#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3r s HIS 365 N 0.00 2.90 -0.66 4.78 -0.00 -1.26 -4.92 115.29 116.12 3h3r s HIS 365 Ca 0.00 1.00 0.19 0.00 -0.00 0.00 0.00 55.06 56.25 3h3r s HIS 365 Cb 0.00 -3.22 0.82 0.00 -0.00 0.00 0.00 32.58 30.18 3h3r s HIS 365 CO 0.00 -1.76 1.59 2.89 -0.00 0.00 0.00 174.74 177.45 3h3r n ARG 366 N -3.39 0.11 -0.52 -0.38 1.85 -1.26 -2.79 116.66 110.29 3h3r n ARG 366 Ca 0.07 0.38 0.10 0.00 -1.00 0.00 0.00 57.85 57.40 3h3r n ARG 366 Cb 0.58 -1.73 0.34 0.00 -1.05 0.00 0.00 32.46 30.59 3h3r n ARG 366 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3h3r n PHE 367 N -1.95 1.28 -0.14 2.89 3.72 -1.26 -4.66 117.46 117.34 3h3r n PHE 367 Ca 0.02 -0.58 -0.05 0.00 -0.05 0.00 0.00 57.45 56.79 3h3r n PHE 367 Cb 0.18 -0.16 0.14 0.00 -0.94 0.00 0.00 39.48 38.70 3h3r n PHE 367 CO 0.00 0.00 0.00 -0.39 -0.05 0.00 0.00 176.76 176.32 3h3r h VAL 368 N 4.00 1.24 -0.55 -4.37 -1.51 -1.89 -0.43 116.25 112.74 3h3r h VAL 368 Ca 0.00 -0.99 -0.08 0.00 -1.23 0.00 0.00 66.70 64.40 3h3r h VAL 368 Cb 1.29 0.80 -0.02 0.00 -2.13 0.00 0.00 31.29 31.22 3h3r h VAL 368 CO 0.15 0.36 0.02 1.56 -1.23 0.00 0.00 177.57 178.43 3h3r h GLN 369 N 0.81 0.96 -0.31 5.19 4.20 -1.86 -1.27 115.11 122.83 3h3r h GLN 369 Ca 0.16 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 3h3r h GLN 369 Cb 0.43 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 3h3r h GLN 369 CO 0.02 0.96 0.16 -0.22 -0.67 0.00 0.00 178.83 179.07 3h3r h LYS 370 N 0.84 0.43 -0.36 1.46 1.63 -1.76 -2.01 116.57 116.81 3h3r h LYS 370 Ca 0.16 -0.06 0.06 0.00 -0.85 0.00 0.00 60.65 59.96 3h3r h LYS 370 Cb 0.51 -0.08 -0.05 0.00 -0.60 0.00 0.00 32.23 32.01 3h3r h LYS 370 CO 0.02 0.38 0.05 0.28 -3.45 0.00 0.00 179.45 176.74 3h3r h VAL 371 N 0.37 0.80 -0.73 2.00 2.07 -0.89 0.39 116.25 120.26 3h3r h VAL 371 Ca 0.11 -0.06 -0.06 0.00 0.82 0.00 0.00 66.70 67.51 3h3r h VAL 371 Cb 0.08 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 3h3r h VAL 371 CO -0.02 0.03 0.21 -0.33 0.02 0.00 0.00 177.57 177.49 3h3r h GLU 372 N 0.17 1.15 -0.32 1.57 4.39 -1.12 0.11 114.58 120.52 3h3r h GLU 372 Ca 0.17 -0.25 -0.14 0.00 0.34 0.00 0.00 59.36 59.48 3h3r h GLU 372 Cb 0.21 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 3h3r h GLU 372 CO -0.24 0.98 -0.38 1.49 -1.16 0.00 0.00 179.01 179.71 3h3r h GLU 373 N 1.09 0.75 -0.17 2.33 4.81 -0.93 -0.39 114.58 122.07 3h3r h GLU 373 Ca 0.23 -0.38 -0.09 0.00 -0.13 0.00 0.00 59.36 59.00 3h3r h GLU 373 Cb 0.33 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.71 3h3r h GLU 373 CO -0.00 1.00 -0.24 0.52 -0.73 0.00 0.00 179.01 179.55 3h3r h MET 374 N 0.62 0.47 -0.42 1.92 2.86 -0.15 -1.33 114.93 118.90 3h3r h MET 374 Ca 0.06 -0.27 0.03 0.00 -2.06 0.00 0.00 59.70 57.46 3h3r h MET 374 Cb 0.92 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.57 3h3r h MET 374 CO 0.08 0.86 0.21 0.28 1.06 0.00 0.00 176.91 179.40 3h3r h VAL 375 N 0.11 0.96 -0.32 -2.22 2.07 -0.81 -1.17 116.25 114.88 3h3r h VAL 375 Ca 0.02 -0.14 -0.14 0.00 0.82 0.00 0.00 66.70 67.26 3h3r h VAL 375 Cb 0.81 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 3h3r h VAL 375 CO 0.06 0.08 -0.36 -0.61 0.02 0.00 0.00 177.57 176.75 3h3r h GLN 376 N 0.42 0.72 -0.29 1.57 5.75 -1.01 -0.99 115.11 121.27 3h3r h GLN 376 Ca 0.18 -0.36 -0.07 0.00 -0.15 0.00 0.00 58.65 58.26 3h3r h GLN 376 Cb 0.10 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 3h3r h GLN 376 CO -0.13 0.97 -0.11 -0.91 -2.65 0.00 0.00 178.83 176.00 3h3r h ASN 377 N 0.60 0.48 -0.32 -0.69 2.35 -1.09 -0.50 115.58 116.40 3h3r h ASN 377 Ca 0.06 -0.12 -0.16 0.00 -0.55 0.00 0.00 56.30 55.53 3h3r h ASN 377 Cb 0.89 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 39.13 3h3r h ASN 377 CO 0.08 0.62 -0.41 0.45 -1.65 0.00 0.00 177.43 176.53 3h3r h HIS 378 N 0.46 1.03 -0.04 1.19 3.86 -0.83 -0.40 115.15 120.43 3h3r h HIS 378 Ca 0.09 -0.33 -0.06 0.00 -1.16 0.00 0.00 60.37 58.90 3h3r h HIS 378 Cb 0.47 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.72 3h3r h HIS 378 CO 0.02 1.14 -0.27 0.52 0.86 0.00 0.00 177.93 