#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3q h ARG 366 N 0.00 0.00 -0.70 -1.40 0.11 -2.04 -3.01 114.38 107.33 3h3q h ARG 366 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3h3q h ARG 366 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 3h3q h ARG 366 CO 0.00 0.00 0.00 1.19 0.10 0.00 0.00 179.97 181.26 3h3q n PHE 367 N -2.70 1.10 -0.27 4.08 3.72 -1.26 -4.65 117.46 117.49 3h3q n PHE 367 Ca 0.01 -0.51 0.04 0.00 -0.05 0.00 0.00 57.45 56.94 3h3q n PHE 367 Cb 0.24 -0.07 0.27 0.00 -0.94 0.00 0.00 39.48 38.98 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 4.15 1.07 -0.43 -4.37 -1.51 -1.96 0.94 116.25 114.13 3h3q h VAL 368 Ca 0.00 -0.33 -0.12 0.00 -1.23 0.00 0.00 66.70 65.02 3h3q h VAL 368 Cb 1.09 0.02 -0.01 0.00 -2.13 0.00 0.00 31.29 30.26 3h3q h VAL 368 CO 0.06 0.18 -0.23 1.56 -1.23 0.00 0.00 177.57 177.91 3h3q h GLN 369 N 0.96 0.88 -0.31 5.19 4.20 -1.87 -0.19 115.11 123.97 3h3q h GLN 369 Ca 0.36 -0.37 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 3h3q h GLN 369 Cb 0.18 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 3h3q h GLN 369 CO -0.13 1.02 0.04 -0.22 -0.67 0.00 0.00 178.83 178.88 3h3q h LYS 370 N 0.76 0.52 -0.14 1.46 1.63 -1.56 -2.22 116.57 117.02 3h3q h LYS 370 Ca 0.10 -0.14 0.03 0.00 -0.85 0.00 0.00 60.65 59.79 3h3q h LYS 370 Cb 0.77 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.31 3h3q h LYS 370 CO 0.06 0.62 -0.07 0.28 -3.45 0.00 0.00 179.45 176.89 3h3q h VAL 371 N 0.34 0.78 -1.00 2.00 2.07 -0.63 0.52 116.25 120.33 3h3q h VAL 371 Ca 0.09 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.64 3h3q h VAL 371 Cb 0.36 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 30.85 3h3q h VAL 371 CO 0.01 0.00 0.66 -0.33 0.02 0.00 0.00 177.57 177.93 3h3q h GLU 372 N -0.06 1.27 -0.17 1.57 4.39 -1.03 -1.48 114.58 119.07 3h3q h GLU 372 Ca 0.08 -0.08 -0.12 0.00 0.34 0.00 0.00 59.36 59.58 3h3q h GLU 372 Cb 0.17 -0.29 0.00 0.00 -0.10 0.00 0.00 28.75 28.54 3h3q h GLU 372 CO -0.18 0.84 -0.36 1.49 -1.16 0.00 0.00 179.01 179.64 3h3q h GLU 373 N 1.30 0.54 -0.87 2.33 4.81 -0.91 0.18 114.58 121.97 3h3q h GLU 373 Ca 0.39 -0.36 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 3h3q h GLU 373 Cb -0.06 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 3h3q h GLU 373 CO -0.11 0.97 0.50 0.52 -0.73 0.00 0.00 179.01 180.17 3h3q h MET 374 N 0.19 1.19 -0.15 1.92 2.86 -0.73 0.23 114.93 120.44 3h3q h MET 374 Ca 0.00 -0.12 -0.07 0.00 -2.06 0.00 0.00 59.70 57.45 3h3q h MET 374 Cb 0.96 -0.24 -0.00 0.00 0.06 0.00 0.00 31.60 32.38 3h3q h MET 374 CO 0.08 0.85 -0.19 0.28 1.06 0.00 0.00 176.91 178.99 3h3q h VAL 375 N 1.20 1.35 -0.67 -2.22 2.07 -1.24 -0.20 116.25 116.54 3h3q h VAL 375 Ca 0.31 -1.39 -0.06 0.00 0.82 0.00 0.00 66.70 66.38 3h3q h VAL 375 Cb -0.02 1.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.64 3h3q h VAL 375 CO -0.05 0.41 0.20 -0.61 0.02 0.00 0.00 177.57 177.53 3h3q h GLN 376 N 0.02 1.05 -0.63 1.57 5.75 -0.52 -0.85 115.11 121.50 3h3q h GLN 376 Ca 0.02 -0.23 -0.03 0.00 -0.15 0.00 0.00 58.65 58.26 3h3q h GLN 376 Cb 0.75 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 29.12 3h3q h GLN 376 CO 0.05 0.92 0.28 -0.91 -2.65 0.00 0.00 178.83 176.52 3h3q h ASN 377 N 0.99 0.82 -0.12 -0.69 2.35 -0.39 -1.25 115.58 117.28 3h3q h ASN 377 Ca 0.21 -0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.83 3h3q h ASN 377 Cb 0.32 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 3h3q h ASN 377 CO -0.00 0.72 -0.06 0.45 -1.65 0.00 0.00 177.43 176.88 3h3q h HIS 378 N 0.90 0.30 -0.01 1.19 3.86 -0.56 -1.80 115.15 119.03 3h3q h HIS 378 Ca 0.22 -0.08 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 3h3q h HIS 378 Cb 0.13 -0.07 -0.00 0.00 1.06 0.00 0.00 27.41 28.53 3h3q h HIS 378 CO 0.01 0.60 0.01 0.52 0.86 0.00 0.00 177.93 179.94 3h3q h MET 379 N -0.10 0.00 0.06 2.45 2.86 -0.89 0.32 114.93 119.64 3h3q h MET 379 Ca 0.03 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.33 3h3q h MET 379 Cb 0.53 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.15 3h3q h MET 379 CO 0.02 0.00 -1.93 2.41 1.06 0.00 0.00 176.91 178.47 3h3q n THR 380 N -3.90 1.68 -0.02 2.22 -1.04 -0.50 -4.66 114.28 108.06 3h3q n THR 380 Ca -0.03 -0.72 0.00 0.00 -2.04 0.00 0.00 64.05 61.26 3h3q n THR 380 Cb 0.10 -1.37 -0.05 0.00 -1.82 0.00 0.00 70.33 67.18 3h3q n THR 380 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3h3q n TYR 381 N -3.26 0.00 1.51 -1.42 4.02 -0.68 -4.68 117.16 112.65 3h3q n TYR 381 Ca -0.27 0.00 0.14 0.00 -0.01 0.00 0.00 57.90 57.77 3h3q n TYR 381 Cb 1.05 -0.22 0.67 0.00 -0.02 0.00 0.00 39.34 40.82 3h3q n TYR 381 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3h3q n SER 382 N -1.97 0.45 -1.00 7.72 7.64 0.11 -3.26 113.62 123.31 3h3q n SER 382 Ca -0.05 -0.69 0.09 0.00 1.01 0.00 0.00 58.87 59.22 3h3q n SER 382 Cb 0.43 -0.07 0.23 0.00 -1.01 0.00 0.00 64.21 63.79 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 -0.88 3.42 -4.77 -3.43 4.77 -1.25 -4.95 117.00 109.90 3h3q n LEU 383 Ca 0.16 -1.93 -0.39 0.00 -0.03 0.00 0.00 56.01 53.83 3h3q n LEU 383 Cb 0.25 -0.35 -0.05 0.00 -2.33 0.00 0.00 43.42 40.95 3h3q n LEU 383 CO 0.22 0.84 0.73 -1.10 -1.33 0.00 0.00 177.39 176.75 3h3q s GLN 384 N -1.03 4.56 0.18 3.23 -0.21 -1.20 -4.98 119.66 120.20 3h3q s GLN 384 Ca 0.36 1.59 -0.31 0.00 0.02 0.00 0.00 55.36 57.02 3h3q s GLN 384 Cb 0.19 -2.99 -0.09 0.00 1.00 0.00 0.00 33.01 31.12 3h3q s GLN 384 CO 0.25 0.20 1.44 0.34 -2.12 0.00 0.00 175.29 175.40 3h3q s ASP 385 N -1.23 6.72 -0.01 5.90 -1.08 -1.26 -4.90 116.67 120.81 3h3q s ASP 385 Ca 0.48 2.52 0.16 0.00 -0.52 0.00 0.00 52.55 55.19 3h3q s ASP 385 Cb -0.26 -2.60 -0.22 0.00 -1.46 0.00 0.00 42.92 38.38 3h3q s ASP 385 CO 0.33 -0.69 0.52 1.33 0.52 0.00 0.00 175.17 177.18 3h3q n VAL 386 N 3.25 0.00 0.13 1.11 0.24 -1.26 -4.33 118.33 117.47 3h3q n VAL 386 Ca 0.10 -0.25 0.18 0.00 -2.04 0.00 0.00 64.34 62.33 3h3q n VAL 386 Cb 0.41 0.55 0.77 0.00 -1.47 0.00 0.00 33.84 34.10 3h3q n VAL 386 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3h3q h GLY 387 N 3.42 0.00 -0.77 7.63 0.00 -1.96 0.39 103.07 111.77 3h3q h GLY 387 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3h3q h GLY 387 CO 0.00 0.00 -0.12 0.61 0.00 0.00 0.00 176.54 177.03 3h3q n GLY 388 N -1.49 -0.17 3.55 4.60 0.00 -1.26 -4.90 105.19 105.53 3h3q n GLY 388 Ca 0.05 -0.35 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.27 6.45 0.00 1.61 -1.08 0.12 -4.89 116.67 117.62 3h3q s ASP 389 Ca 0.12 0.02 0.21 0.00 -0.52 0.00 0.00 52.55 52.38 3h3q s ASP 389 Cb 0.10 -2.39 1.21 0.00 -1.46 0.00 0.00 42.92 40.37 3h3q s ASP 389 CO 0.22 -0.88 1.64 0.00 0.52 0.00 0.00 175.17 176.67 3h3q n ALA 390 N 6.69 2.24 0.81 3.66 0.00 -1.26 -1.01 120.51 131.63 3h3q n ALA 390 Ca 0.03 -0.12 0.12 0.00 0.00 0.00 0.00 53.44 53.46 3h3q n ALA 390 Cb 0.48 -1.34 0.16 0.00 0.00 0.00 0.00 19.45 18.75 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 -1.06 0.60 -4.90 0.00 4.13 -1.26 -4.89 115.26 107.88 3h3q n ASN 391 Ca 0.14 -0.20 -0.25 0.00 1.68 0.00 0.00 54.58 55.96 3h3q n ASN 391 Cb 0.09 0.39 -0.04 0.00 -1.54 0.00 0.00 39.78 38.69 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 -3.08 3.36 -0.07 3.10 0.52 -0.18 -4.50 118.94 118.09 3h3q s TRP 392 Ca 0.08 0.04 0.02 0.00 0.02 0.00 0.00 56.10 56.26 3h3q s TRP 392 Cb 0.16 -1.59 0.01 0.00 -1.15 0.00 0.00 33.47 30.90 3h3q s TRP 392 CO 0.74 0.50 -0.13 -1.14 0.02 0.00 0.00 176.95 176.94 3h3q s GLN 393 N -3.39 1.79 -0.46 4.98 0.74 0.49 -4.91 119.66 118.89 3h3q s GLN 393 Ca 0.33 -0.44 -0.28 0.00 0.05 0.00 0.00 55.36 55.02 3h3q s GLN 393 Cb -0.10 -1.47 0.00 0.00 1.10 0.00 0.00 33.01 32.55 3h3q s GLN 393 CO 0.27 0.03 1.52 -1.17 -0.55 0.00 0.00 175.29 175.39 3h3q s LEU 394 N 0.66 3.49 -0.14 3.68 2.96 -1.26 -1.54 118.68 126.53 3h3q s LEU 394 Ca -0.15 0.70 0.18 0.00 -0.22 0.00 0.00 54.13 54.65 3h3q s LEU 