h3q s ASN 558 Ca -0.10 -0.55 0.24 0.00 0.21 0.00 0.00 52.86 52.67 3h3q s ASN 558 Cb -0.16 -2.14 1.12 0.00 -0.55 0.00 0.00 41.25 39.51 3h3q s ASN 558 CO 0.02 -0.29 1.73 1.55 -2.79 0.00 0.00 177.10 177.33 3h3q h PRO 559 N 8.53 0.00 0.00 0.43 0.14 -1.86 -1.31 132.00 137.93 3h3q h PRO 559 Ca -0.30 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.84 3h3q h PRO 559 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.29 3h3q h PRO 559 CO 0.66 0.00 0.00 0.41 0.14 0.00 0.00 178.00 179.21 3h3q n GLY 560 N -0.45 0.67 0.00 1.56 0.00 -1.26 -4.42 105.19 101.28 3h3q n GLY 560 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3h3q n GLY 560 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h3q n GLY 561 N -2.63 0.25 3.79 -0.02 0.00 -1.26 -4.82 105.19 100.49 3h3q n GLY 561 Ca 0.00 -1.13 -0.36 0.00 0.00 0.00 0.00 46.02 44.53 3h3q n GLY 561 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3h3q s TRP 562 N -2.00 3.10 0.01 1.61 -0.00 -1.26 -4.88 118.94 115.52 3h3q s TRP 562 Ca 0.00 1.60 -0.22 0.00 -0.00 0.00 0.00 56.10 57.48 3h3q s TRP 562 Cb 0.00 -3.14 0.05 0.00 -0.00 0.00 0.00 33.47 30.38 3h3q s TRP 562 CO 0.00 -0.84 0.49 0.00 -0.00 0.00 0.00 176.95 176.61 3h3q s ALA 563 N -1.77 -1.25 0.22 5.86 0.00 -1.26 -4.96 121.76 118.59 3h3q s ALA 563 Ca 0.63 0.65 -0.31 0.00 0.00 0.00 0.00 51.96 52.92 3h3q s ALA 563 Cb -0.21 0.23 -0.11 0.00 0.00 0.00 0.00 23.12 23.03 3h3q s ALA 563 CO 0.25 -0.42 1.61 -1.25 0.00 0.00 0.00 175.76 175.96 3h3q s PRO 564 N -1.95 4.17 0.12 0.00 0.04 -1.26 -4.83 135.00 131.29 3h3q s PRO 564 Ca -0.08 2.49 -0.17 0.00 0.04 0.00 0.00 61.00 63.28 3h3q s PRO 564 Cb -0.01 -3.09 -0.03 0.00 0.04 0.00 0.00 34.50 31.40 3h3q s PRO 564 CO 0.02 -0.64 1.68 0.00 0.04 0.00 0.00 177.00 178.10 3h3q h ALA 565 N 6.12 0.43 -0.98 8.56 0.00 -2.00 -2.61 119.26 128.78 3h3q h ALA 565 Ca -0.44 -0.12 0.23 0.00 0.00 0.00 0.00 54.91 54.58 3h3q h ALA 565 Cb 1.21 -0.13 -0.12 0.00 0.00 0.00 0.00 17.79 18.75 3h3q h ALA 565 CO 0.88 0.02 0.55 0.66 0.00 0.00 0.00 179.25 181.36 3h3q h SER 566 N 0.39 0.62 -0.11 0.00 4.64 -2.00 -0.77 113.55 116.33 3h3q h SER 566 Ca 0.11 0.13 -0.21 0.00 -0.47 0.00 0.00 61.79 61.35 3h3q h SER 566 Cb 0.16 0.04 0.01 0.00 -0.31 0.00 0.00 62.40 62.30 3h3q h SER 566 CO -0.01 0.12 -0.75 0.58 -0.87 0.00 0.00 176.83 175.89 3h3q h VAL 567 N 0.58 1.31 -0.49 0.95 2.07 -1.88 -2.69 116.25 116.09 3h3q h VAL 567 Ca 0.61 -1.99 -0.06 0.00 0.82 0.00 0.00 66.70 66.08 3h3q h VAL 567 Cb 1.12 2.14 -0.02 0.00 -1.52 0.00 0.00 31.29 33.01 3h3q h VAL 567 CO -0.47 0.62 0.06 -0.07 0.02 0.00 0.00 177.57 177.74 3h3q h LEU 568 N 0.38 0.73 -0.41 2.57 3.38 -0.82 -0.69 115.31 120.44 3h3q h LEU 568 Ca -0.06 -0.15 -0.18 0.00 0.09 0.00 0.00 57.88 57.58 3h3q h LEU 568 Cb 1.40 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 