180.19 3h3r h MET 379 N 0.63 0.06 0.20 2.45 2.86 -0.87 0.18 114.93 120.43 3h3r h MET 379 Ca 0.04 -0.02 -0.27 0.00 -2.06 0.00 0.00 59.70 57.39 3h3r h MET 379 Cb 1.00 -0.01 0.03 0.00 0.06 0.00 0.00 31.60 32.68 3h3r h MET 379 CO 0.10 0.34 -1.24 1.15 1.06 0.00 0.00 176.91 178.32 3h3r h THR 380 N 0.06 1.33 0.00 2.22 2.02 -0.98 -3.42 112.91 114.13 3h3r h THR 380 Ca 0.01 -2.60 -0.21 0.00 0.77 0.00 0.00 66.41 64.38 3h3r h THR 380 Cb 0.52 3.06 -0.04 0.00 -1.74 0.00 0.00 68.15 69.95 3h3r h THR 380 CO 0.04 0.77 -1.83 -1.22 0.37 0.00 0.00 175.52 173.65 3h3r n TYR 381 N -3.89 0.00 1.14 3.16 4.02 -0.17 -4.63 117.16 116.79 3h3r n TYR 381 Ca -0.17 0.00 0.14 0.00 -0.01 0.00 0.00 57.90 57.86 3h3r n TYR 381 Cb 0.98 -0.59 0.60 0.00 -0.02 0.00 0.00 39.34 40.31 3h3r n TYR 381 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3h3r n SER 382 N -2.43 0.12 -1.21 7.72 7.64 0.61 -3.16 113.62 122.92 3h3r n SER 382 Ca -0.19 0.14 0.11 0.00 1.01 0.00 0.00 58.87 59.95 3h3r n SER 382 Cb 0.87 -0.31 0.29 0.00 -1.01 0.00 0.00 64.21 64.04 3h3r n SER 382 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3h3r n LEU 383 N -1.39 3.53 -4.76 -3.43 4.77 -1.25 -4.95 117.00 109.53 3h3r n LEU 383 Ca 0.09 -1.72 -0.40 0.00 -0.03 0.00 0.00 56.01 53.95 3h3r n LEU 383 Cb 0.31 -0.41 -0.04 0.00 -2.33 0.00 0.00 43.42 40.95 3h3r n LEU 383 CO 0.27 0.86 0.78 -1.10 -1.33 0.00 0.00 177.39 176.87 3h3r s GLN 384 N -1.19 4.65 -0.58 3.23 -0.21 -1.19 -4.95 119.66 119.41 3h3r s GLN 384 Ca 0.44 1.78 -0.27 0.00 0.02 0.00 0.00 55.36 57.32 3h3r s GLN 384 Cb 0.23 -3.21 -0.00 0.00 1.00 0.00 0.00 33.01 31.03 3h3r s GLN 384 CO 0.31 0.21 1.62 0.34 -2.12 0.00 0.00 175.29 175.65 3h3r s ASP 385 N -0.79 5.74 0.08 5.90 -1.08 -1.26 -4.87 116.67 120.39 3h3r s ASP 385 Ca 0.45 0.31 0.27 0.00 -0.52 0.00 0.00 52.55 53.06 3h3r s ASP 385 Cb -0.31 -2.54 0.97 0.00 -1.46 0.00 0.00 42.92 39.58 3h3r s ASP 385 CO 0.40 -2.01 1.80 1.33 0.52 0.00 0.00 175.17 177.20 3h3r n VAL 386 N 7.00 0.23 0.11 1.11 0.24 -1.26 -3.39 118.33 122.38 3h3r n VAL 386 Ca 0.15 -0.12 0.07 0.00 -2.04 0.00 0.00 64.34 62.40 3h3r n VAL 386 Cb 0.50 -0.45 0.54 0.00 -1.47 0.00 0.00 33.84 32.96 3h3r n VAL 386 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3h3r h GLY 387 N 4.80 0.29 -0.81 7.63 0.00 -1.97 -0.16 103.07 112.86 3h3r h GLY 387 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.22 3h3r h GLY 387 CO 0.00 0.10 -0.07 0.61 0.00 0.00 0.00 176.54 177.18 3h3r n GLY 388 N -1.51 0.19 3.47 4.60 0.00 -1.22 -4.88 105.19 105.85 3h3r n GLY 388 Ca 0.01 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 3h3r n GLY 388 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3h3r s ASP 389 N -2.10 6.19 0.00 1.61 -1.08 -0.07 -4.93 116.67 116.29 3h3r s ASP 389 Ca 0.32 -0.75 0.21 0.00 -0.52 0.00 0.00 52.55 51.82 3h3r s ASP 389 Cb 0.20 -2.22 1.05 0.00 -1.46 0.00 0.00 42.92 40.49 3h3r s ASP 389 CO 0.37 -0.60 1.69 0.00 0.52 0.00 0.00 175.17 177.14 3h3r n ALA 390 N 5.59 2.09 1.21 3.66 0.00 -1.26 -1.03 120.51 130.77 3h3r n ALA 390 Ca -0.08 -0.10 0.14 0.00 0.00 0.00 0.00 53.44 53.40 3h3r n ALA 390 Cb 0.47 -1.35 0.57 0.00 0.00 0.00 0.00 19.45 19.14 3h3r n ALA 390 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3h3r n ASN 391 N -1.32 0.27 -4.72 0.00 4.13 -1.26 -4.83 115.26 107.53 3h3r n ASN 391 Ca 0.09 -0.13 -0.28 0.00 1.68 0.00 0.00 54.58 55.95 3h3r n ASN 391 Cb 0.18 -0.17 -0.07 0.00 -1.54 0.00 0.00 39.78 38.18 3h3r n ASN 391 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 3h3r s TRP 392 N -2.74 3.00 -0.11 3.10 0.52 -0.20 -4.53 118.94 117.98 3h3r s TRP 392 Ca 0.21 -0.06 0.02 0.00 0.02 0.00 0.00 56.10 56.30 3h3r s TRP 392 Cb 0.19 -1.48 0.01 0.00 -1.15 0.00 0.00 33.47 31.05 3h3r s TRP 392 CO 0.53 0.51 -0.19 -1.14 0.02 0.00 0.00 176.95 176.68 3h3r s GLN 393 N -2.80 2.54 -0.41 4.98 0.74 0.12 -4.91 119.66 119.91 3h3r s GLN 393 Ca 0.28 -0.69 -0.29 0.00 0.05 0.00 0.00 55.36 54.72 3h3r s GLN 393 Cb -0.10 -2.05 0.01 0.00 1.10 0.00 0.00 33.01 31.96 3h3r s GLN 393 CO 0.20 0.02 1.42 -1.17 -0.55 0.00 0.00 175.29 175.21 3h3r s LEU 