394 Cb -0.16 -3.30 -0.26 0.00 0.50 0.00 0.00 46.19 42.97 3h3q s LEU 394 CO 0.04 -1.65 0.24 1.33 -1.32 0.00 0.00 176.35 174.99 3h3q n VAL 395 N 7.09 1.11 -3.83 1.68 0.24 0.25 -4.96 118.33 119.91 3h3q n VAL 395 Ca 0.17 -0.77 -0.12 0.00 -2.04 0.00 0.00 64.34 61.57 3h3q n VAL 395 Cb 0.48 -0.42 -0.14 0.00 -1.47 0.00 0.00 33.84 32.30 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 -2.73 -0.01 -0.00 3.34 1.01 -1.04 -5.01 120.40 115.96 3h3q s VAL 396 Ca -0.09 0.03 -0.00 0.00 0.00 0.00 0.00 61.98 61.91 3h3q s VAL 396 Cb 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 36.38 36.34 3h3q s VAL 396 CO 0.84 0.01 0.01 -0.70 0.00 0.00 0.00 175.10 175.26 3h3q s GLU 397 N 0.18 0.01 -0.28 2.72 2.12 -1.26 -0.52 118.70 121.66 3h3q s GLU 397 Ca -0.01 0.01 -0.12 0.00 0.36 0.00 0.00 54.97 55.21 3h3q s GLU 397 Cb -0.02 0.00 0.11 0.00 0.26 0.00 0.00 34.13 34.48 3h3q s GLU 397 CO -0.01 -0.00 0.64 -2.00 -0.54 0.00 0.00 175.26 173.36 3h3q s GLU 398 N 0.02 0.60 6.45 4.30 2.12 -0.35 -5.02 118.70 126.82 3h3q s GLU 398 Ca -0.00 1.34 0.00 0.00 0.36 0.00 0.00 54.97 56.67 3h3q s GLU 398 Cb -0.00 0.57 0.00 0.00 0.26 0.00 0.00 34.13 34.96 3h3q s GLU 398 CO -0.00 -0.18 0.00 0.41 -0.54 0.00 0.00 175.26 174.95 3h3q n GLY 399 N 5.02 3.25 0.02 -1.50 0.00 -1.26 -1.59 105.19 109.13 3h3q n GLY 399 Ca -0.15 -0.18 0.16 0.00 0.00 0.00 0.00 46.02 45.85 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 14.00 1.03 -3.74 1.61 -0.58 -1.26 -4.88 120.64 126.81 3h3q n GLU 400 Ca 0.00 -0.04 -0.36 0.00 -0.42 0.00 0.00 57.16 56.34 3h3q n GLU 400 Cb 0.00 -1.50 -0.07 0.00 -0.57 0.00 0.00 31.44 29.30 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 -2.00 3.96 -0.03 3.49 1.75 -0.62 -4.08 119.30 121.77 3h3q s MET 401 Ca 0.47 -0.13 0.03 0.00 -1.25 0.00 0.00 55.69 54.81 3h3q s MET 401 Cb 0.22 -3.34 0.00 0.00 2.84 0.00 0.00 34.83 34.55 3h3q s MET 401 CO 0.37 0.45 -0.09 0.15 -0.65 0.00 0.00 175.02 175.25 3h3q s LYS 402 N -0.10 1.01 -0.07 4.11 1.02 -0.74 -1.21 119.74 123.74 3h3q s LYS 402 Ca 0.12 -0.31 0.03 0.00 0.02 0.00 0.00 55.97 55.82 3h3q s LYS 402 Cb -0.12 -0.93 0.01 0.00 -0.52 0.00 0.00 37.83 36.27 3h3q s LYS 402 CO 0.01 0.11 -0.15 0.08 -0.92 0.00 0.00 175.35 174.49 3h3q s VAL 403 N 0.21 1.32 0.21 3.17 1.01 0.32 -1.52 120.40 125.11 3h3q s VAL 403 Ca -0.04 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 61.43 3h3q s VAL 403 Cb -0.09 -1.19 -0.05 0.00 0.00 0.00 0.00 36.38 35.05 3h3q s VAL 403 CO 0.01 0.40 -0.13 -0.31 0.00 0.00 0.00 175.10 175.07 3h3q s TYR 404 N 0.62 1.69 0.17 5.22 2.02 0.57 -0.58 117.35 127.06 3h3q s TYR 404 Ca -0.15 -0.61 -0.14 0.00 -0.37 0.00 0.00 57.07 55.79 3h3q s TYR 404 Cb -0.16 -0.81 0.02 0.00 -0.40 0.00 0.00 41.96 40.60 3h3q s TYR 404 CO 0.04 0.31 0.43 -0.98 -1.57 0.00 0.00 175.55 173.78 3h3q s ARG 405 N -3.67 1.25 -0.14 -0.62 1.70 -0.59 -1.69 118.95 115.19 3h3q s ARG 405 Ca 0.23 -0.94 0.02 0.00 -0.47 0.00 0.00 55.73 54.57 3h3q s ARG 405 Cb 0.00 0.47 0.01 0.00 -0.57 0.00 0.00 34.95 34.86 3h3q s ARG 405 CO 0.07 -0.50 -0.18 0.50 -1.08 0.00 0.00 175.30 174.10 3h3q s ARG 406 N -3.89 2.64 -0.25 3.89 3.52 -0.78 -0.38 118.95 123.70 3h3q s ARG 406 Ca 0.10 -0.71 -0.29 0.00 -0.13 0.00 0.00 55.73 54.70 3h3q s ARG 406 Cb 0.01 -2.22 -0.00 0.00 -1.56 0.00 0.00 34.95 31.18 3h3q s ARG 406 CO -0.04 -0.09 1.27 -1.21 -0.81 0.00 0.00 175.30 174.43 3h3q s GLU 407 N 1.03 4.05 -0.04 5.12 2.02 -1.26 -3.30 118.70 126.31 3h3q s GLU 407 Ca -0.04 1.40 0.02 0.00 0.02 0.00 0.00 54.97 56.37 3h3q s GLU 407 Cb -0.15 -3.82 0.01 0.00 0.10 0.00 0.00 34.13 30.28 3h3q s GLU 407 CO -0.04 -0.94 -0.07 0.08 0.02 0.00 0.00 175.26 174.30 3h3q s VAL 408 N 3.99 0.69 -0.09 2.63 1.01 -1.26 -4.95 120.40 122.41 3h3q s VAL 408 Ca 0.55 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 62.30 3h3q s VAL 408 Cb -0.18 -0.66 0.01 0.00 0.00 0.00 0.00 36.38 35.55 3h3q s VAL 408 CO 0.19 0.25 -0.14 -1.61 0.00 0.00 0.00 175.10 173.79 3h3q s GLU 409 N 0.63 2.01 -0.11 2.72 2.02 -1.26 -0.76 118.70 123.94 3h3q s GLU 409 Ca -0.10 -0.50 0.03 0.00 0.02 0.00 0.00 54.97 54.43 3h3q s GLU 409 Cb -0.13 -1.69 0.00 0.00 0.10 0.00 0.00 34.13 32.42 3h3q s GLU 409 CO 0.01 -0.02 -0.23 -1.21 0.02 0.00 0.00 175.26 173.83 3h3q s GLU 410 N 0.87 2.98 -1.54 1.61 2.02 -0.58 -4.72 118.70 119.33 3h3q s GLU 410 Ca -0.10 -0.85 -0.10 0.00 0.02 0.00 0.00 54.97 53.95 3h3q s GLU 410 Cb -0.15 -2.32 0.08 0.00 0.10 0.00 0.00 34.13 31.84 3h3q s GLU 410 CO 0.01 0.09 0.66 0.09 0.02 0.00 0.00 175.26 176.13 3h3q n ASN 411 N 3.76 -2.20 0.00 -0.19 4.13 -1.26 -1.73 115.26 117.77 3h3q n ASN 411 Ca -0.19 -0.97 0.00 0.00 1.68 0.00 0.00 54.58 55.10 3h3q n ASN 411 Cb 0.52 -3.09 0.00 0.00 -1.54 0.00 0.00 39.78 35.68 3h3q n ASN 411 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3h3q n GLY 412 N -1.70 2.46 3.78 7.41 0.00 -1.26 -5.03 105.19 110.86 3h3q n GLY 412 Ca -0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.91 5.27 -0.27 -0.61 -1.09 -0.71 -5.05 121.20 115.84 3h3q s ILE 413 Ca 0.00 0.57 -0.29 0.00 -2.23 0.00 0.00 60.65 58.70 3h3q s ILE 413 Cb 0.00 -3.61 -0.00 0.00 -1.58 0.00 0.00 42.46 37.27 3h3q s ILE 413 CO 0.00 0.48 1.27 -0.69 -1.23 0.00 0.00 174.94 174.78 3h3q s VAL 414 N -0.22 4.21 -0.55 2.92 1.01 -1.26 -1.53 120.40 124.98 3h3q s VAL 414 Ca 0.18 1.39 0.05 0.00 0.00 0.00 0.00 61.98 63.60 3h3q s VAL 414 Cb -0.14 -4.14 0.03 0.00 0.00 0.00 0.00 36.38 32.14 3h3q s VAL 414 CO 0.06 -0.39 0.62 0.18 0.00 0.00 0.00 175.10 175.57 3h3q n LEU 415 N 7.32 1.31 0.00 3.92 4.77 0.06 -4.74 117.00 129.64 3h3q n LEU 415 Ca 0.14 -0.97 0.00 0.00 -0.03 0.00 0.00 56.01 55.16 3h3q n LEU 415 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 3h3q n LEU 415 CO 0.61 0.28 0.00 0.47 -1.33 0.00 0.00 177.39 177.42 3h3q n ASP 416 N 0.17 0.00 -4.63 -1.43 9.92 -1.19 -4.35 116.55 115.04 3h3q n ASP 416 Ca 0.03 0.00 -0.44 0.00 -0.53 0.00 0.00 54.79 53.85 3h3q n ASP 416 Cb 0.11 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.58 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 1.67 -4.86 -0.24 -0.02 -1.21 -4.66 135.00 125.69 3h3q n PRO 417 Ca 0.00 0.58 -0.26 0.00 -2.02 0.00 0.00 63.50 61.81 3h3q n PRO 417 Cb 0.00 -2.04 -0.16 0.00 -0.02 0.00 0.00 33.50 31.28 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 -0.14 1.96 -0.06 2.45 0.20 0.08 -1.87 118.68 121.29 3h3q s LEU 418 Ca 0.58 -0.35 0.02 0.00 0.69 0.00 0.00 54.13 55.06 3h3q s LEU 418 Cb -0.65 -0.97 0.02 0.00 -0.43 0.00 0.00 46.19 44.16 3h3q s LEU 418 CO 0.61 0.18 -0.09 -0.75 -0.29 0.00 0.00 176.35 176.00 3h3q s LYS 419 N -0.11 1.40 0.09 1.98 2.20 -0.69 0.17 119.74 124.79 3h3q s LYS 419 Ca -0.00 -0.30 0.09 0.00 -0.36 0.00 0.00 55.97 55.39 3h3q s LYS 419 Cb -0.10 -1.23 -0.04 0.00 -1.51 0.00 0.00 37.83 34.95 3h3q s LYS 419 CO 0.01 -0.03 -0.21 0.00 -0.36 0.00 0.00 175.35 174.77 3h3q s ALA 420 N 0.82 2.56 0.02 3.13 0.00 0.17 -0.31 121.76 128.15 3h3q s ALA 420 Ca -0.12 -1.32 0.06 0.00 0.00 0.00 0.00 51.96 50.57 3h3q s ALA 420 Cb -0.15 -0.61 -0.02 0.00 0.00 0.00 0.00 23.12 22.34 3h3q s ALA 420 CO 0.02 0.57 -0.17 0.95 0.00 0.00 0.00 175.76 177.13 3h3q s THR 421 N -1.03 1.32 0.20 0.00 -4.23 -0.58 -0.05 115.64 111.27 3h3q s THR 421 Ca 0.16 -0.94 -0.09 0.00 -1.18 0.00 0.00 61.69 59.64 3h3q s THR 421 Cb -0.10 -1.14 -0.01 0.00 1.34 0.00 0.00 72.50 72.58 3h3q s THR 421 CO 0.07 0.19 0.32 -2.28 -0.54 0.00 0.00 174.62 172.38 3h3q s HIS 422 N -0.66 0.55 -0.15 3.99 2.46 0.22 -1.80 115.29 119.89 3h3q s HIS 422 Ca 0.05 -0.88 -0.04 0.00 0.47 0.00 0.00 55.06 54.66 3h3q s HIS 422 Cb -0.07 -0.07 0.07 0.00 -0.13 0.00 0.00 32.58 32.38 3h3q s HIS 422 CO 0.01 -0.80 0.25 0.00 -2.47 0.00 0.00 174.74 171.72 3h3q s ALA 423 N -4.03 -0.48 -0.20 1.58 0.00 -1.26 -0.62 121.76 116.76 3h3q s ALA 423 Ca 0.24 0.72 0.01 0.00 0.00 0.00 0.00 51.96 52.93 3h3q s ALA 423 Cb 0.03 -1.12 0.03 0.00 0.00 0.00 0.00 23.12 22.05 3h3q s ALA 423 CO 0.06 -0.83 -0.18 0.08 0.00 0.00 0.00 175.76 174.90 3h3q s VAL 424 N 2.39 2.10 0.33 0.00 1.01 0.73 -4.87 120.40 122.09 3h3q s VAL 424 Ca 0.04 -1.10 -0.27 0.00 0.00 0.00 0.00 61.98 60.65 3h3q s VAL 424 Cb -0.13 -1.96 -0.09 0.00 0.00 0.00 0.00 36.38 34.19 3h3q s VAL 424 CO -0.10 0.41 1.07 -0.54 0.00 0.00 0.00 175.10 175.94 3h3q s LYS 425 N 1.25 4.44 0.00 2.72 1.02 -1.26 -0.89 119.74 127.02 3h3q s LYS 425 Ca 0.02 1.65 0.00 0.00 0.02 0.00 0.00 55.97 57.66 3h3q s LYS 425 Cb -0.15 -2.90 0.00 0.00 -0.52 0.00 0.00 37.83 34.26 3h3q s LYS 425 CO -0.11 0.08 0.00 0.41 -0.92 0.00 0.00 175.35 174.80 3h3q n GLY 426 N 0.83 0.64 3.12 -3.33 0.00 -0.35 -4.93 105.19 101.18 3h3q n GLY 426 Ca 0.02 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.00 0.53 0.30 1.61 -7.23 -1.26 -4.83 120.40 107.52 3h3q s VAL 427 Ca 0.00 -1.71 0.06 0.00 -1.81 0.00 0.00 61.98 58.52 3h3q s VAL 427 Cb 0.00 -1.40 -0.02 0.00 0.56 0.00 0.00 36.38 35.53 3h3q s VAL 427 CO 0.00 -0.80 0.42 0.42 -0.31 0.00 0.00 175.10 174.83 3h3q s THR 428 N -3.21 4.53 0.40 5.32 -4.23 -1.26 -3.38 115.64 113.81 3h3q s THR 428 Ca 0.06 -1.01 0.07 0.00 -1.18 0.00 0.00 61.69 59.63 3h3q s THR 428 Cb 0.03 -3.58 0.23 0.00 1.34 0.00 0.00 72.50 70.52 3h3q s THR 428 CO -0.05 -0.23 2.01 1.23 -0.54 0.00 0.00 174.62 177.04 3h3q h GLY 429 N 1.02 0.50 1.07 3.99 0.00 -1.86 -1.28 103.07 106.52 3h3q h GLY 429 Ca -0.48 -0.22 -0.15 0.00 0.00 0.00 0.00 47.33 46.48 3h3q h GLY 429 CO 0.56 0.21 -0.38 0.84 0.00 0.00 0.00 176.54 177.78 3h3q h HIS 430 N 0.47 1.02 -0.55 5.60 -0.00 -1.89 -1.33 115.15 118.46 3h3q h HIS 430 Ca 0.12 -0.32 -0.08 0.00 -0.00 0.00 0.00 60.37 60.09 3h3q h HIS 430 Cb 0.07 -0.21 -0.02 0.00 -0.00 0.00 0.00 27.41 27.25 3h3q h HIS 430 CO 0.00 1.12 0.04 0.93 -0.00 0.00 0.00 177.93 180.02 3h3q h GLU 431 N 0.62 0.95 -0.08 5.26 5.08 -1.66 -1.28 114.58 123.48 3h3q h GLU 431 Ca 0.05 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.11 3h3q h GLU 431 Cb 0.97 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.12 3h3q h GLU 431 CO 0.09 0.94 0.01 0.28 -1.00 0.00 0.00 179.01 179.34 3h3q h VAL 432 N 0.84 1.21 -0.62 3.13 2.07 -1.09 -2.00 116.25 119.80 3h3q h VAL 432 Ca 0.16 -0.65 -0.05 0.00 0.82 0.00 0.00 66.70 66.98 3h3q h VAL 432 Cb 0.49 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 3h3q h VAL 432 CO 0.02 0.18 0.20 0.00 0.02 0.00 0.00 177.57 178.00 3h3q h ASN 434 N 0.88 0.17 0.38 0.00 -0.26 -1.05 -0.92 115.58 114.78 3h3q h ASN 434 Ca 0.20 0.11 -0.22 0.00 -0.56 0.00 0.00 56.30 55.82 3h3q h ASN 434 Cb 0.27 0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.64 3h3q h ASN 434 CO -0.01 0.08 -0.94 1.88 -1.06 0.00 0.00 177.43 177.38 3h3q h TYR 435 N 0.37 0.55 -0.65 1.19 -1.99 -1.15 -0.92 116.97 114.38 3h3q h TYR 435 Ca 0.36 -0.30 -0.04 0.00 2.00 0.00 0.00 58.73 60.75 3h3q h TYR 435 Cb 0.53 -0.06 -0.03 0.00 2.00 0.00 0.00 36.73 39.17 3h3q h TYR 435 CO -0.20 1.12 0.26 0.35 -0.00 0.00 0.00 178.16 179.69 3h3q h PHE 436 N 0.21 0.96 0.08 4.88 3.57 -0.77 -3.31 116.94 122.56 3h3q h PHE 436 Ca -0.07 -0.06 -0.31 0.00 3.53 0.00 0.00 57.97 61.06 3h3q h PHE 436 Cb 1.57 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 40.00 3h3q h PHE 436 CO 0.05 0.74 -1.61 2.35 -2.23 0.00 0.00 178.31 177.61 3h3q h TRP 437 N 0.93 0.31 -3.16 0.41 7.01 -1.12 -3.46 115.95 116.87 3h3q h TRP 437 Ca 0.22 -0.23 -0.56 0.00 2.11 0.00 0.00 58.89 60.43 3h3q h TRP 437 Cb 0.18 -0.01 -0.06 0.00 -2.10 0.00 0.00 29.16 27.18 3h3q h TRP 437 CO 0.01 1.33 1.07 1.21 -2.79 0.00 0.00 178.44 179.27 3h3q s ASN 438 N -6.75 6.28 0.63 2.65 2.47 -0.36 -4.89 114.94 114.98 3h3q s ASN 438 Ca -0.09 0.61 0.37 0.00 0.42 0.00 0.00 52.86 54.16 3h3q s ASN 438 Cb 0.07 -2.54 2.14 0.00 -1.45 0.00 0.00 41.25 39.47 3h3q s ASN 438 CO 0.83 -1.52 2.32 -0.37 -3.72 0.00 0.00 177.10 174.64 3h3q h VAL 439 N 6.42 0.27 0.00 -5.21 -1.51 -1.89 -2.86 116.25 111.46 3h3q h VAL 439 Ca -0.27 -0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.20 3h3q h VAL 439 Cb 1.10 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 31.26 3h3q h VAL 439 CO 1.12 0.00 0.00 0.44 -1.23 0.00 0.00 177.57 177.90 3h3q h ASP 440 N 0.00 0.00 -0.00 4.19 3.32 -1.96 -2.97 116.42 118.99 3h3q h ASP 440 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3h3q h ASP 440 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3h3q h ASP 440 CO 0.00 0.00 -0.06 1.33 -1.72 0.00 0.00 179.24 178.79 3h3q n VAL 441 N -2.73 0.00 -0.31 -1.35 0.24 -1.08 -4.73 118.33 108.37 3h3q n VAL 441 Ca 0.00 -0.47 0.16 0.00 -2.04 0.00 0.00 64.34 61.99 3h3q n VAL 441 Cb 0.21 1.07 0.33 0.00 -1.47 0.00 0.00 33.84 33.98 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 0.68 0.15 0.00 7.34 9.65 -1.54 0.34 114.38 131.00 3h3q h ARG 442 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3h3q h ARG 442 Cb 0.17 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.72 3h3q h ARG 442 CO 0.00 0.10 0.00 -0.91 2.80 0.00 0.00 179.97 181.96 3h3q h ASN 443 N 0.16 0.00 1.26 -3.80 -0.26 -1.85 0.09 115.58 111.18 3h3q h ASN 443 Ca 0.60 0.00 -0.06 0.00 -0.56 0.00 0.00 56.30 56.28 3h3q h ASN 443 Cb 1.28 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.53 3h3q h ASN 443 CO -0.72 0.00 -0.29 0.44 -1.06 0.00 0.00 177.43 175.81 3h3q h ASP 444 N 0.00 0.00 0.00 5.81 5.19 -1.27 -3.38 116.42 122.77 3h3q h ASP 444 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3h3q h ASP 444 Cb 0.59 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.10 3h3q h ASP 444 CO 0.00 0.29 -0.90 -2.67 -3.12 0.00 0.00 179.24 172.84 3h3q n TRP 445 N -3.29 0.00 -2.65 4.55 4.27 -1.06 -5.04 117.44 114.22 3h3q n TRP 445 Ca 0.01 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 53.21 3h3q n TRP 445 Cb 0.55 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.45 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 -1.90 4.68 0.00 -2.67 2.56 -0.01 -4.73 118.70 116.63 3h3q s GLU 446 Ca 0.00 1.56 0.02 0.00 0.00 0.00 0.00 54.97 56.55 3h3q s GLU 446 Cb 0.00 -3.32 -0.01 0.00 2.00 0.00 0.00 34.13 32.79 3h3q s GLU 446 CO 0.00 0.20 0.20 0.25 -0.56 0.00 0.00 175.26 175.35 3h3q n THR 447 N 2.43 0.00 -0.44 -1.70 -2.24 -1.26 -4.67 114.28 106.40 3h3q n THR 447 Ca 0.02 -0.46 0.10 0.00 -2.27 0.00 0.00 64.05 61.44 3h3q n THR 447 Cb 0.48 1.01 0.30 0.00 -2.10 0.00 0.00 70.33 70.02 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 -0.79 1.31 -3.87 4.28 -2.24 -1.26 -4.91 114.28 106.80 3h3q n THR 448 Ca 0.01 -1.10 -0.35 0.00 -2.27 0.00 0.00 64.05 60.34 3h3q n THR 448 Cb 0.04 0.35 -0.09 0.00 -2.10 0.00 0.00 70.33 68.54 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 -1.34 5.11 -0.22 2.28 -1.09 -1.26 -0.87 121.20 123.81 3h3q s ILE 449 Ca 0.44 0.08 -0.19 0.00 -2.23 0.00 0.00 60.65 58.76 3h3q s ILE 449 Cb 0.26 -3.32 -0.18 0.00 -1.58 0.00 0.00 42.46 37.64 3h3q s ILE 449 CO 0.26 0.45 0.09 1.21 -1.23 0.00 0.00 174.94 175.72 3h3q n GLU 450 N 3.50 0.58 -3.78 2.79 2.13 0.04 -4.60 120.64 121.30 3h3q n GLU 450 Ca -0.16 0.48 -0.09 0.00 0.66 0.00 0.00 57.16 58.05 3h3q n GLU 450 Cb 0.52 -1.68 -0.06 0.00 0.27 0.00 0.00 31.44 30.48 3h3q n GLU 450 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 3h3q s ASN 451 N -7.01 -0.01 0.07 4.31 3.84 -1.20 -5.01 114.94 109.93 3h3q s ASN 451 Ca -0.31 -0.55 -0.20 0.00 0.21 0.00 0.00 52.86 52.02 3h3q s ASN 451 Cb 0.08 0.39 0.04 0.00 -0.55 0.00 0.00 41.25 41.22 3h3q s ASN 451 CO 0.58 -0.78 0.47 0.72 -2.79 0.00 0.00 177.10 175.29 3h3q s PHE 452 N -3.85 -0.33 0.05 0.43 -0.12 -1.26 -1.00 117.98 111.89 3h3q s PHE 452 Ca 0.05 0.25 -0.11 0.00 -0.05 0.00 0.00 56.93 57.07 3h3q s PHE 452 Cb 0.04 0.30 0.01 0.00 -0.63 0.00 0.00 43.02 42.74 3h3q s PHE 452 CO -0.11 -0.65 0.25 -3.38 -0.05 0.00 0.00 175.22 171.28 3h3q s HIS 453 N -2.86 -0.01 -0.18 3.49 -3.43 -0.64 -5.01 115.29 106.65 3h3q s HIS 453 Ca -0.03 -0.20 -0.29 0.00 -0.80 0.00 0.00 55.06 53.74 3h3q s HIS 453 Cb -0.00 0.03 -0.02 0.00 -1.43 