3h3q h LEU 568 CO 0.15 0.76 -0.61 0.03 0.09 0.00 0.00 178.44 178.86 3h3q h ARG 569 N 0.73 0.63 -0.12 1.13 3.08 -1.28 -0.76 114.38 117.79 3h3q h ARG 569 Ca 0.15 -0.43 0.01 0.00 0.07 0.00 0.00 59.98 59.79 3h3q h ARG 569 Cb 0.36 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 3h3q h ARG 569 CO 0.01 1.05 0.04 0.00 -1.07 0.00 0.00 179.97 180.00 3h3q h ALA 570 N 0.85 0.13 -0.46 0.04 0.00 -1.09 0.69 119.26 119.42 3h3q h ALA 570 Ca -0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3h3q h ALA 570 Cb 1.18 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 3h3q h ALA 570 CO 0.12 -0.41 0.25 0.28 0.00 0.00 0.00 179.25 179.49 3h3q h VAL 571 N 0.11 1.17 -0.50 0.00 2.07 -0.99 -1.15 116.25 116.96 3h3q h VAL 571 Ca 0.05 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.11 3h3q h VAL 571 Cb 0.02 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 3h3q h VAL 571 CO -0.05 0.18 0.25 0.00 0.02 0.00 0.00 177.57 177.97 3h3q h ALA 572 N 1.09 0.64 -0.22 1.67 0.00 -0.98 0.49 119.26 121.95 3h3q h ALA 572 Ca 0.16 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3h3q h ALA 572 Cb 0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3h3q h ALA 572 CO -0.03 0.19 0.13 -0.22 0.00 0.00 0.00 179.25 179.33 3h3q h LYS 573 N 0.66 0.30 0.07 0.00 3.64 -0.46 -2.82 116.57 117.96 3h3q h LYS 573 Ca 0.17 -0.02 -0.21 0.00 -1.27 0.00 0.00 60.65 59.32 3h3q h LYS 573 Cb 0.10 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3h3q h LYS 573 CO -0.02 0.21 -1.10 -0.09 -2.27 0.00 0.00 179.45 176.18 3h3q h ARG 574 N 0.31 0.14 0.21 1.90 2.43 -0.41 -3.40 114.38 115.56 3h3q h ARG 574 Ca 0.08 -0.24 -0.31 0.00 -0.81 0.00 0.00 59.98 58.70 3h3q h ARG 574 Cb -0.01 0.09 0.03 0.00 -0.42 0.00 0.00 29.97 29.67 3h3q h ARG 574 CO -0.02 1.12 -1.34 0.93 -1.51 0.00 0.00 179.97 179.15 3h3q h GLU 575 N -0.60 0.54 0.04 0.20 4.39 -0.01 -3.04 114.58 116.10 3h3q h GLU 575 Ca -0.25 -0.86 -0.00 0.00 0.34 0.00 0.00 59.36 58.58 3h3q h GLU 575 Cb 1.51 0.31 0.00 0.00 -0.10 0.00 0.00 28.75 30.47 3h3q h GLU 575 CO -0.02 1.41 -0.02 1.88 -1.16 0.00 0.00 179.01 181.10 3h3q h TYR 576 N 0.13 -0.06 -0.50 4.33 0.05 -1.70 -1.43 116.97 117.80 3h3q h TYR 576 Ca -0.23 -0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.51 3h3q h TYR 576 Cb 2.04 0.02 -0.02 0.00 1.01 0.00 0.00 36.73 39.77 3h3q h TYR 576 CO 0.13 0.04 0.15 -1.00 -1.05 0.00 0.00 178.16 176.43 3h3q h PRO 577 N -0.14 0.74 -0.05 4.88 0.13 -1.77 -0.63 132.00 135.16 3h3q h PRO 577 Ca -0.01 -0.13 0.02 0.00 -0.87 0.00 0.00 66.00 65.02 3h3q h PRO 577 Cb 0.12 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 3h3q h PRO 577 CO 0.01 0.65 -0.08 -0.22 -0.23 0.00 0.00 178.00 178.12 3h3q h LYS 578 N 0.72 -0.12 -0.04 0.86 3.64 -1.47 -1.89 116.57 118.28 3h3q h LYS 578 Ca 0.17 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.59 