394 N 0.76 3.58 -0.13 3.68 2.96 -1.26 -1.09 118.68 127.17 3h3r s LEU 394 Ca -0.11 0.83 0.19 0.00 -0.22 0.00 0.00 54.13 54.82 3h3r s LEU 394 Cb -0.16 -3.54 -0.28 0.00 0.50 0.00 0.00 46.19 42.71 3h3r s LEU 394 CO 0.01 -1.45 0.23 1.33 -1.32 0.00 0.00 176.35 175.16 3h3r n VAL 395 N 7.10 0.81 -3.78 1.68 0.24 0.55 -4.95 118.33 119.98 3h3r n VAL 395 Ca 0.17 -0.70 -0.13 0.00 -2.04 0.00 0.00 64.34 61.63 3h3r n VAL 395 Cb 0.48 -0.28 -0.14 0.00 -1.47 0.00 0.00 33.84 32.44 3h3r n VAL 395 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3h3r s VAL 396 N -2.89 -0.03 -0.01 3.34 1.01 -1.14 -5.03 120.40 115.65 3h3r s VAL 396 Ca -0.09 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.01 3h3r s VAL 396 Cb 0.09 -0.23 0.01 0.00 0.00 0.00 0.00 36.38 36.25 3h3r s VAL 396 CO 0.85 0.05 -0.02 -0.70 0.00 0.00 0.00 175.10 175.28 3h3r s GLU 397 N 0.76 0.21 -0.26 2.72 2.12 -1.26 -0.64 118.70 122.35 3h3r s GLU 397 Ca -0.06 -0.03 -0.10 0.00 0.36 0.00 0.00 54.97 55.14 3h3r s GLU 397 Cb -0.08 -0.26 0.10 0.00 0.26 0.00 0.00 34.13 34.16 3h3r s GLU 397 CO -0.04 -0.01 0.57 -2.00 -0.54 0.00 0.00 175.26 173.25 3h3r s GLU 398 N 0.26 0.51 6.97 4.30 2.12 -0.08 -5.02 118.70 127.76 3h3r s GLU 398 Ca -0.02 1.24 0.00 0.00 0.36 0.00 0.00 54.97 56.54 3h3r s GLU 398 Cb -0.05 0.51 0.00 0.00 0.26 0.00 0.00 34.13 34.86 3h3r s GLU 398 CO -0.01 -0.20 0.00 0.41 -0.54 0.00 0.00 175.26 174.92 3h3r n GLY 399 N 5.12 3.22 0.00 -1.50 0.00 -1.26 -1.79 105.19 108.98 3h3r n GLY 399 Ca -0.14 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 45.77 3h3r n GLY 399 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h3r n GLU 400 N 13.92 0.30 -3.31 1.61 -0.58 -1.26 -4.86 120.64 126.47 3h3r n GLU 400 Ca 0.00 0.03 -0.38 0.00 -0.42 0.00 0.00 57.16 56.39 3h3r n GLU 400 Cb 0.00 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.31 3h3r n GLU 400 CO 0.00 0.00 0.00 1.41 -0.48 0.00 0.00 177.13 178.06 3h3r s MET 401 N -2.66 4.28 -0.04 3.49 1.75 -0.74 -4.05 119.30 121.32 3h3r s MET 401 Ca 0.23 0.40 0.04 0.00 -1.25 0.00 0.00 55.69 55.11 3h3r s MET 401 Cb 0.18 -3.48 -0.00 0.00 2.84 0.00 0.00 34.83 34.36 3h3r s MET 401 CO 0.43 0.05 -0.17 0.15 -0.65 0.00 0.00 175.02 174.83 3h3r s LYS 402 N 0.99 1.65 -0.08 4.11 1.02 -0.56 -0.90 119.74 125.97 3h3r s LYS 402 Ca 0.24 -0.59 0.03 0.00 0.02 0.00 0.00 55.97 55.67 3h3r s LYS 402 Cb -0.15 -1.47 0.01 0.00 -0.52 0.00 0.00 37.83 35.70 3h3r s LYS 402 CO 0.10 0.26 -0.15 0.08 -0.92 0.00 0.00 175.35 174.72 3h3r s VAL 403 N -0.05 1.39 0.23 3.17 1.01 0.19 -0.88 120.40 125.46 3h3r s VAL 403 Ca -0.01 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.41 3h3r s VAL 403 Cb -0.10 -1.25 -0.05 0.00 0.00 0.00 0.00 36.38 34.98 3h3r s VAL 403 CO 0.01 0.41 -0.11 -0.31 0.00 0.00 0.00 175.10 175.11 3h3r s TYR 404 N 0.62 1.76 0.17 5.22 2.02 0.80 -0.33 117.35 127.61 3h3r s TYR 404 Ca -0.15 -0.64 -0.16 0.00 -0.37 0.00 0.00 57.07 55.75 3h3r s TYR 404 Cb -0.16 -0.89 0.03 0.00 -0.40 0.00 0.00 41.96 40.53 3h3r s TYR 404 CO 0.05 0.30 0.46 -0.98 -1.57 0.00 0.00 175.55 173.80 3h3r s ARG 405 N -3.69 1.26 -0.12 -0.62 1.70 -0.25 -1.64 118.95 115.59 3h3r s ARG 405 Ca 0.25 -0.86 0.01 0.00 -0.47 0.00 0.00 55.73 54.67 3h3r s ARG 405 Cb 0.01 0.49 0.02 0.00 -0.57 0.00 0.00 34.95 34.90 3h3r s ARG 405 CO 0.08 -0.52 -0.16 0.50 -1.08 0.00 0.00 175.30 174.13 3h3r s ARG 406 N -3.86 2.30 -0.30 3.89 3.52 -0.65 0.12 118.95 123.97 3h3r s ARG 406 Ca 0.08 -0.58 -0.29 0.00 -0.13 0.00 0.00 55.73 54.81 3h3r s ARG 406 Cb 0.00 -1.98 0.00 0.00 -1.56 0.00 0.00 34.95 31.42 3h3r s ARG 406 CO -0.05 -0.09 1.26 -1.21 -0.81 0.00 0.00 175.30 174.40 3h3r s GLU 407 N 1.07 3.95 -0.04 5.12 2.02 -1.26 -3.09 118.70 126.47 3h3r s GLU 407 Ca -0.04 1.24 0.02 0.00 0.02 0.00 0.00 54.97 56.20 3h3r s GLU 407 Cb -0.15 -3.85 0.02 0.00 0.10 0.00 0.00 34.13 30.25 3h3r s GLU 407 CO -0.03 -1.07 -0.08 0.08 0.02 0.00 0.00 175.26 174.18 3h3r s VAL 408 N 4.21 0.75 -0.04 2.63 1.01 -1.26 -4.93 120.40 122.77 3h3r s VAL 408 Ca 0.54 -0.28 0.01 0.00 0.00 0.00 0.00 61.98 62.26 3h3r s VAL 408 Cb -0.16 -0.72 0.02 0.00 