0.00 0.00 32.58 31.16 3h3q s HIS 453 CO -0.05 -0.48 1.41 0.08 -2.00 0.00 0.00 174.74 173.70 3h3q s VAL 454 N -2.74 4.01 0.16 -5.38 1.01 -1.26 -1.61 120.40 114.58 3h3q s VAL 454 Ca -0.04 1.19 -0.04 0.00 0.00 0.00 0.00 61.98 63.10 3h3q s VAL 454 Cb -0.00 -3.86 -0.12 0.00 0.00 0.00 0.00 36.38 32.39 3h3q s VAL 454 CO -0.05 -0.21 1.39 0.58 0.00 0.00 0.00 175.10 176.82 3h3q h VAL 455 N 5.71 1.36 -1.71 2.92 2.07 -0.20 -3.47 116.25 122.92 3h3q h VAL 455 Ca -0.30 -2.15 0.03 0.00 0.82 0.00 0.00 66.70 65.10 3h3q h VAL 455 Cb 1.13 2.13 -0.25 0.00 -1.52 0.00 0.00 31.29 32.77 3h3q h VAL 455 CO 0.98 0.65 0.37 -0.70 0.02 0.00 0.00 177.57 178.89 3h3q s GLU 456 N -3.60 0.60 -0.30 1.57 2.12 -1.16 -4.99 118.70 112.95 3h3q s GLU 456 Ca -0.07 0.69 -0.11 0.00 0.36 0.00 0.00 54.97 55.84 3h3q s GLU 456 Cb 0.10 0.29 -0.04 0.00 0.26 0.00 0.00 34.13 34.75 3h3q s GLU 456 CO 0.86 -0.08 0.20 0.99 -0.54 0.00 0.00 175.26 176.68 3h3q s THR 457 N 0.22 5.21 -0.08 -1.70 2.01 -1.26 0.03 115.64 120.06 3h3q s THR 457 Ca 0.02 0.02 0.07 0.00 0.31 0.00 0.00 61.69 62.10 3h3q s THR 457 Cb -0.05 -3.54 -0.24 0.00 0.01 0.00 0.00 72.50 68.68 3h3q s THR 457 CO -0.04 0.17 0.52 0.18 -0.69 0.00 0.00 174.62 174.77 3h3q n LEU 458 N 5.06 1.41 -3.70 4.42 4.77 -0.36 -5.02 117.00 123.58 3h3q n LEU 458 Ca -0.14 0.32 -0.02 0.00 -0.03 0.00 0.00 56.01 56.14 3h3q n LEU 458 Cb 0.51 -0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 41.36 3h3q n LEU 458 CO 0.34 0.55 0.84 0.00 -1.33 0.00 0.00 177.39 177.78 3h3q s ALA 459 N -2.58 -1.86 0.57 -1.18 0.00 -1.02 -4.72 121.76 110.97 3h3q s ALA 459 Ca -0.11 0.35 0.29 0.00 0.00 0.00 0.00 51.96 52.49 3h3q s ALA 459 Cb 0.07 0.53 1.47 0.00 0.00 0.00 0.00 23.12 25.20 3h3q s ALA 459 CO 0.80 -1.03 1.93 -0.44 0.00 0.00 0.00 175.76 177.02 3h3q h ASP 460 N 2.00 0.00 -0.22 0.00 3.32 -2.02 -2.17 116.42 117.33 3h3q h ASP 460 Ca -0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.79 3h3q h ASP 460 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 3h3q h ASP 460 CO 0.26 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.32 3h3q n ASN 461 N -3.97 2.55 -3.72 6.45 6.94 -1.26 -5.02 115.26 117.23 3h3q n ASN 461 Ca 0.10 -1.93 -0.14 0.00 -0.02 0.00 0.00 54.58 52.59 3h3q n ASN 461 Cb 0.69 -0.15 -0.14 0.00 -2.36 0.00 0.00 39.78 37.83 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 -0.96 -0.36 0.09 -2.53 0.00 -0.82 -1.61 121.76 115.56 3h3q s ALA 462 Ca 0.15 0.78 0.01 0.00 0.00 0.00 0.00 51.96 52.90 3h3q s ALA 462 Cb 0.08 -0.61 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 3h3q s ALA 462 CO 0.11 -0.27 -0.04 0.96 0.00 0.00 0.00 175.76 176.52 3h3q s ILE 463 N 1.46 0.49 -0.18 0.00 -4.36 -0.13 -1.23 121.20 117.25 3h3q s ILE 463 Ca -0.07 -1.89 -0.04 0.00 -0.26 0.00 0.00 60.65 58.39 3h3q s ILE 463 Cb -0.11 -1.66 -0.02 0.00 1.25 0.00 0.00 42.46 41.91 3h3q s ILE 463 CO -0.07 -0.88 -0.03 -0.63 0.24 0.00 0.00 174.94 173.57 3h3q s ILE 464 N -3.76 3.81 -0.08 8.37 1.01 0.10 0.14 121.20 130.81 3h3q s ILE 464 Ca 0.11 -0.37 0.02 0.00 0.00 0.00 0.00 60.65 60.41 3h3q s ILE 464 Cb 0.06 -2.70 -0.02 0.00 0.01 0.00 0.00 42.46 39.81 3h3q s ILE 464 CO -0.06 0.46 -0.13 -0.63 0.00 0.00 0.00 174.94 174.57 3h3q s ILE 465 N 0.80 3.10 -0.14 2.92 1.01 0.74 0.58 121.20 130.20 3h3q s ILE 465 Ca -0.01 -0.69 -0.06 0.00 0.00 0.00 0.00 60.65 59.89 3h3q s ILE 465 Cb -0.14 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 3h3q s ILE 465 CO 0.02 0.57 0.08 -0.47 0.00 0.00 0.00 174.94 175.14 3h3q s TYR 466 N -0.36 3.37 0.02 3.97 5.04 -0.64 -0.98 117.35 127.78 3h3q s TYR 466 Ca 0.04 0.29 -0.11 0.00 -2.44 0.00 0.00 57.07 54.85 3h3q s TYR 466 Cb -0.12 -1.97 0.01 0.00 0.35 0.00 0.00 41.96 40.22 3h3q s TYR 466 CO 0.02 0.45 0.24 1.14 -1.34 0.00 0.00 175.55 176.06 3h3q s GLN 467 N -0.41 0.67 -0.01 4.97 -2.07 0.89 -1.62 119.66 122.08 3h3q s GLN 467 Ca 0.10 -0.43 0.02 0.00 -1.82 0.00 0.00 55.36 53.22 3h3q s GLN 467 Cb -0.12 0.28 -0.03 0.00 -1.09 0.00 0.00 33.01 32.05 3h3q s GLN 467 CO 0.02 -0.19 -0.02 0.95 -1.32 0.00 0.00 175.29 174.73 3h3q s THR 468 N -1.96 4.01 -0.03 3.63 -4.23 -0.17 -0.65 115.64 116.24 3h3q s THR 468 Ca -0.10 -0.60 -0.01 0.00 -1.18 0.00 0.00 61.69 59.80 3h3q s THR 468 Cb -0.04 -2.76 -0.04 0.00 1.34 0.00 0.00 72.50 71.01 3h3q s THR 468 CO -0.00 0.42 0.06 -1.00 -0.54 0.00 0.00 174.62 173.56 3h3q s HIS 469 N -1.03 3.27 0.75 3.99 3.76 -0.58 -0.78 115.29 124.67 3h3q s HIS 469 Ca 0.18 0.22 -0.15 0.00 -0.15 0.00 0.00 55.06 55.15 3h3q s HIS 469 Cb -0.11 -1.75 0.02 0.00 1.11 0.00 0.00 32.58 31.85 3h3q s HIS 469 CO 0.08 0.54 0.97 1.63 -0.85 0.00 0.00 174.74 177.12 3h3q n LYS 470 N 1.42 0.39 -2.45 1.40 5.02 -0.05 -4.40 118.16 119.49 3h3q n LYS 470 Ca -0.15 0.19 -0.43 0.00 -2.02 0.00 0.00 58.31 55.91 3h3q n LYS 470 Cb 0.53 -2.23 -0.02 0.00 -0.02 0.00 0.00 35.03 33.28 3h3q n LYS 470 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3h3q s ARG 471 N -3.50 4.26 0.00 1.97 0.52 -1.26 -4.82 118.95 116.12 3h3q s ARG 471 Ca 0.72 1.65 0.14 0.00 -0.52 0.00 0.00 55.73 57.72 3h3q s ARG 471 Cb -0.33 -3.71 0.09 0.00 0.52 0.00 0.00 34.95 31.52 3h3q s ARG 471 CO 0.52 -0.65 0.92 1.33 0.02 0.00 0.00 175.30 177.44 3h3q n VAL 472 N 5.21 0.00 -4.25 3.52 0.24 -1.26 -4.92 118.33 116.87 3h3q n VAL 472 Ca 0.13 -0.47 -0.14 0.00 -2.04 0.00 0.00 64.34 61.82 3h3q n VAL 472 Cb 0.45 1.27 -0.10 0.00 -1.47 0.00 0.00 33.84 33.99 3h3q n VAL 472 CO 0.00 0.00 0.00 -1.66 -2.14 0.00 0.00 176.83 173.03 3h3q s TRP 473 N -1.30 1.32 -0.99 6.34 -2.14 -1.26 -4.93 118.94 115.99 3h3q s TRP 473 Ca 0.16 -1.33 -0.23 0.00 2.66 0.00 0.00 56.10 57.35 3h3q s TRP 473 Cb 0.12 -0.69 0.04 0.00 -3.10 0.00 0.00 33.47 29.84 3h3q s TRP 473 CO 0.21 -0.55 1.46 -2.14 -2.66 0.00 0.00 176.95 173.28 3h3q s PRO 474 N -4.08 3.50 0.16 3.25 0.02 -1.26 -4.83 135.00 131.75 3h3q s PRO 474 Ca 0.39 -0.99 -0.18 0.00 0.02 0.00 0.00 61.00 60.23 3h3q s PRO 474 Cb 0.07 -5.23 0.06 0.00 0.02 0.00 0.00 34.50 29.43 3h3q s PRO 474 CO 0.13 -2.26 0.88 0.00 -0.33 0.00 0.00 177.00 175.42 3h3q n ALA 475 N 9.20 -2.29 -1.26 -1.55 0.00 -1.26 -5.12 120.51 118.22 3h3q n ALA 475 Ca 0.30 -0.88 -0.33 0.00 0.00 0.00 0.00 53.44 52.53 3h3q n ALA 475 Cb 0.51 0.50 0.10 0.00 0.00 0.00 0.00 19.45 20.55 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 -3.09 4.21 0.46 0.00 0.01 -1.26 -4.93 113.70 109.10 3h3q s SER 476 Ca 0.20 2.18 -0.24 0.00 1.31 0.00 0.00 55.95 59.39 3h3q s SER 476 Cb -0.02 -2.57 -0.07 0.00 0.21 0.00 0.00 66.02 63.56 3h3q s SER 476 CO 0.05 -2.24 1.33 -1.58 0.41 0.00 0.00 173.24 171.21 3h3q s GLN 477 N -4.20 3.67 -0.03 12.44 0.74 -1.26 -4.79 119.66 126.22 3h3q s GLN 477 Ca 0.70 2.20 -0.06 0.00 0.05 0.00 0.00 55.36 58.25 3h3q s GLN 477 Cb -0.25 -2.57 -0.04 0.00 1.10 0.00 0.00 33.01 31.25 3h3q s GLN 477 CO 0.48 -0.75 0.21 1.03 -0.55 0.00 0.00 175.29 175.71 3h3q s ARG 478 N -2.51 3.52 0.46 1.67 3.00 -1.26 -0.02 118.95 123.81 3h3q s ARG 478 Ca 0.62 -0.14 0.05 0.00 0.00 0.00 0.00 55.73 56.27 3h3q s ARG 478 Cb -0.39 -3.12 -0.03 0.00 0.00 0.00 0.00 34.95 31.40 3h3q s ARG 478 CO 0.49 0.69 0.12 0.16 0.00 0.00 0.00 175.30 176.76 3h3q s ASP 479 N -1.55 4.23 -0.13 0.23 1.47 0.44 -1.53 116.67 119.82 3h3q s ASP 479 Ca 0.24 -1.35 -0.19 0.00 1.18 0.00 0.00 52.55 52.43 3h3q s ASP 479 Cb -0.13 -0.02 0.05 0.00 -0.34 0.00 0.00 42.92 42.47 3h3q s ASP 479 CO 0.13 -0.70 0.49 0.54 0.68 0.00 0.00 175.17 176.31 3h3q s VAL 480 N -2.74 0.01 -0.13 2.11 0.11 0.17 -1.37 120.40 118.57 3h3q s VAL 480 Ca 0.28 -0.10 -0.01 0.00 -2.93 0.00 0.00 61.98 59.21 3h3q s VAL 480 Cb 0.04 -0.73 0.04 0.00 -1.53 0.00 0.00 36.38 34.20 3h3q s VAL 480 CO 0.15 -0.05 -0.01 -0.22 -3.33 0.00 0.00 175.10 171.64 3h3q s LEU 481 N -0.29 1.06 -0.03 2.54 2.96 -1.26 -0.08 118.68 123.59 3h3q s LEU 481 Ca -0.05 -0.44 -0.08 0.00 -0.22 0.00 0.00 54.13 53.34 3h3q s LEU 481 Cb -0.03 -0.64 0.01 0.00 0.50 0.00 0.00 46.19 46.03 3h3q s LEU 481 