3h3q h LYS 578 Cb 0.23 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 3h3q h LYS 578 CO -0.01 -0.08 -0.17 0.35 -2.27 0.00 0.00 179.45 177.28 3h3q h PHE 579 N -0.12 -0.43 -0.80 1.91 3.57 -0.86 -1.87 116.94 118.32 3h3q h PHE 579 Ca 0.05 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.57 3h3q h PHE 579 Cb 0.19 0.20 -0.04 0.00 2.79 0.00 0.00 35.95 39.09 3h3q h PHE 579 CO -0.17 -0.24 0.50 -0.07 -2.23 0.00 0.00 178.31 176.10 3h3q h LEU 580 N -0.25 0.95 0.16 0.59 3.38 -0.97 0.34 115.31 119.51 3h3q h LEU 580 Ca 0.07 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3h3q h LEU 580 Cb 0.35 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3h3q h LEU 580 CO -0.19 0.72 -0.08 0.11 0.09 0.00 0.00 178.44 179.09 3h3q h LYS 581 N 1.10 -0.20 -0.15 1.13 1.57 -1.24 0.31 116.57 119.08 3h3q h LYS 581 Ca 0.29 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 59.06 3h3q h LYS 581 Cb -0.08 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 3h3q h LYS 581 CO -0.06 -0.09 -0.02 -0.09 -0.57 0.00 0.00 179.45 178.62 3h3q h ARG 582 N -0.26 0.28 0.10 3.15 2.43 -1.08 -0.97 114.38 118.02 3h3q h ARG 582 Ca -0.02 -0.10 0.01 0.00 -0.81 0.00 0.00 59.98 59.06 3h3q h ARG 582 Cb 0.21 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 3h3q h ARG 582 CO 0.04 0.54 -0.15 0.35 -1.51 0.00 0.00 179.97 179.23 3h3q h PHE 583 N 0.00 -0.39 -0.59 2.20 3.57 -0.40 -0.09 116.94 121.25 3h3q h PHE 583 Ca 0.04 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 3h3q h PHE 583 Cb 0.42 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 3h3q h PHE 583 CO 0.04 -0.22 0.24 1.79 -2.23 0.00 0.00 178.31 177.93 3h3q h THR 584 N -0.30 1.23 -0.93 4.41 1.35 -0.92 -1.60 112.91 116.15 3h3q h THR 584 Ca 0.02 -0.70 0.12 0.00 -0.55 0.00 0.00 66.41 65.30 3h3q h THR 584 Cb 0.31 0.59 -0.07 0.00 -1.73 0.00 0.00 68.15 67.24 3h3q h THR 584 CO -0.07 0.27 0.60 0.28 -0.25 0.00 0.00 175.52 176.34 3h3q h SER 585 N 0.81 0.80 -0.39 5.36 0.02 -1.12 -1.45 113.55 117.58 3h3q h SER 585 Ca 0.20 0.04 -0.13 0.00 -0.84 0.00 0.00 61.79 61.05 3h3q h SER 585 Cb 0.19 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 3h3q h SER 585 CO -0.02 0.43 -0.24 0.22 -1.14 0.00 0.00 176.83 176.08 3h3q h TYR 586 N 0.86 1.04 -0.50 3.45 3.20 -0.20 -0.34 116.97 124.48 3h3q h TYR 586 Ca 0.45 -0.25 -0.08 0.00 3.14 0.00 0.00 58.73 61.99 3h3q h TYR 586 Cb 0.53 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.54 3h3q h TYR 586 CO -0.00 1.04 -0.01 0.28 -1.64 0.00 0.00 178.16 177.84 3h3q h VAL 587 N 0.77 1.25 0.04 1.81 2.07 -0.46 -0.46 116.25 121.27 3h3q h VAL 587 Ca 0.10 -1.04 -0.00 0.00 0.82 0.00 0.00 66.70 66.58 3h3q h VAL 587 Cb 0.80 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 3h3q h VAL 587 CO 0.07 0.37 -0.02 1.56 0.02 0.00 0.00 177.57 179.57 