0.00 0.00 0.00 36.38 35.52 3h3r s VAL 408 CO 0.22 0.26 -0.05 -1.61 0.00 0.00 0.00 175.10 173.92 3h3r s GLU 409 N 0.66 0.86 -0.11 2.72 2.02 -1.26 0.51 118.70 124.11 3h3r s GLU 409 Ca -0.11 -0.12 0.03 0.00 0.02 0.00 0.00 54.97 54.79 3h3r s GLU 409 Cb -0.13 -0.85 0.01 0.00 0.10 0.00 0.00 34.13 33.26 3h3r s GLU 409 CO 0.01 -0.07 -0.21 -1.21 0.02 0.00 0.00 175.26 173.81 3h3r s GLU 410 N 0.86 2.78 -1.46 1.61 2.02 -0.04 -4.73 118.70 119.74 3h3r s GLU 410 Ca -0.12 -0.78 -0.11 0.00 0.02 0.00 0.00 54.97 53.98 3h3r s GLU 410 Cb -0.14 -2.19 0.06 0.00 0.10 0.00 0.00 34.13 31.96 3h3r s GLU 410 CO 0.00 0.08 1.02 0.09 0.02 0.00 0.00 175.26 176.47 3h3r n ASN 411 N 3.80 -4.94 0.00 -0.19 5.03 -1.26 -1.74 115.26 115.97 3h3r n ASN 411 Ca -0.20 -0.71 0.00 0.00 0.87 0.00 0.00 54.58 54.54 3h3r n ASN 411 Cb 0.52 -4.24 0.00 0.00 -1.02 0.00 0.00 39.78 35.04 3h3r n ASN 411 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h3r n GLY 412 N -1.76 2.33 3.80 7.41 0.00 -1.26 -5.02 105.19 110.68 3h3r n GLY 412 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3h3r n GLY 412 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3r s ILE 413 N -2.51 5.40 -0.22 -0.61 -1.09 -0.71 -5.05 121.20 116.41 3h3r s ILE 413 Ca 0.00 0.32 -0.29 0.00 -2.23 0.00 0.00 60.65 58.45 3h3r s ILE 413 Cb 0.00 -3.49 0.01 0.00 -1.58 0.00 0.00 42.46 37.39 3h3r s ILE 413 CO 0.00 0.52 1.05 -0.69 -1.23 0.00 0.00 174.94 174.59 3h3r s VAL 414 N -0.31 4.66 -0.36 2.92 1.01 -1.26 -0.86 120.40 126.20 3h3r s VAL 414 Ca 0.14 2.01 0.04 0.00 0.00 0.00 0.00 61.98 64.16 3h3r s VAL 414 Cb -0.12 -4.29 0.01 0.00 0.00 0.00 0.00 36.38 31.97 3h3r s VAL 414 CO 0.03 -0.17 0.45 0.18 0.00 0.00 0.00 175.10 175.59 3h3r n LEU 415 N 6.30 0.91 0.00 3.92 4.77 0.18 -4.77 117.00 128.32 3h3r n LEU 415 Ca 0.12 -0.83 0.00 0.00 -0.03 0.00 0.00 56.01 55.27 3h3r n LEU 415 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 3h3r n LEU 415 CO 0.52 0.20 0.00 0.47 -1.33 0.00 0.00 177.39 177.25 3h3r n ASP 416 N -0.23 0.00 -4.76 -1.43 8.00 -1.08 -4.37 116.55 112.67 3h3r n ASP 416 Ca 0.02 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.11 3h3r n ASP 416 Cb 0.08 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.19 3h3r n ASP 416 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3h3r n PRO 417 N 0.00 2.41 -5.04 -0.24 -0.02 -1.18 -4.64 135.00 126.29 3h3r n PRO 417 Ca 0.00 0.85 -0.29 0.00 -2.02 0.00 0.00 63.50 62.04 3h3r n PRO 417 Cb 0.00 -2.63 -0.15 0.00 -0.02 0.00 0.00 33.50 30.70 3h3r n PRO 417 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3h3r s LEU 418 N -2.33 2.10 -0.02 2.45 0.20 -0.03 -1.64 118.68 119.40 3h3r s LEU 418 Ca 0.58 -0.50 -0.00 0.00 0.69 0.00 0.00 54.13 54.90 3h3r s LEU 418 Cb -0.47 -1.22 0.03 0.00 -0.43 0.00 0.00 46.19 44.10 3h3r s LEU 418 CO 0.60 0.27 0.03 -0.75 -0.29 0.00 0.00 176.35 176.21 3h3r s LYS 419 N -0.86 0.02 0.12 1.98 2.20 -0.65 -0.89 119.74 121.66 3h3r s LYS 419 Ca 0.10 0.18 0.11 0.00 -0.36 0.00 0.00 55.97 55.99 3h3r s LYS 419 Cb -0.09 -0.31 -0.04 0.00 -1.51 0.00 0.00 37.83 35.88 3h3r s LYS 419 CO 0.00 -0.17 -0.26 0.00 -0.36 0.00 0.00 175.35 174.56 3h3r s ALA 420 N 1.13 2.41 0.07 3.13 0.00 0.66 -0.14 121.76 129.02 3h3r s ALA 420 Ca -0.08 -1.43 0.07 0.00 0.00 0.00 0.00 51.96 50.52 3h3r s ALA 420 Cb -0.13 -0.43 -0.03 0.00 0.00 0.00 0.00 23.12 22.53 3h3r s ALA 420 CO -0.03 0.55 -0.19 0.95 0.00 0.00 0.00 175.76 177.04 3h3r s THR 421 N -1.05 1.57 0.12 0.00 -4.23 -0.06 -0.58 115.64 111.41 3h3r s THR 421 Ca 0.14 -1.32 -0.17 0.00 -1.18 0.00 0.00 61.69 59.17 3h3r s THR 421 Cb -0.10 -1.40 0.04 0.00 1.34 0.00 0.00 72.50 72.37 3h3r s THR 421 CO 0.06 0.04 0.41 -2.28 -0.54 0.00 0.00 174.62 172.31 3h3r s HIS 422 N -0.99 -0.23 -0.14 3.99 2.46 -0.25 -1.50 115.29 118.63 3h3r s HIS 422 Ca 0.05 -0.05 -0.04 0.00 0.47 0.00 0.00 55.06 55.50 3h3r s HIS 422 Cb -0.09 0.27 0.05 0.00 -0.13 0.00 0.00 32.58 32.68 3h3r s HIS 422 CO 0.03 -0.69 0.07 0.00 -2.47 0.00 0.00 174.74 171.68 3h3r s ALA 423 N -3.62 0.47 -0.24 1.58 0.00 -1.26 -0.29 121.76 118.41 3h3r s ALA 423 Ca 