CO 0.03 -0.21 0.18 -0.72 -1.32 0.00 0.00 176.35 174.31 3h3q s TYR 482 N 1.83 -0.07 0.08 5.38 -0.85 -0.15 -1.86 117.35 121.71 3h3q s TYR 482 Ca 0.02 0.14 -0.29 0.00 -0.52 0.00 0.00 57.07 56.43 3h3q s TYR 482 Cb -0.14 0.01 -0.05 0.00 0.38 0.00 0.00 41.96 42.16 3h3q s TYR 482 CO -0.07 -0.24 0.91 -1.17 -1.52 0.00 0.00 175.55 173.46 3h3q s LEU 483 N -0.89 4.47 -0.15 -3.49 0.20 0.23 -0.19 118.68 118.86 3h3q s LEU 483 Ca -0.10 1.68 0.01 0.00 0.69 0.00 0.00 54.13 56.42 3h3q s LEU 483 Cb -0.05 -3.49 0.02 0.00 -0.43 0.00 0.00 46.19 42.23 3h3q s LEU 483 CO 0.02 -0.08 -0.18 -0.55 -0.29 0.00 0.00 176.35 175.27 3h3q s SER 484 N 0.15 2.90 0.01 3.68 0.15 0.12 -1.50 113.70 119.21 3h3q s SER 484 Ca 0.46 -0.56 0.01 0.00 0.70 0.00 0.00 55.95 56.55 3h3q s SER 484 Cb -0.22 -1.33 -0.01 0.00 -1.71 0.00 0.00 66.02 62.75 3h3q s SER 484 CO 0.28 -0.00 -0.04 0.54 1.20 0.00 0.00 173.24 175.22 3h3q s VAL 485 N 1.23 0.26 -0.12 4.45 0.11 -0.82 -0.95 120.40 124.55 3h3q s VAL 485 Ca 0.01 -0.35 0.02 0.00 -2.93 0.00 0.00 61.98 58.74 3h3q s VAL 485 Cb -0.14 -0.26 -0.01 0.00 -1.53 0.00 0.00 36.38 34.45 3h3q s VAL 485 CO -0.09 -0.06 -0.18 -0.51 -3.33 0.00 0.00 175.10 170.93 3h3q s ILE 486 N -0.41 2.55 0.02 7.04 2.07 -0.64 -1.16 121.20 130.68 3h3q s ILE 486 Ca -0.02 -0.83 0.01 0.00 -1.41 0.00 0.00 60.65 58.39 3h3q s ILE 486 Cb -0.03 -2.04 -0.02 0.00 0.13 0.00 0.00 42.46 40.50 3h3q s ILE 486 CO -0.00 0.54 -0.04 -0.13 -1.91 0.00 0.00 174.94 173.39 3h3q s ARG 487 N 0.47 0.35 -0.12 3.50 1.81 0.20 -4.87 118.95 120.28 3h3q s ARG 487 Ca -0.13 -0.50 -0.17 0.00 -1.72 0.00 0.00 55.73 53.21 3h3q s ARG 487 Cb -0.17 -0.12 -0.04 0.00 -0.45 0.00 0.00 34.95 34.17 3h3q s ARG 487 CO 0.05 0.01 0.42 0.21 -0.68 0.00 0.00 175.30 175.32 3h3q s LYS 488 N -1.08 4.30 -0.38 3.54 2.20 -1.26 -1.40 119.74 125.65 3h3q s LYS 488 Ca -0.09 0.35 -0.10 0.00 -0.36 0.00 0.00 55.97 55.78 3h3q s LYS 488 Cb -0.07 -3.42 0.04 0.00 -1.51 0.00 0.00 37.83 32.87 3h3q s LYS 488 CO -0.00 0.21 0.21 0.42 -0.36 0.00 0.00 175.35 175.82 3h3q s ILE 489 N 0.49 4.37 0.78 5.43 -1.09 0.36 -5.00 121.20 126.55 3h3q s ILE 489 Ca 0.23 -1.05 -0.12 0.00 -2.23 0.00 0.00 60.65 57.48 3h3q s ILE 489 Cb -0.15 -3.51 0.07 0.00 -1.58 0.00 0.00 42.46 37.29 3h3q s ILE 489 CO 0.09 -0.31 1.12 -2.16 -1.23 0.00 0.00 174.94 172.45 3h3q s PRO 490 N 1.50 2.04 -0.22 2.79 0.04 -1.26 -1.61 135.00 138.27 3h3q s PRO 490 Ca 0.02 1.37 -0.18 0.00 0.04 0.00 0.00 61.00 62.25 3h3q s PRO 490 Cb -0.20 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 3h3q s PRO 490 CO 0.05 -1.84 0.50 0.00 0.04 0.00 0.00 177.00 175.75 3h3q s ALA 491 N -2.64 3.56 -2.80 8.56 0.00 -1.26 -4.78 121.76 122.41 3h3q s ALA 491 Ca 0.65 -0.50 0.24 0.00 0.00 0.00 0.00 51.96 52.35 3h3q s ALA 491 Cb -0.20 -2.81 0.32 0.00 0.00 0.00 0.00 23.12 20.42 3h3q s ALA 491 CO 0.53 -0.53 1.34 1.28 0.00 0.00 0.00 175.76 178.37 3h3q n LEU 492 N 5.02 3.04 -4.59 0.00 4.77 -1.26 -4.83 117.00 119.15 3h3q n LEU 492 Ca -0.05 -1.12 -0.24 0.00 -0.03 0.00 0.00 56.01 54.57 3h3q n LEU 492 Cb 0.50 -0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 41.43 3h3q n LEU 492 CO 0.41 0.56 -0.36 0.42 -1.33 0.00 0.00 177.39 177.09 3h3q s THR 493 N -1.84 2.83 0.30 -5.08 -4.23 -1.26 -5.07 115.64 101.30 3h3q s THR 493 Ca 0.32 -2.08 0.11 0.00 -1.18 0.00 0.00 61.69 58.86 3h3q s THR 493 Cb 0.21 -2.67 0.01 0.00 1.34 0.00 0.00 72.50 71.39 3h3q s THR 493 CO 0.31 -0.31 1.68 1.05 -0.54 0.00 0.00 174.62 176.81 3h3q h GLU 494 N 1.97 0.01 0.00 3.99 4.11 -2.03 -3.27 114.58 119.35 3h3q h GLU 494 Ca -0.42 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.00 3h3q h GLU 494 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3h3q h GLU 494 CO 0.63 0.54 -1.02 0.09 0.07 0.00 0.00 179.01 179.33 3h3q n ASN 495 N -3.90 2.03 -4.72 3.06 5.03 -1.26 -4.99 115.26 110.51 3h3q n ASN 495 Ca -0.01 -0.26 -0.42 0.00 0.87 0.00 0.00 54.58 54.75 3h3q n ASN 495 Cb 0.55 1.25 -0.03 0.00 -1.02 0.00 0.00 39.78 40.52 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 -2.54 7.25 0.63 6.41 1.01 -1.24 -4.98 116.67 123.21 3h3q s ASP 496 Ca -0.01 1.88 -0.16 0.00 0.71 0.00 0.00 52.55 54.97 3h3q s ASP 496 Cb 0.06 -2.58 -0.02 0.00 1.01 0.00 0.00 42.92 41.39 3h3q s ASP 496 CO 0.35 -0.32 1.11 -2.16 0.21 0.00 0.00 175.17 174.36 3h3q s PRO 497 N 0.75 2.97 0.64 8.23 0.04 -1.26 -4.73 135.00 141.64 3h3q s PRO 497 Ca 0.54 1.43 -0.15 0.00 0.04 0.00 0.00 61.00 62.86 3h3q s PRO 497 Cb -0.26 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 32.30 3h3q s PRO 497 CO 0.30 -1.12 1.09 -1.21 0.04 0.00 0.00 177.00 176.09 3h3q s GLU 498 N -3.90 2.98 -0.14 4.56 2.02 -1.26 -4.64 118.70 118.30 3h3q s GLU 498 Ca 0.68 1.30 0.00 0.00 0.02 0.00 0.00 54.97 56.98 3h3q s GLU 498 Cb -0.21 -1.98 -0.01 0.00 0.10 0.00 0.00 34.13 32.04 3h3q s GLU 498 CO 0.38 -1.10 -0.15 0.99 0.02 0.00 0.00 175.26 175.40 3h3q s THR 499 N -2.42 2.73 -0.10 3.63 2.01 -0.63 -4.22 115.64 116.64 3h3q s THR 499 Ca 0.65 -0.76 -0.10 0.00 0.31 0.00 0.00 61.69 61.79 3h3q s THR 499 Cb -0.19 -2.14 -0.05 0.00 0.01 0.00 0.00 72.50 70.14 3h3q s THR 499 CO 0.41 0.52 0.23 0.26 -0.69 0.00 0.00 174.62 175.34 3h3q s TRP 500 N 0.62 3.61 -0.01 4.92 0.52 -0.38 0.13 118.94 128.35 3h3q s TRP 500 Ca -0.08 0.65 0.01 0.00 0.02 0.00 0.00 56.10 56.69 3h3q s TRP 500 Cb -0.16 -2.08 0.01 0.00 -1.15 0.00 0.00 33.47 30.09 3h3q s TRP 500 CO 0.03 0.64 -0.03 -1.50 0.02 0.00 0.00 176.95 176.11 3h3q s ILE 501 N -0.83 0.30 -0.20 2.03 2.07 -0.49 -0.11 121.20 123.97 3h3q s ILE 501 Ca 0.17 -0.09 -0.02 0.00 -1.41 0.00 0.00 60.65 59.29 3h3q s ILE 501 Cb -0.13 -0.30 -0.00 0.00 0.13 0.00 0.00 42.46 42.15 3h3q s ILE 501 CO 0.06 0.12 -0.08 -0.69 -1.91 0.00 0.00 174.94 172.44 3h3q s VAL 502 N 0.33 3.10 -0.18 4.00 1.01 -0.47 -0.63 120.40 127.55 3h3q s VAL 502 Ca -0.03 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.29 3h3q s VAL 502 Cb -0.06 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 3h3q s VAL 502 CO -0.01 0.46 0.03 0.00 0.00 0.00 0.00 175.10 175.58 3h3q s ASN 504 N 0.58 4.47 0.01 0.00 0.02 0.95 -1.95 114.94 119.02 3h3q s ASN 504 Ca 0.01 -1.07 -0.02 0.00 -1.02 0.00 0.00 52.86 50.76 3h3q s ASN 504 Cb -0.13 -1.65 -0.01 0.00 0.02 0.00 0.00 41.25 39.47 3h3q s ASN 504 CO 0.02 -0.17 0.01 0.72 0.02 0.00 0.00 177.10 177.69 3h3q s PHE 505 N 1.27 0.19 0.20 2.20 -0.12 -0.56 0.02 117.98 121.17 3h3q s PHE 505 Ca -0.03 -0.40 -0.30 0.00 -0.05 0.00 0.00 56.93 56.16 3h3q s PHE 505 Cb -0.18 -0.14 -0.08 0.00 -0.63 0.00 0.00 43.02 41.98 3h3q s PHE 505 CO -0.04 -0.19 1.17 -1.12 -0.05 0.00 0.00 175.22 174.99 3h3q s SER 506 N -1.32 7.13 0.09 1.98 0.01 -0.59 -0.60 113.70 120.40 3h3q s SER 506 Ca -0.14 2.23 0.02 0.00 1.31 0.00 0.00 55.95 59.36 3h3q s SER 506 Cb -0.09 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.49 3h3q s SER 506 CO -0.00 -0.32 -0.07 0.68 0.41 0.00 0.00 173.24 173.94 3h3q s VAL 507 N -0.29 0.66 0.47 3.43 -7.23 -0.77 -4.83 120.40 111.83 3h3q s VAL 507 Ca 0.51 -1.83 -0.03 0.00 -1.81 0.00 0.00 61.98 58.82 3h3q s VAL 507 Cb -0.32 -1.55 -0.02 0.00 0.56 0.00 0.00 36.38 35.05 3h3q s VAL 507 CO 0.38 -0.82 0.73 -1.81 -0.31 0.00 0.00 175.10 173.27 3h3q s ASP 508 N -2.86 6.03 -0.28 4.85 1.01 -1.26 -4.58 116.67 119.59 3h3q s ASP 508 Ca 0.09 0.63 -0.24 0.00 0.71 0.00 0.00 52.55 53.75 3h3q s ASP 508 Cb 0.03 -1.92 0.10 0.00 1.01 0.00 0.00 42.92 42.14 3h3q s ASP 508 CO -0.04 -0.65 0.90 -2.28 0.21 0.00 0.00 175.17 173.31 3h3q s HIS 509 N -2.66 -0.63 0.36 4.23 2.46 -1.26 -5.05 115.29 112.74 3h3q s HIS 509 Ca 0.47 1.49 0.13 0.00 0.47 0.00 0.00 55.06 57.63 3h3q s HIS 509 Cb -0.10 0.35 0.72 0.00 -0.13 0.00 0.00 32.58 33.41 3h3q s HIS 509 CO 0.41 -0.31 1.82 -0.44 -2.47 0.00 0.00 174.74 173.75 3h3q h ASP 510 N 4.81 0.00 0.86 9.88 3.32 -2.01 -1.04 116.42 132.25 3h3q h ASP 510 Ca -0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.76 3h3q h ASP 510 