3h3q h GLN 588 N 0.77 -0.05 0.01 1.57 4.20 -0.89 -1.89 115.11 118.83 3h3q h GLN 588 Ca 0.15 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.89 3h3q h GLN 588 Cb 0.48 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.21 3h3q h GLN 588 CO 0.02 0.04 -0.41 0.93 -0.67 0.00 0.00 178.83 178.74 3h3q h GLU 589 N -0.13 -0.55 0.00 1.46 5.08 -0.89 -1.62 114.58 117.93 3h3q h GLU 589 Ca -0.01 0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 3h3q h GLU 589 Cb 0.11 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 3h3q h GLU 589 CO 0.01 -0.37 -0.11 0.87 -1.00 0.00 0.00 179.01 178.41 3h3q h LYS 590 N -0.57 0.00 0.00 2.33 1.79 -1.01 -2.84 116.57 116.26 3h3q h LYS 590 Ca 0.05 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 3h3q h LYS 590 Cb 0.65 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.30 3h3q h LYS 590 CO -0.31 0.11 -1.14 0.25 -1.08 0.00 0.00 179.45 177.29 3h3q n THR 591 N -3.37 0.02 -1.71 -0.16 -2.24 -0.72 -4.93 114.28 101.17 3h3q n THR 591 Ca -0.01 -0.11 -0.42 0.00 -2.27 0.00 0.00 64.05 61.24 3h3q n THR 591 Cb 0.30 0.69 -0.03 0.00 -2.10 0.00 0.00 70.33 69.19 3h3q n THR 591 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h3q s ALA 592 N -3.11 3.69 0.00 6.98 0.00 -0.62 -1.44 121.76 127.26 3h3q s ALA 592 Ca 0.05 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.40 3h3q s ALA 592 Cb 0.16 -3.79 0.00 0.00 0.00 0.00 0.00 23.12 19.48 3h3q s ALA 592 CO 0.86 -1.35 0.00 0.41 0.00 0.00 0.00 175.76 175.67 3h3q n GLY 593 N 4.34 0.70 3.90 0.00 0.00 -1.26 -5.05 105.19 107.83 3h3q n GLY 593 Ca 0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 3h3q n GLY 593 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h3q s LYS 594 N -0.68 3.31 0.43 1.61 1.02 -0.52 -5.07 119.74 119.83 3h3q s LYS 594 Ca 0.00 -0.63 -0.26 0.00 0.02 0.00 0.00 55.97 55.10 3h3q s LYS 594 Cb 0.00 -2.90 -0.09 0.00 -0.52 0.00 0.00 37.83 34.32 3h3q s LYS 594 CO 0.00 0.53 1.37 -2.14 -0.92 0.00 0.00 175.35 174.19 3h3q s PRO 595 N -3.05 3.83 0.09 -1.68 0.02 -1.26 -4.93 135.00 128.02 3h3q s PRO 595 Ca 0.34 2.30 -0.30 0.00 0.02 0.00 0.00 61.00 63.35 3h3q s PRO 595 Cb -0.11 -2.71 -0.06 0.00 0.02 0.00 0.00 34.50 31.64 3h3q s PRO 595 CO 0.27 -0.66 1.14 0.42 -0.33 0.00 0.00 177.00 177.85 3h3q s ILE 596 N -1.23 4.07 -0.42 2.83 1.01 -1.26 -5.02 121.20 121.18 3h3q s ILE 596 Ca 0.59 1.57 -0.05 0.00 0.00 0.00 0.00 60.65 62.76 3h3q s ILE 596 Cb -0.41 -4.01 0.11 0.00 0.01 0.00 0.00 42.46 38.16 3h3q s ILE 596 CO 0.53 0.17 0.24 -0.22 0.00 0.00 0.00 174.94 175.66 3h3q s LEU 597 N 0.59 5.34 0.00 2.97 0.20 -1.26 -5.15 118.68 121.37 3h3q s LEU 597 Ca 0.55 -1.96 0.31 0.00 0.69 0.00 0.00 54.13 53.72 3h3q s LEU 597 Cb -0.29 -1.88 1.71 0.00 -0.43 0.00 0.00 46.19 45.30 3h3q s LEU 597 CO 0.31 -0.58 2.12 0.49 -0.29 0.00 0.00 176.35 178.40