0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 3h3r s ALA 423 Cb 0.01 -0.95 0.02 0.00 0.00 0.00 0.00 23.12 22.20 3h3r s ALA 423 CO -0.11 -1.00 -0.07 0.08 0.00 0.00 0.00 175.76 174.66 3h3r s VAL 424 N 2.10 2.83 0.34 0.00 1.01 0.35 -4.84 120.40 122.18 3h3r s VAL 424 Ca 0.02 -0.97 -0.27 0.00 0.00 0.00 0.00 61.98 60.76 3h3r s VAL 424 Cb -0.15 -2.40 -0.09 0.00 0.00 0.00 0.00 36.38 33.74 3h3r s VAL 424 CO -0.07 0.25 1.10 -0.54 0.00 0.00 0.00 175.10 175.84 3h3r s LYS 425 N 1.33 4.40 0.00 2.72 1.02 -1.26 -0.88 119.74 127.07 3h3r s LYS 425 Ca 0.01 1.74 0.00 0.00 0.02 0.00 0.00 55.97 57.74 3h3r s LYS 425 Cb -0.16 -2.92 0.00 0.00 -0.52 0.00 0.00 37.83 34.23 3h3r s LYS 425 CO -0.05 0.01 0.00 0.41 -0.92 0.00 0.00 175.35 174.80 3h3r n GLY 426 N 0.85 0.72 3.12 -3.33 0.00 -0.16 -4.92 105.19 101.46 3h3r n GLY 426 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 3h3r n GLY 426 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h3r s VAL 427 N -2.06 0.58 0.29 1.61 -7.23 -1.26 -4.86 120.40 107.49 3h3r s VAL 427 Ca 0.00 -1.57 0.04 0.00 -1.81 0.00 0.00 61.98 58.64 3h3r s VAL 427 Cb 0.00 -1.21 -0.03 0.00 0.56 0.00 0.00 36.38 35.70 3h3r s VAL 427 CO 0.00 -0.68 0.44 0.42 -0.31 0.00 0.00 175.10 174.97 3h3r s THR 428 N -2.71 4.96 0.35 5.32 -4.23 -1.26 -3.18 115.64 114.89 3h3r s THR 428 Ca 0.02 -0.83 0.05 0.00 -1.18 0.00 0.00 61.69 59.74 3h3r s THR 428 Cb -0.01 -3.77 0.19 0.00 1.34 0.00 0.00 72.50 70.26 3h3r s THR 428 CO -0.03 -0.36 1.93 1.23 -0.54 0.00 0.00 174.62 176.85 3h3r h GLY 429 N 0.98 0.59 0.98 3.99 0.00 -1.86 -1.43 103.07 106.32 3h3r h GLY 429 Ca -0.50 -0.31 0.01 0.00 0.00 0.00 0.00 47.33 46.53 3h3r h GLY 429 CO 0.60 0.29 0.23 0.84 0.00 0.00 0.00 176.54 178.50 3h3r h HIS 430 N 0.55 0.44 -0.33 5.60 -0.00 -1.88 -0.33 115.15 119.19 3h3r h HIS 430 Ca 0.13 0.01 -0.08 0.00 -0.00 0.00 0.00 60.37 60.43 3h3r h HIS 430 Cb 0.20 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 27.46 3h3r h HIS 430 CO 0.01 0.27 -0.09 0.93 -0.00 0.00 0.00 177.93 179.05 3h3r h GLU 431 N 0.47 0.65 -0.35 5.26 5.08 -1.63 -1.72 114.58 122.34 3h3r h GLU 431 Ca 0.13 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3h3r h GLU 431 Cb -0.04 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 3h3r h GLU 431 CO -0.04 0.83 0.22 0.28 -1.00 0.00 0.00 179.01 179.30 3h3r h VAL 432 N 0.43 1.11 -0.57 3.13 2.07 -1.17 -1.29 116.25 119.96 3h3r h VAL 432 Ca 0.08 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.30 3h3r h VAL 432 Cb 0.60 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 3h3r h VAL 432 CO 0.04 0.11 0.10 0.00 0.02 0.00 0.00 177.57 177.83 3h3r h ASN 434 N 0.84 -0.32 0.18 0.00 -0.26 -0.95 0.23 115.58 115.30 3h3r h ASN 434 Ca 0.17 0.09 -0.11 0.00 -0.56 0.00 0.00 56.30 55.90 3h3r h ASN 434 Cb 0.41 0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.85 3h3r h ASN 434 CO 0.01 -0.12 -0.39 1.88 -1.06 0.00 0.00 177.43 177.75 3h3r h TYR 435 N -0.04 0.33 -0.38 1.19 -1.99 -1.05 0.26 116.97 115.28 3h3r h TYR 435 Ca 0.13 -0.09 -0.04 0.00 2.00 0.00 0.00 58.73 60.73 3h3r h TYR 435 Cb 0.24 -0.07 -0.01 0.00 2.00 0.00 0.00 36.73 38.88 3h3r h TYR 435 CO -0.28 0.63 0.06 0.35 -0.00 0.00 0.00 178.16 178.93 3h3r h PHE 436 N 0.24 0.66 0.10 4.88 3.57 -0.73 -3.29 116.94 122.37 3h3r h PHE 436 Ca 0.02 -0.09 -0.26 0.00 3.53 0.00 0.00 57.97 61.17 3h3r h PHE 436 Cb 0.80 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.35 3h3r h PHE 436 CO 0.02 0.67 -1.18 2.35 -2.23 0.00 0.00 178.31 177.93 3h3r h TRP 437 N 0.47 0.43 -2.69 0.41 7.01 -0.76 -3.45 115.95 117.36 3h3r h TRP 437 Ca 0.12 -0.30 -0.57 0.00 2.11 0.00 0.00 58.89 60.24 3h3r h TRP 437 Cb 0.36 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.37 3h3r h TRP 437 CO 0.02 1.22 1.25 1.21 -2.79 0.00 0.00 178.44 179.36 3h3r s ASN 438 N -7.08 5.90 0.57 2.65 2.47 0.91 -4.87 114.94 115.49 3h3r s ASN 438 Ca -0.03 1.16 0.29 0.00 0.42 0.00 0.00 52.86 54.69 3h3r s ASN 438 Cb 0.08 -2.53 1.71 0.00 -1.45 0.00 0.00 41.25 39.06 3h3r s ASN 438 CO 0.87 -1.73 2.20 -0.37 -3.72 0.00 0.00 177.10 174.36 3h3r h VAL 439 N 6.77 0.55 0.00 -5.21 -1.51 -1.89 -2.83 116.25 112.12 3h3r h VAL 439 Ca -0.32 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 65.00 3h3r h VAL 439 Cb 1.16 1.10 0.00 0.00 -2.13 0.00 0.00 31.29 31.42 3h3r h VAL 439 CO 1.05 0.03 0.00 0.44 -1.23 0.00 0.00 177.57 177.87 3h3r h ASP 440 N 0.00 0.00 -0.03 4.19 3.32 -1.96 -2.84 116.42 119.10 3h3r h ASP 440 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3h3r h ASP 440 Cb 0.