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3h3q h ASP 510 CO 0.10 0.38 0.00 -1.20 -1.72 0.00 0.00 179.24 176.80 3h3q n SER 511 N -4.04 0.46 -3.22 6.45 7.64 -1.26 -4.04 113.62 115.61 3h3q n SER 511 Ca -0.02 0.59 -0.24 0.00 1.01 0.00 0.00 58.87 60.21 3h3q n SER 511 Cb 0.42 -0.69 -0.06 0.00 -1.01 0.00 0.00 64.21 62.86 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 -1.68 2.73 -0.93 -0.43 0.00 -0.39 -5.11 120.51 114.70 3h3q n ALA 512 Ca 0.04 -3.68 -0.28 0.00 0.00 0.00 0.00 53.44 49.51 3h3q n ALA 512 Cb 0.27 -0.84 0.21 0.00 0.00 0.00 0.00 19.45 19.09 3h3q n ALA 512 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3h3q s PRO 513 N -1.70 -0.27 0.51 0.00 0.04 -1.23 -4.52 135.00 127.83 3h3q s PRO 513 Ca 0.37 0.56 -0.22 0.00 0.04 0.00 0.00 61.00 61.75 3h3q s PRO 513 Cb 0.20 -1.65 -0.06 0.00 0.04 0.00 0.00 34.50 33.03 3h3q s PRO 513 CO -0.09 -3.22 1.29 -0.51 0.04 0.00 0.00 177.00 174.51 3h3q s LEU 514 N -6.80 3.92 0.34 -3.56 1.43 -1.26 -5.03 118.68 107.72 3h3q s LEU 514 Ca 0.67 2.61 0.03 0.00 -1.03 0.00 0.00 54.13 56.41 3h3q s LEU 514 Cb -0.21 -4.24 -0.04 0.00 0.03 0.00 0.00 46.19 41.73 3h3q s LEU 514 CO 0.60 -1.31 0.12 0.54 0.23 0.00 0.00 176.35 176.53 3h3q s ASN 515 N -1.08 2.12 0.00 2.29 2.20 -1.26 -5.05 114.94 114.16 3h3q s ASN 515 Ca 0.68 -1.55 0.25 0.00 -0.94 0.00 0.00 52.86 51.31 3h3q s ASN 515 Cb -0.36 0.31 0.52 0.00 -2.00 0.00 0.00 41.25 39.72 3h3q s ASN 515 CO 0.43 -0.83 1.42 -0.46 -2.94 0.00 0.00 177.10 174.72 3h3q n ASN 516 N -0.97 0.80 -0.05 3.54 6.94 -1.26 -4.23 115.26 120.03 3h3q n ASN 516 Ca -0.02 -0.60 -0.15 0.00 -0.02 0.00 0.00 54.58 53.79 3h3q n ASN 516 Cb 0.65 0.27 -0.13 0.00 -2.36 0.00 0.00 39.78 38.22 3h3q n ASN 516 CO 0.00 0.00 0.00 0.03 -1.03 0.00 0.00 177.26 176.26 3h3q h ARG 517 N 0.56 0.05 -6.37 -3.83 3.08 -1.97 -3.48 114.38 102.42 3h3q h ARG 517 Ca 0.00 -0.08 -0.61 0.00 0.07 0.00 0.00 59.98 59.37 3h3q h ARG 517 Cb 0.51 0.03 -0.12 0.00 0.08 0.00 0.00 29.97 30.47 3h3q h ARG 517 CO 0.00 0.97 -0.69 0.00 -1.07 0.00 0.00 179.97 179.18 3h3q s VAL 519 N -1.81 5.06 -0.42 0.00 1.01 0.98 -4.59 120.40 120.63 3h3q s VAL 519 Ca 0.27 1.18 -0.28 0.00 0.00 0.00 0.00 61.98 63.15 3h3q s VAL 519 Cb -0.09 -3.91 0.02 0.00 0.00 0.00 0.00 36.38 32.41 3h3q s VAL 519 CO 0.17 0.34 1.04 -0.60 0.00 0.00 0.00 175.10 176.05 3h3q s ARG 520 N 0.40 3.77 0.62 2.72 6.06 -1.26 -0.42 118.95 130.84 3h3q s ARG 520 Ca 0.31 0.58 -0.10 0.00 -2.50 0.00 0.00 55.73 54.01 3h3q s ARG 520 Cb -0.17 -3.86 -0.03 0.00 0.06 0.00 0.00 34.95 30.95 3h3q s ARG 520 CO 0.15 -1.18 1.01 0.00 -2.50 0.00 0.00 175.30 172.79 3h3q s ALA 521 N 3.97 3.10 -0.06 6.12 0.00 -0.47 -4.47 121.76 129.96 3h3q s ALA 521 Ca 0.43 -0.18 0.04 0.00 0.00 0.00 0.00 51.96 52.25 3h3q s ALA 521 Cb -0.10 -3.01 0.00 0.00 0.00 0.00 0.00 23.12 20.01 3h3q s ALA 521 CO 0.25 -0.73 -0.17 0.15 0.00 0.00 0.00 175.76 175.26 3h3q s LYS 522 N -5.16 1.99 0.11 0.00 -0.14 0.04 -4.60 119.74 111.97 3h3q s LYS 522 Ca 0.55 -0.60 0.07 0.00 -1.36 0.00 0.00 55.97 54.63 3h3q s LYS 522 Cb -0.11 -1.64 -0.04 0.00 -1.68 0.00 0.00 37.83 34.36 3h3q s LYS 522 CO 0.53 0.16 -0.17 0.96 -0.76 0.00 0.00 175.35 176.07 3h3q s ILE 523 N 0.29 1.44 -0.24 2.17 -4.36 -1.26 -0.44 121.20 118.80 3h3q s ILE 523 Ca -0.10 -1.58 -0.03 0.00 -0.26 0.00 0.00 60.65 58.68 3h3q s ILE 523 Cb -0.14 -1.46 0.08 0.00 1.25 0.00 0.00 42.46 42.19 3h3q s ILE 523 CO 0.04 -0.25 0.08 0.21 0.24 0.00 0.00 174.94 175.26 3h3q s ASN 524 N -2.13 3.28 0.01 4.36 2.47 0.16 -1.55 114.94 121.54 3h3q s ASN 524 Ca 0.06 -1.12 0.05 0.00 0.42 0.00 0.00 52.86 52.28 3h3q s ASN 524 Cb -0.08 -0.57 -0.02 0.00 -1.45 0.00 0.00 41.25 39.14 3h3q s ASN 524 CO 0.04 -0.37 -0.16 -0.69 -3.72 0.00 0.00 177.10 172.20 3h3q s VAL 525 N 1.89 1.24 -0.01 -5.21 1.01 0.10 -1.52 120.40 117.90 3h3q s VAL 525 Ca 0.04 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.20 3h3q s VAL 525 Cb -0.17 -1.07 -0.00 0.00 0.00 0.00 0.00 36.38 35.14 3h3q s VAL 525 CO -0.19 0.22 -0.06 0.00 0.00 0.00 0.00 175.10 175.07 3h3q s ALA 526 N -0.57 0.48 -0.21 5.51 0.00 -0.40 -0.03 121.76 126.53 3h3q s ALA 526 Ca 0.05 -0.23 -0.05 0.00 0.00 0.00 0.00 51.96 51.73 3h3q s ALA 526 Cb -0.07 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 3h3q s ALA 526 CO 0.00 0.11 -0.01 1.41 0.00 0.00 0.00 175.76 177.28 3h3q s MET 527 N -0.07 3.54 -0.17 0.00 1.75 -0.06 -1.54 119.30 122.75 3h3q s MET 527 Ca 0.01 -0.55 0.01 0.00 -1.25 0.00 0.00 55.69 53.92 3h3q s MET 527 Cb -0.03 -3.09 0.02 0.00 2.84 0.00 0.00 34.83 34.57 3h3q s MET 527 CO -0.00 -0.08 -0.20 0.42 -0.65 0.00 0.00 175.02 174.51 3h3q s ILE 528 N 1.23 2.06 -0.03 10.11 1.01 0.72 -1.37 121.20 134.92 3h3q s ILE 528 Ca 0.03 -0.94 0.04 0.00 0.00 0.00 0.00 60.65 59.78 3h3q s ILE 528 Cb -0.15 -1.85 -0.00 0.00 0.01 0.00 0.00 42.46 40.47 3h3q s ILE 528 CO 0.01 0.54 -0.16 0.00 0.00 0.00 0.00 174.94 175.33 3h3q s GLN 530 N -0.02 1.44 -0.17 0.00 -0.21 -0.67 -1.25 119.66 118.77 3h3q s GLN 530 Ca -0.02 -0.54 -0.17 0.00 0.02 0.00 0.00 55.36 54.65 3h3q s GLN 530 Cb -0.10 -1.32 -0.04 0.00 1.00 0.00 0.00 33.01 32.55 3h3q s GLN 530 CO 0.01 0.27 0.43 0.99 -2.12 0.00 0.00 175.29 174.86 3h3q s THR 531 N -0.11 5.19 -0.18 -0.19 2.01 -1.26 -0.82 115.64 120.29 3h3q s THR 531 Ca 0.01 0.79 -0.11 0.00 0.31 0.00 0.00 61.69 62.68 3h3q s THR 531 Cb -0.09 -3.76 -0.05 0.00 0.01 0.00 0.00 72.50 68.62 3h3q s THR 531 CO 0.01 0.27 0.20 -0.76 -0.69 0.00 0.00 174.62 173.65 3h3q s LEU 532 N 1.08 4.24 -0.03 4.42 1.43 0.92 -4.70 118.68 126.04 3h3q s LEU 532 Ca 0.21 0.37 0.05 0.00 -1.03 0.00 0.00 54.13 53.73 3h3q s LEU 532 Cb -0.15 -2.21 -0.03 0.00 0.03 0.00 0.00 46.19 43.84 3h3q s LEU 532 CO 0.08 0.16 -0.17 -0.69 0.23 0.00 0.00 176.35 175.96 3h3q s VAL 533 N 0.30 2.81 -0.26 -1.59 1.01 -1.26 -1.69 120.40 119.71 3h3q s VAL 533 Ca 0.12 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.24 3h3q s VAL 533 Cb -0.12 -2.09 0.07 0.00 0.00 0.00 0.00 36.38 34.25 3h3q s VAL 533 CO 0.01 0.56 0.00 -0.94 0.00 0.00 0.00 175.10 174.73 3h3q s SER 534 N -0.80 3.97 0.20 3.32 1.04 -0.43 -5.03 113.70 115.98 3h3q s SER 534 Ca 0.12 -1.40 -0.30 0.00 0.48 0.00 0.00 55.95 54.84 3h3q s SER 534 Cb -0.10 -1.15 -0.16 0.00 0.10 0.00 0.00 66.02 64.71 3h3q s SER 534 CO 0.01 -0.30 0.75 -2.65 0.98 0.00 0.00 173.24 172.03 3h3q n PRO 535 N 4.67 0.44 0.00 4.02 -0.01 -1.26 -4.70 135.00 138.15 3h3q n PRO 535 Ca -0.07 0.15 0.00 0.00 -0.01 0.00 0.00 63.50 63.57 3h3q n PRO 535 Cb 0.43 -1.34 0.00 0.00 -0.01 0.00 0.00 33.50 32.58 3h3q n PRO 535 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 175.50 175.14 3h3q n PRO 536 N 1.06 3.61 -2.77 0.52 -0.04 -1.26 -5.06 135.00 131.06 3h3q n PRO 536 Ca 0.16 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.23 3h3q n PRO 536 Cb 0.25 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.65 3h3q n PRO 536 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3h3q s GLU 537 N 2.62 4.74 4.77 0.54 1.03 -1.26 -4.95 118.70 126.19 3h3q s GLU 537 Ca 0.00 1.41 0.00 0.00 0.03 0.00 0.00 54.97 56.41 3h3q s GLU 537 Cb 0.00 -3.09 0.00 0.00 -0.80 0.00 0.00 34.13 30.24 3h3q s GLU 537 CO 0.00 0.43 0.00 0.41 -1.33 0.00 0.00 175.26 174.77 3h3q n GLY 538 N 1.14 1.99 2.12 -3.83 0.00 -1.26 -2.48 105.19 102.87 3h3q n GLY 538 Ca -0.01 -0.48 -0.21 0.00 0.00 0.00 0.00 46.02 45.33 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 -1.08 3.78 -4.77 1.61 3.02 -1.26 -4.99 115.26 111.57 3h3q n ASN 539 Ca 0.00 -3.46 -0.38 0.00 -0.03 0.00 0.00 54.58 50.71 3h3q n ASN 539 Cb 0.00 -0.81 -0.02 0.00 -0.61 0.00 0.00 39.78 38.34 3h3q n ASN 539 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3h3q s GLN 540 N -3.04 4.07 0.73 3.52 -0.21 -1.03 -5.04 119.66 118.66 3h3q s GLN 540 Ca 0.53 1.75 -0.11 0.00 0.02 0.00 0.00 55.36 57.54 3h3q s GLN 540 Cb 0.44 -2.63 0.03 0.00 1.00 0.00 0.00 33.01 31.85 3h3q s GLN 540 CO 0.10 -0.28 1.08 -1.21 -2.12 0.00 0.00 175.29 172.86 3h3q s GLU 541 N -2.36 2.66 0.31 2.91 2.02 -1.26 -4.67 118.70 118.31 3h3q s GLU 541 Ca 0.58 0.75 -0.29 0.00 0.02 0.00 0.00 54.97 56.03 3h3q s GLU 541 Cb -0.28 -1.97 -0.11 0.00 0.10 0.00 0.00 34.13 31.86 3h3q s GLU 541 CO 0.35 -1.25 1.51 0.42 0.02 0.00 0.00 175.26 176.32 3h3q s ILE 542 N -3.14 2.24 0.42 -1.63 -1.09 -1.26 -4.89 121.20 111.85 3h3q s ILE 542 Ca 0.59 0.21 0.04 0.00 -2.23 0.00 0.00 60.65 59.26 3h3q s ILE 542 Cb -0.14 -3.14 -0.04 0.00 -1.58 0.00 0.00 42.46 37.56 3h3q s ILE 542 CO 0.54 0.04 0.04 -0.94 -1.23 0.00 0.00 174.94 173.40 3h3q s SER 543 N 0.21 3.38 0.00 3.58 1.04 -1.26 -4.99 113.70 115.66 3h3q s SER 543 Ca 0.58 -1.52 0.09 0.00 0.48 0.00 0.00 55.95 55.58 3h3q s SER 543 Cb -0.46 0.14 0.41 0.00 0.10 0.00 0.00 66.02 66.22 3h3q s SER 543 CO 0.52 -0.71 1.21 0.54 0.98 0.00 0.00 173.24 175.77 3h3q n ARG 544 N -0.98 0.07 0.14 4.02 1.74 -1.26 -0.33 116.66 120.05 3h3q n ARG 544 Ca -0.09 0.27 0.13 0.00 -0.77 0.00 0.00 57.85 57.38 3h3q n ARG 544 Cb 0.66 -1.50 0.34 0.00 -1.02 0.00 0.00 32.46 30.95 3h3q n ARG 544 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3h3q h ASP 545 N 0.00 0.00 -0.02 0.55 3.32 -1.94 -3.19 116.42 115.14 3h3q h ASP 545 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3h3q h ASP 545 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 3h3q h ASP 545 CO 0.00 0.00 -0.28 0.59 -1.72 0.00 0.00 179.24 177.83 3h3q n ASN 546 N -2.49 2.44 -4.52 6.45 3.02 0.55 -4.97 115.26 115.73 3h3q n ASN 546 Ca 0.05 -1.72 -0.30 0.00 -0.03 0.00 0.00 54.58 52.58 3h3q n ASN 546 Cb 0.46 0.28 -0.11 0.00 -0.61 0.00 0.00 39.78 39.79 3h3q n ASN 546 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 3h3q s ILE 547 N -2.27 3.10 -0.03 2.41 -4.36 -1.21 -1.31 121.20 117.54 3h3q s ILE 547 Ca 0.22 -1.23 -0.01 0.00 -0.26 0.00 0.00 60.65 59.38 3h3q s ILE 547 Cb 0.19 -2.39 0.02 0.00 1.25 0.00 0.00 42.46 41.53 3h3q s ILE 547 CO 0.46 0.22 0.05 -0.22 0.24 0.00 0.00 174.94 175.69 3h3q s LEU 548 N -1.83 1.25 -0.23 0.37 2.96 -0.68 -1.21 118.68 119.30 3h3q s LEU 548 Ca 0.18 0.10 -0.07 0.00 -0.22 0.00 0.00 54.13 54.11 3h3q s LEU 548 Cb -0.11 0.07 -0.03 0.00 0.50 0.00 0.00 46.19 46.62 3h3q s LEU 548 CO 0.09 -0.10 0.07 0.00 -1.32 0.00 0.00 176.35 175.09 3h3q s LYS 550 N 1.24 4.05 -0.11 0.00 1.02 0.00 -0.20 119.74 125.75 3h3q s LYS 550 Ca 0.05 0.02 0.03 0.00 0.02 0.00 0.00 55.97 56.08 3h3q s LYS 550 Cb -0.14 -3.62 -0.01 0.00 -0.52 0.00 0.00 37.83 33.54 3h3q s LYS 550 CO 0.03 -0.18 -0.20 0.42 -0.92 0.00 0.00 175.35 174.51 3h3q s ILE 551 N 1.76 2.41 -0.15 2.17 1.01 0.21 -1.67 121.20 126.94 3h3q s ILE 551 Ca 0.15 -0.90 -0.00 0.00 0.00 0.00 0.00 60.65 59.90 3h3q s ILE 551 Cb -0.15 -1.95 -0.01 0.00 0.01 0.00 0.00 42.46 40.36 3h3q s ILE 551 CO 0.09 0.55 -0.14 -0.89 0.00 0.00 0.00 174.94 174.55 3h3q s THR 552 N 0.28 2.85 -0.15 2.92 2.01 0.15 -0.61 115.64 123.09 3h3q s THR 552 Ca -0.15 -0.72 0.00 0.00 0.31 0.00 0.00 61.69 61.14 3h3q s THR 552 Cb -0.17 -2.20 0.02 0.00 0.01 0.00 0.00 72.50 70.16 3h3q s THR 552 CO 0.07 0.51 -0.15 -0.47 -0.69 0.00 0.00 174.62 173.90 3h3q s TYR 553 N 0.64 2.19 -0.07 4.92 5.04 0.93 -0.20 117.35 130.80 3h3q s TYR 553 Ca -0.08 -1.22 0.05 0.00 -2.44 0.00 0.00 57.07 53.39 3h3q s TYR 553 Cb -0.16 -1.60 -0.01 0.00 0.35 0.00 0.00 41.96 40.54 3h3q s TYR 553 CO 0.03 -0.66 -0.23 0.14 -1.34 0.00 0.00 175.55 173.48 3h3q s VAL 554 N 1.43 2.19 -0.10 3.14 -7.23 -0.59 0.46 120.40 119.70 3h3q s VAL 554 Ca 0.04 -1.01 0.01 0.00 -1.81 0.00 0.00 61.98 59.21 3h3q s VAL 554 Cb -0.13 -1.81 0.02 0.00 0.56 0.00 0.00 36.38 35.02 3h3q s VAL 554 CO -0.10 0.57 -0.12 0.00 -0.31 0.00 0.00 175.10 175.13 3h3q s ALA 555 N -0.12 1.46 -0.25 1.32 0.00 0.13 -1.27 121.76 123.03 3h3q s ALA 555 Ca -0.05 -0.58 0.03 0.00 0.00 0.00 0.00 51.96 51.35 3h3q s ALA 555 Cb -0.14 -0.77 0.05 0.00 0.00 0.00 0.00 23.12 22.26 3h3q s ALA 555 CO 0.04 -0.11 -0.12 -0.80 0.00 0.00 0.00 175.76 174.77 3h3q s ASN 556 N 1.08 4.21 -0.11 0.00 0.01 -0.58 -0.74 114.94 118.82 3h3q s ASN 556 Ca -0.06 -1.27 0.02 0.00 -0.71 0.00 0.00 52.86 50.85 3h3q s ASN 556 Cb -0.15 -1.53 0.01 0.00 0.41 0.00 0.00 41.25 40.00 3h3q s ASN 556 CO -0.02 -0.16 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.56 3h3q s VAL 557 N 1.14 1.54 -0.43 1.60 1.01 -1.26 -0.67 120.40 123.33 3h3q s VAL 557 Ca -0.07 -0.68 -0.12 0.00 0.00 0.00 0.00 61.98 61.11 3h3q s VAL 557 Cb -0.19 -1.40 0.07 0.00 0.00 0.00 0.00 36.38 34.86 3h3q s VAL 557 CO -0.06 0.45 0.31 0.21 0.00 0.00 0.00 175.10 176.01 3h3q s ASN 558 N 0.89 5.89 0.00 3.32 3.84 0.41 -4.73 114.94 124.57 3h3q s ASN 558 Ca -0.08 -1.32 0.22 0.00 0.21 0.00 0.00 52.86 51.89 3h3q s ASN 558 Cb -0.15 -2.08 1.20 0.00 -0.55 0.00 0.00 41.25 39.67 3h3q s ASN 558 CO -0.00 -0.56 1.72 -0.81 -2.79 0.00 0.00 177.10 174.66 3h3q n PRO 559 N 5.06 0.46 -0.72 0.43 -0.04 -1.26 -0.78 135.00 138.14 3h3q n PRO 559 Ca -0.11 0.05 0.10 0.00 -0.04 0.00 0.00 63.50 63.49 3h3q n PRO 559 Cb 0.44 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.37 3h3q n PRO 559 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h3q n GLY 560 N 0.53 -1.90 7.00 0.55 0.00 -1.26 -4.28 105.19 105.83 3h3q n GLY 560 Ca 0.13 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.97 1.32 3.00 -0.02 0.00 -1.26 -4.74 105.19 100.53 3h3q n GLY 561 Ca -0.01 -0.62 -0.12 0.00 0.00 0.00 0.00 46.02 45.28 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 0.00 -0.09 0.14 1.61 -0.00 -1.26 -5.09 118.94 114.24 3h3q s TRP 562 Ca 0.00 0.23 -0.17 0.00 -0.00 0.00 0.00 56.10 56.16 3h3q s TRP 562 Cb 0.00 0.02 0.04 0.00 -0.00 0.00 0.00 33.47 33.53 3h3q s TRP 562 CO 0.00 -0.09 0.44 0.00 -0.00 0.00 0.00 176.95 177.30 3h3q s ALA 563 N -0.15 -1.01 0.34 5.86 0.00 -1.26 -5.06 121.76 120.48 3h3q s ALA 563 Ca -0.02 -0.01 -0.29 0.00 0.00 0.00 0.00 51.96 51.64 3h3q s ALA 563 Cb -0.02 0.74 -0.10 0.00 0.00 0.00 0.00 23.12 23.74 3h3q s ALA 563 CO 0.00 -0.68 1.35 -2.14 0.00 0.00 0.00 175.76 174.30 3h3q s PRO 564 N -3.81 4.30 0.13 0.00 0.02 -1.26 -4.89 135.00 129.49 3h3q s PRO 564 Ca 0.04 2.30 -0.20 0.00 0.02 0.00 0.00 61.00 63.16 3h3q s PRO 564 Cb 0.01 -3.05 -0.02 0.00 0.02 0.00 0.00 34.50 31.46 3h3q s PRO 564 CO -0.11 -0.28 1.70 0.00 -0.33 0.00 0.00 177.00 177.99 3h3q h ALA 565 N 3.41 0.14 0.00 -1.55 0.00 -1.99 -1.70 119.26 117.57 3h3q h ALA 565 Ca -0.49 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 3h3q h ALA 565 Cb 1.23 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 3h3q h ALA 565 CO 0.66 -0.47 -0.10 0.66 0.00 0.00 0.00 179.25 180.00 3h3q h SER 566 N 0.01 0.00 0.03 0.00 4.64 -1.99 -0.15 113.55 116.09 3h3q h SER 566 Ca 0.10 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.15 3h3q h SER 566 Cb 0.15 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.27 3h3q h SER 566 CO -0.21 0.10 -1.09 0.58 -0.87 0.00 0.00 176.83 175.34 3h3q h VAL 567 N 0.00 1.28 -0.51 0.95 2.07 -1.77 -1.54 116.25 116.73 3h3q h VAL 567 Ca -0.00 -2.29 -0.09 0.00 0.82 0.00 0.00 66.70 65.14 3h3q h VAL 567 Cb 0.20 2.47 -0.02 0.00 -1.52 0.00 0.00 31.29 32.42 3h3q h VAL 567 CO 0.01 0.71 -0.02 -0.07 0.02 0.00 0.00 177.57 178.22 3h3q h LEU 568 N 0.35 0.90 -0.93 2.57 3.38 -0.79 -1.47 115.31 119.32 3h3q h LEU 568 Ca -0.14 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.43 3h3q h LEU 568 Cb 1.75 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 42.24 3h3q h LEU 568 CO 0.21 1.00 -0.09 0.03 0.09 0.00 0.00 178.44 179.68 3h3q h ARG 569 N 0.78 0.68 -0.29 1.13 3.08 -1.06 -1.93 114.38 116.76 3h3q h ARG 569 Ca 0.14 -0.20 -0.15 0.00 0.07 0.00 0.00 59.98 59.84 3h3q h ARG 569 Cb 0.55 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 3h3q h ARG 569 CO 0.03 0.76 -0.42 0.00 -1.07 0.00 0.00 179.97 179.26 3h3q h ALA 570 N 1.28 0.70 -0.16 0.04 0.00 -1.05 -2.63 119.26 117.44 3h3q h ALA 570 Ca 0.11 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.43 3h3q h ALA 570 Cb 0.52 