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.64 3h3r h ASP 440 CO 0.00 0.00 0.00 1.33 -1.72 0.00 0.00 179.24 178.85 3h3r n VAL 441 N -3.03 0.39 -0.25 -1.35 0.24 -1.07 -4.74 118.33 108.52 3h3r n VAL 441 Ca -0.02 -0.69 0.05 0.00 -2.04 0.00 0.00 64.34 61.63 3h3r n VAL 441 Cb 0.12 0.83 0.16 0.00 -1.47 0.00 0.00 33.84 33.48 3h3r n VAL 441 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3h3r h ARG 442 N 0.39 0.14 0.00 7.34 9.65 -1.55 0.54 114.38 130.90 3h3r h ARG 442 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3h3r h ARG 442 Cb 0.26 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.81 3h3r h ARG 442 CO 0.00 0.09 0.00 -0.91 2.80 0.00 0.00 179.97 181.95 3h3r h ASN 443 N 0.14 0.00 1.16 -3.80 -0.26 -1.85 0.84 115.58 111.82 3h3r h ASN 443 Ca 0.41 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 56.10 3h3r h ASN 443 Cb 0.71 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.97 3h3r h ASN 443 CO -0.61 0.00 -0.24 0.44 -1.06 0.00 0.00 177.43 175.96 3h3r h ASP 444 N 0.00 0.00 0.00 5.81 5.19 -1.23 -3.38 116.42 122.81 3h3r h ASP 444 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3h3r h ASP 444 Cb 0.40 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.91 3h3r h ASP 444 CO 0.00 0.24 -0.72 -2.67 -3.12 0.00 0.00 179.24 172.96 3h3r n TRP 445 N -3.30 0.00 -2.83 4.55 4.27 -0.80 -5.04 117.44 114.29 3h3r n TRP 445 Ca 0.01 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 53.21 3h3r n TRP 445 Cb 0.49 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.40 3h3r n TRP 445 CO 0.00 0.00 0.00 -2.00 -2.29 0.00 0.00 177.69 173.40 3h3r s GLU 446 N -1.51 4.56 -0.00 -2.67 2.56 0.22 -4.68 118.70 117.18 3h3r s GLU 446 Ca 0.00 1.26 0.09 0.00 0.00 0.00 0.00 54.97 56.32 3h3r s GLU 446 Cb 0.00 -3.42 -0.11 0.00 2.00 0.00 0.00 34.13 32.60 3h3r s GLU 446 CO 0.00 0.09 0.35 0.25 -0.56 0.00 0.00 175.26 175.39 3h3r n THR 447 N 3.41 0.00 -0.18 -1.70 -2.24 -1.26 -4.62 114.28 107.69 3h3r n THR 447 Ca 0.02 -0.27 0.12 0.00 -2.27 0.00 0.00 64.05 61.65 3h3r n THR 447 Cb 0.50 0.84 0.30 0.00 -2.10 0.00 0.00 70.33 69.88 3h3r n THR 447 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3h3r n THR 448 N -1.35 0.88 -3.79 4.28 -2.24 -1.26 -4.91 114.28 105.90 3h3r n THR 448 Ca 0.01 -0.92 -0.36 0.00 -2.27 0.00 0.00 64.05 60.51 3h3r n THR 448 Cb 0.16 0.56 -0.09 0.00 -2.10 0.00 0.00 70.33 68.86 3h3r n THR 448 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3h3r s ILE 449 N -1.12 5.13 -0.15 2.28 -1.09 -1.26 -0.46 121.20 124.53 3h3r s ILE 449 Ca 0.47 0.09 -0.19 0.00 -2.23 0.00 0.00 60.65 58.79 3h3r s ILE 449 Cb 0.25 -3.36 -0.16 0.00 -1.58 0.00 0.00 42.46 37.61 3h3r s ILE 449 CO 0.33 0.40 0.35 -0.08 -1.23 0.00 0.00 174.94 174.71 3h3r h GLU 450 N 7.12 0.00 -3.65 2.79 4.81 -1.14 -3.43 114.58 121.08 3h3r h GLU 450 Ca -0.38 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.76 3h3r h GLU 450 Cb 1.16 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.39 3h3r h GLU 450 CO 0.69 0.68 -0.33 1.21 -0.73 0.00 0.00 179.01 180.52 3h3r s ASN 451 N -6.19 0.04 0.07 1.04 3.84 -1.20 -5.00 114.94 107.53 3h3r s ASN 451 Ca -0.17 -0.50 -0.16 0.00 0.21 0.00 0.00 52.86 52.25 3h3r s ASN 451 Cb 0.01 0.34 0.03 0.00 -0.55 0.00 0.00 41.25 41.08 3h3r s ASN 451 CO 0.47 -0.69 0.37 0.72 -2.79 0.00 0.00 177.10 175.18 3h3r s PHE 452 N -3.39 -0.17 0.06 0.43 -0.12 -1.26 -1.09 117.98 112.44 3h3r s PHE 452 Ca 0.01 -0.01 -0.17 0.00 -0.05 0.00 0.00 56.93 56.71 3h3r s PHE 452 Cb 0.02 0.18 0.03 0.00 -0.63 0.00 0.00 43.02 42.63 3h3r s PHE 452 CO -0.08 -0.60 0.40 -3.38 -0.05 0.00 0.00 175.22 171.50 3h3r s HIS 453 N -3.06 -0.23 -0.22 3.49 -3.43 0.20 -4.99 115.29 107.05 3h3r s HIS 453 Ca -0.02 0.11 -0.29 0.00 -0.80 0.00 0.00 55.06 54.06 3h3r s HIS 453 Cb 0.01 0.21 0.00 0.00 -1.43 0.00 0.00 32.58 31.37 3h3r s HIS 453 CO -0.07 -0.60 1.16 0.08 -2.00 0.00 0.00 174.74 173.32 3h3r s VAL 454 N -2.82 4.44 0.09 -5.38 1.01 -1.26 -1.13 120.40 115.34 3h3r s VAL 454 Ca -0.03 1.72 -0.04 0.00 0.00 0.00 0.00 61.98 63.63 3h3r s VAL 454 Cb -0.00 -4.18 -0.27 0.00 0.00 0.00 0.00 36.38 31.94 3h3r s VAL 454 CO -0.05 -0.23 1.17 0.58 0.00 0.00 0.00 175.10 176.57 3h3r h VAL 455 N 5.56 1.49 -1.92 2.92 2.07 -1.11 -3.48 116.25 121.79 3h3r h VAL 455 Ca -0.23 -2.99 -0.02 0.00 0.82 0.00 0.00 66.70 64.28 3h3r h VAL 455 Cb 1.08 2.87 -0.21 0.00 -1.52 0.00 0.00 31.29 33.51 3h3r h VAL 455 CO 0.99 0.87 0.22 -0.70 0.02 0.00 0.00 177.57 178.97 3h3r s GLU 456 N -2.75 0.83 -0.25 1.57 2.12 -1.19 -4.98 118.70 114.06 3h3r s GLU 456 Ca -0.04 0.70 -0.09 0.00 0.36 0.00 0.00 54.97 55.91 3h3r s GLU 456 Cb 0.07 0.40 -0.04 0.00 0.26 0.00 0.00 34.13 34.83 3h3r s GLU 456 CO 0.88 -0.16 0.11 0.99 -0.54 0.00 0.00 175.26 176.54 3h3r s THR 457 N -0.13 4.76 -0.18 -1.70 2.01 -1.26 0.02 115.64 119.15 3h3r s THR 457 Ca -0.02 -0.02 0.10 0.00 0.31 0.00 0.00 61.69 62.05 3h3r s THR 457 Cb -0.03 -3.22 -0.23 0.00 0.01 0.00 0.00 72.50 69.02 3h3r s THR 457 CO 0.02 0.33 0.14 0.18 -0.69 0.00 0.00 174.62 174.61 3h3r n LEU 458 N 4.67 1.20 -3.77 4.42 4.77 -0.12 -5.01 117.00 123.17 3h3r n LEU 458 Ca -0.16 0.07 -0.03 0.00 -0.03 0.00 0.00 56.01 55.86 3h3r n LEU 458 Cb 0.52 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.50 3h3r n LEU 458 CO 0.33 0.63 0.73 0.00 -1.33 0.00 0.00 177.39 177.74 3h3r s ALA 459 N -2.53 -1.64 0.56 -1.18 0.00 -0.93 -4.67 121.76 111.38 3h3r s ALA 459 Ca -0.17 0.07 0.30 0.00 0.00 0.00 0.00 51.96 52.16 3h3r s ALA 459 Cb 0.07 0.65 1.46 0.00 0.00 0.00 0.00 23.12 25.31 3h3r s ALA 459 CO 0.76 -1.05 1.90 -0.44 0.00 0.00 0.00 175.76 176.94 3h3r h ASP 460 N 2.00 0.00 -0.09 0.00 3.32 -2.02 -2.60 116.42 117.03 3h3r h ASP 460 Ca -0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.81 3h3r h ASP 460 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3h3r h ASP 460 CO 0.26 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.32 3h3r n ASN 461 N -4.06 2.48 -3.69 6.45 6.94 -1.26 -5.01 115.26 117.11 3h3r n ASN 461 Ca 0.14 -2.44 -0.12 0.00 -0.02 0.00 0.00 54.58 52.14 3h3r n ASN 461 Cb 0.81 -0.23 -0.12 0.00 -2.36 0.00 0.00 39.78 37.88 3h3r n ASN 461 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3h3r s ALA 462 N -1.77 -0.77 0.09 -2.53 0.00 -0.98 -1.62 121.76 114.18 3h3r s ALA 462 Ca 0.18 1.18 0.01 0.00 0.00 0.00 0.00 51.96 53.33 3h3r s ALA 462 Cb 0.14 -0.95 -0.04 0.00 0.00 0.00 0.00 23.12 22.27 3h3r s ALA 462 CO 0.05 -0.46 -0.04 0.96 0.00 0.00 0.00 175.76 176.26 3h3r s ILE 463 N 1.92 0.49 -0.14 0.00 -4.36 -0.61 -0.95 121.20 117.55 3h3r s ILE 463 Ca -0.04 -1.89 -0.03 0.00 -0.26 0.00 0.00 60.65 58.43 3h3r s ILE 463 Cb -0.11 -1.67 -0.03 0.00 1.25 0.00 0.00 42.46 41.90 3h3r s ILE 463 CO -0.10 -0.87 -0.05 -0.63 0.24 0.00 0.00 174.94 173.53 3h3r s ILE 464 N -3.76 3.82 -0.03 8.37 1.01 0.10 0.10 121.20 130.81 3h3r s ILE 464 Ca 0.12 -0.39 0.07 0.00 0.00 0.00 0.00 60.65 60.44 3h3r s ILE 464 Cb 0.06 -2.65 -0.01 0.00 0.01 0.00 0.00 42.46 39.87 3h3r s ILE 464 CO -0.06 0.51 -0.23 -0.63 0.00 0.00 0.00 174.94 174.54 3h3r s ILE 465 N 0.15 1.81 -0.11 2.92 1.01 0.54 -0.45 121.20 127.07 3h3r s ILE 465 Ca -0.02 -0.96 0.00 0.00 0.00 0.00 0.00 60.65 59.67 3h3r s ILE 465 Cb -0.14 -1.51 -0.02 0.00 0.01 0.00 0.00 42.46 40.80 3h3r s ILE 465 CO 0.03 0.51 -0.12 -0.47 0.00 0.00 0.00 174.94 174.89 3h3r s TYR 466 N -0.40 2.82 -0.00 3.97 5.04 -0.28 -1.40 117.35 127.09 3h3r s TYR 466 Ca 0.05 -0.45 -0.09 0.00 -2.44 0.00 0.00 57.07 54.14 3h3r s TYR 466 Cb -0.10 -1.80 0.01 0.00 0.35 0.00 0.00 41.96 40.42 3h3r s TYR 466 CO 0.00 -0.06 0.18 1.14 -1.34 0.00 0.00 175.55 175.47 3h3r s GLN 467 N 0.02 0.53 -0.04 4.97 -2.07 -0.70 -0.63 119.66 121.74 3h3r s GLN 467 Ca -0.03 -0.36 0.01 0.00 -1.82 0.00 0.00 55.36 53.16 3h3r s GLN 467 Cb -0.14 0.23 -0.03 