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3h3q h ALA 570 CO 0.03 0.67 -0.47 -0.39 0.00 0.00 0.00 179.25 179.09 3h3q h VAL 571 N 0.59 1.32 -0.13 0.00 -1.51 -1.04 -1.16 116.25 114.32 3h3q h VAL 571 Ca 0.04 -1.67 0.04 0.00 -1.23 0.00 0.00 66.70 63.88 3h3q h VAL 571 Cb 0.97 1.71 -0.05 0.00 -2.13 0.00 0.00 31.29 31.79 3h3q h VAL 571 CO 0.09 0.51 -0.18 0.00 -1.23 0.00 0.00 177.57 176.76 3h3q h ALA 572 N 1.17 -0.11 0.00 5.19 0.00 -1.33 0.13 119.26 124.31 3h3q h ALA 572 Ca 0.02 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3h3q h ALA 572 Cb 0.95 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 3h3q h ALA 572 CO 0.08 -0.63 -0.16 0.87 0.00 0.00 0.00 179.25 179.41 3h3q h LYS 573 N -0.22 0.00 0.01 0.00 1.57 -1.12 -2.39 116.57 114.42 3h3q h LYS 573 Ca 0.10 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3h3q h LYS 573 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 3h3q h LYS 573 CO -0.26 0.16 -0.00 -0.09 -0.57 0.00 0.00 179.45 178.69 3h3q h ARG 574 N 0.00 -0.01 0.09 3.15 2.43 -0.93 -3.40 114.38 115.71 3h3q h ARG 574 Ca -0.00 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 58.89 3h3q h ARG 574 Cb 0.29 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.86 3h3q h ARG 574 CO 0.02 0.72 -1.16 0.93 -1.51 0.00 0.00 179.97 178.96 3h3q h GLU 575 N -0.98 0.51 0.06 0.20 4.39 -0.71 -3.08 114.58 114.97 3h3q h GLU 575 Ca -0.00 -0.66 -0.00 0.00 0.34 0.00 0.00 59.36 59.03 3h3q h GLU 575 Cb 0.73 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.60 3h3q h GLU 575 CO 0.00 1.28 -0.03 1.88 -1.16 0.00 0.00 179.01 180.98 3h3q h TYR 576 N 0.23 -0.07 -0.67 4.33 0.05 -1.62 -0.43 116.97 118.79 3h3q h TYR 576 Ca -0.15 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.62 3h3q h TYR 576 Cb 1.83 0.02 -0.03 0.00 1.01 0.00 0.00 36.73 39.57 3h3q h TYR 576 CO 0.09 0.15 0.37 -1.35 -1.05 0.00 0.00 178.16 176.37 3h3q h PRO 577 N -0.29 0.94 -0.20 4.88 0.11 -1.77 -1.04 132.00 134.62 3h3q h PRO 577 Ca -0.01 -0.11 0.03 0.00 0.11 0.00 0.00 66.00 66.02 3h3q h PRO 577 Cb 0.25 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.15 3h3q h PRO 577 CO 0.01 0.71 0.03 -0.22 -0.21 0.00 0.00 178.00 178.32 3h3q h LYS 578 N 0.92 0.11 -0.42 1.05 3.64 -1.49 -1.36 116.57 119.02 3h3q h LYS 578 Ca 0.24 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.65 3h3q h LYS 578 Cb 0.04 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 3h3q h LYS 578 CO -0.04 0.07 0.19 0.35 -2.27 0.00 0.00 179.45 177.76 3h3q h PHE 579 N 0.11 0.35 -0.79 1.91 3.57 -0.77 -2.10 116.94 119.22 3h3q h PHE 579 Ca 0.09 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.62 3h3q h PHE 579 Cb 0.09 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.70 3h3q h PHE 579 CO -0.15 0.17 0.52 -0.07 -2.23 0.00 0.00 178.31 176.55 3h3q h LEU 580 N 0.39 0.91 0.03 0.59 3.38 -0.73 0.21 115.31 120.10 3h3q h LEU 580 Ca 0.19 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 3h3q h LEU 580 Cb 0.12 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3h3q h LEU 580 CO -0.15 0.66 -0.02 0.50 0.09 0.00 0.00 178.44 179.53 3h3q h LYS 581 N 1.07 -0.04 -0.13 1.13 3.64 -1.20 -1.38 116.57 119.65 3h3q h LYS 581 Ca 0.29 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.67 3h3q h LYS 581 Cb -0.12 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 3h3q h LYS 581 CO -0.06 0.36 0.06 -0.09 -2.27 0.00 0.00 179.45 177.45 3h3q h ARG 582 N -0.46 0.19 -0.31 1.90 2.43 -1.18 -1.67 114.38 115.29 3h3q h ARG 582 Ca -0.00 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.14 3h3q h ARG 582 Cb 0.42 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 3h3q h ARG 582 CO 0.01 0.23 0.20 0.35 -1.51 0.00 0.00 179.97 179.25 3h3q h PHE 583 N 0.09 0.37 -0.32 2.20 3.57 -0.62 -0.47 116.94 121.76 3h3q h PHE 583 Ca 0.04 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.46 3h3q h PHE 583 Cb 0.11 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 3h3q h PHE 583 CO -0.03 0.23 -0.21 1.79 -2.23 0.00 0.00 178.31 177.86 3h3q h THR 584 N 0.40 1.26 -0.07 4.41 1.35 -1.22 -2.17 112.91 116.87 3h3q h THR 584 Ca 0.11 -1.24 -0.13 0.00 -0.55 0.00 0.00 66.41 64.60 3h3q h THR 584 Cb -0.04 1.25 -0.01 0.00 -1.73 0.00 0.00 68.15 67.62 3h3q h THR 584 CO -0.03 0.40 -0.54 0.28 -0.25 0.00 0.00 175.52 175.38 3h3q h SER 585 N 0.53 0.22 -0.06 5.36 0.02 -1.10 -1.42 113.55 117.10 3h3q h SER 585 Ca 0.08 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 3h3q h SER 585 Cb 0.65 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.12 3h3q h SER 585 CO 0.05 0.72 0.03 0.22 -1.14 0.00 0.00 176.83 176.71 3h3q h TYR 586 N 0.16 0.07 -0.33 3.45 3.20 -0.67 -0.09 116.97 122.76 3h3q h TYR 586 Ca 0.00 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.90 3h3q h TYR 586 Cb 1.01 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 39.23 3h3q h TYR 586 CO 0.02 0.09 0.15 0.28 -1.64 0.00 0.00 178.16 177.06 3h3q h VAL 587 N 0.04 0.97 -0.71 1.81 2.07 -1.28 0.17 116.25 119.33 3h3q h VAL 587 Ca 0.02 -0.11 0.09 0.00 0.82 0.00 0.00 66.70 67.52 3h3q h VAL 587 Cb 0.03 0.62 -0.07 0.00 -1.52 0.00 0.00 31.29 30.35 3h3q h VAL 587 CO -0.00 0.06 0.35 1.56 0.02 0.00 0.00 177.57 179.56 3h3q h GLN 588 N 0.32 0.59 -0.24 1.57 4.20 -1.01 -0.21 115.11 120.33 3h3q h GLN 588 Ca 0.14 -0.04 -0.19 0.00 0.06 0.00 0.00 58.65 58.62 3h3q h GLN 588 Cb 0.06 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.71 3h3q h GLN 588 CO -0.10 0.39 -0.61 0.93 -0.67 0.00 0.00 178.83 178.77 3h3q h GLU 589 N 0.61 0.82 0.00 1.46 5.08 -0.61 -2.28 114.58 119.66 3h3q h GLU 589 Ca 0.35 -0.55 -0.08 0.00 -1.00 0.00 0.00 59.36 58.07 3h3q h GLU 589 Cb 0.36 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 3h3q h GLU 589 CO -0.26 1.18 -0.39 0.87 -1.00 0.00 0.00 179.01 179.40 3h3q h LYS 590 N 0.61 0.00 0.00 2.33 1.79 -0.40 -3.29 116.57 117.60 3h3q h LYS 590 Ca -0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.41 3h3q h LYS 590 Cb 1.21 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.85 3h3q h LYS 590 CO 0.13 0.39 -1.45 0.25 -1.08 0.00 0.00 179.45 177.69 3h3q n THR 591 N -3.76 0.60 -1.61 -0.16 -2.24 -0.11 -4.91 114.28 102.10 3h3q n THR 591 Ca -0.01 -0.58 -0.57 0.00 -2.27 0.00 0.00 64.05 60.61 3h3q n THR 591 Cb 0.47 -0.33 -0.07 0.00 -2.10 0.00 0.00 70.33 68.30 3h3q n THR 591 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h3q n ALA 592 N -2.28 -1.65 -0.23 6.98 0.00 -0.86 -1.31 120.51 121.16 3h3q n ALA 592 Ca -0.05 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.90 3h3q n ALA 592 Cb 0.65 -1.99 0.00 0.00 0.00 0.00 0.00 19.45 18.11 3h3q n ALA 592 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h3q n GLY 593 N 2.76 2.41 3.92 0.00 0.00 -1.26 -5.00 105.19 108.01 3h3q n GLY 593 Ca 0.22 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.01 3.57 0.42 1.61 1.02 -0.43 -5.06 119.74 120.86 3h3q s LYS 594 Ca 0.00 -0.09 -0.26 0.00 0.02 0.00 0.00 55.97 55.64 3h3q s LYS 594 Cb 0.00 -2.61 -0.09 0.00 -0.52 0.00 0.00 37.83 34.60 3h3q s LYS 594 CO 0.00 0.13 1.43 -2.30 -0.92 0.00 0.00 175.35 173.70 3h3q n PRO 595 N -1.42 2.36 -2.95 -1.68 -0.02 -1.26 -4.92 135.00 125.10 3h3q n PRO 595 Ca -0.02 0.83 -0.40 0.00 -2.02 0.00 0.00 63.50 61.89 3h3q n PRO 595 Cb 0.55 -2.62 -0.05 0.00 -0.02 0.00 0.00 33.50 31.36 3h3q n PRO 595 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3h3q s ILE 596 N -1.17 4.61 -0.54 4.25 1.01 -1.26 -5.00 121.20 123.09 3h3q s ILE 596 Ca 0.59 1.70 -0.16 0.00 0.00 0.00 0.00 60.65 62.77 3h3q s ILE 596 Cb -0.46 -4.15 0.13 0.00 0.01 0.00 0.00 42.46 37.98 3h3q s ILE 596 CO 0.60 0.40 0.52 -0.22 0.00 0.00 0.00 174.94 176.24 3h3q s LEU 597 N -0.34 6.09 0.00 2.97 2.96 -1.26 -5.17 118.68 123.93 3h3q s LEU 597 Ca 0.39 -1.74 0.32 0.00 -0.22 0.00 0.00 54.13 52.88 3h3q s LEU 597 Cb -0.22 -2.22 1.91 0.00 0.50 0.00 0.00 46.19 46.16 3h3q s LEU 597 CO 0.25 -0.88 2.23 0.49 -1.32 0.00 0.00 176.35 177.11