0.00 -1.09 0.00 0.00 33.01 31.97 3h3r s GLN 467 CO 0.04 -0.13 -0.04 0.95 -1.32 0.00 0.00 175.29 174.78 3h3r s THR 468 N -1.40 3.87 0.02 3.63 -4.23 -0.25 -1.01 115.64 116.27 3h3r s THR 468 Ca -0.14 -0.55 -0.01 0.00 -1.18 0.00 0.00 61.69 59.81 3h3r s THR 468 Cb -0.07 -2.65 -0.04 0.00 1.34 0.00 0.00 72.50 71.08 3h3r s THR 468 CO 0.02 0.50 0.17 -1.00 -0.54 0.00 0.00 174.62 173.77 3h3r s HIS 469 N -0.93 3.49 0.65 3.99 3.76 -0.37 -0.64 115.29 125.23 3h3r s HIS 469 Ca 0.15 0.28 -0.18 0.00 -0.15 0.00 0.00 55.06 55.17 3h3r s HIS 469 Cb -0.11 -1.78 -0.01 0.00 1.11 0.00 0.00 32.58 31.79 3h3r s HIS 469 CO 0.05 0.61 1.26 0.15 -0.85 0.00 0.00 174.74 175.95 3h3r s LYS 470 N -2.15 2.57 -0.04 1.40 1.02 0.39 -4.39 119.74 118.53 3h3r s LYS 470 Ca 0.30 1.95 -0.30 0.00 0.02 0.00 0.00 55.97 57.93 3h3r s LYS 470 Cb -0.13 -1.86 -0.06 0.00 -0.52 0.00 0.00 37.83 35.26 3h3r s LYS 470 CO 0.22 -1.55 1.70 1.03 -0.92 0.00 0.00 175.35 175.83 3h3r s ARG 471 N -3.47 4.17 0.00 1.68 0.52 -1.26 -4.82 118.95 115.76 3h3r s ARG 471 Ca 0.80 2.25 0.16 0.00 -0.52 0.00 0.00 55.73 58.42 3h3r s ARG 471 Cb -0.34 -4.02 0.05 0.00 0.52 0.00 0.00 34.95 31.16 3h3r s ARG 471 CO 0.39 -0.87 0.93 1.33 0.02 0.00 0.00 175.30 177.10 3h3r n VAL 472 N 5.51 0.00 -4.10 3.52 0.24 -1.26 -4.94 118.33 117.29 3h3r n VAL 472 Ca 0.18 -0.40 -0.10 0.00 -2.04 0.00 0.00 64.34 61.98 3h3r n VAL 472 Cb 0.43 1.26 -0.09 0.00 -1.47 0.00 0.00 33.84 33.96 3h3r n VAL 472 CO 0.00 0.00 0.00 -1.66 -2.14 0.00 0.00 176.83 173.03 3h3r s TRP 473 N -1.70 0.77 -0.92 6.34 -2.14 -1.26 -4.93 118.94 115.10 3h3r s TRP 473 Ca 0.16 -1.12 -0.24 0.00 2.66 0.00 0.00 56.10 57.55 3h3r s TRP 473 Cb 0.13 -0.37 -0.02 0.00 -3.10 0.00 0.00 33.47 30.12 3h3r s TRP 473 CO 0.33 -0.60 1.79 -2.14 -2.66 0.00 0.00 176.95 173.68 3h3r s PRO 474 N -4.04 2.86 0.05 3.25 0.02 -1.26 -4.79 135.00 131.09 3h3r s PRO 474 Ca 0.24 -0.48 -0.11 0.00 0.02 0.00 0.00 61.00 60.67 3h3r s PRO 474 Cb 0.06 -5.10 0.04 0.00 0.02 0.00 0.00 34.50 29.52 3h3r s PRO 474 CO 0.03 -3.01 0.53 0.00 -0.33 0.00 0.00 177.00 174.22 3h3r n ALA 475 N 12.44 -1.42 -1.67 -1.55 0.00 -1.26 -5.12 120.51 121.92 3h3r n ALA 475 Ca 0.37 -0.45 -0.41 0.00 0.00 0.00 0.00 53.44 52.95 3h3r n ALA 475 Cb 0.48 0.20 0.02 0.00 0.00 0.00 0.00 19.45 20.15 3h3r n ALA 475 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3h3r n SER 476 N -0.80 2.07 -4.76 0.00 7.64 -1.26 -4.92 113.62 111.58 3h3r n SER 476 Ca 0.00 1.06 -0.37 0.00 1.01 0.00 0.00 58.87 60.57 3h3r n SER 476 Cb 0.27 -1.45 0.01 0.00 -1.01 0.00 0.00 64.21 62.03 3h3r n SER 476 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 3h3r s GLN 477 N -2.22 3.42 0.05 1.43 0.74 -1.26 -4.80 119.66 117.02 3h3r s GLN 477 Ca 0.63 1.91 0.02 0.00 0.05 0.00 0.00 55.36 57.96 3h3r s GLN 477 Cb -0.51 -2.26 -0.04 0.00 1.10 0.00 0.00 33.01 31.30 3h3r s GLN 477 CO 0.56 -0.86 0.08 1.03 -0.55 0.00 0.00 175.29 175.55 3h3r s ARG 478 N -2.90 2.95 0.38 1.67 3.00 -1.26 -0.90 118.95 121.89 3h3r s ARG 478 Ca 0.69 -0.61 0.06 0.00 0.00 0.00 0.00 55.73 55.87 3h3r s ARG 478 Cb -0.32 -2.77 -0.08 0.00 0.00 0.00 0.00 34.95 31.78 3h3r s ARG 478 CO 0.38 0.60 0.02 0.16 0.00 0.00 0.00 175.30 176.45 3h3r s ASP 479 N -2.13 3.47 -0.02 0.23 1.47 -0.10 -1.24 116.67 118.35 3h3r s ASP 479 Ca 0.27 -1.37 -0.15 0.00 1.18 0.00 0.00 52.55 52.49 3h3r s ASP 479 Cb -0.12 -0.31 0.02 0.00 -0.34 0.00 0.00 42.92 42.17 3h3r s ASP 479 CO 0.19 -0.48 0.31 0.54 0.68 0.00 0.00 175.17 176.40 3h3r s VAL 480 N -2.86 0.06 -0.14 2.11 0.11 -0.18 -1.35 120.40 118.14 3h3r s VAL 480 Ca 0.35 -0.46 -0.04 0.00 -2.93 0.00 0.00 61.98 58.90 3h3r s VAL 480 Cb 0.09 -0.60 0.06 0.00 -1.53 0.00 0.00 36.38 34.40 3h3r s VAL 480 CO 0.17 -0.25 0.13 -0.22 -3.33 0.00 0.00 175.10 171.60 3h3r s LEU 481 N -1.27 0.10 -0.07 2.54 2.96 -1.26 -1.73 118.68 119.96 3h3r s LEU 481 Ca -0.13 -0.18 -0.08 0.00 -0.22 0.00 0.00 54.13 53.52 3h3r s LEU 481 Cb -0.05 0.04 0.02 0.00 0.50 0.00 0.00 46.19 46.70 3h3r s LEU 481 CO 0.04 -0.30 0.22 -0.72 -1.32 0.00 0.00 176.35 174.26 3h3r s TYR 482 N 2.22 -0.21 0.04 5.38 -0.85 -0.49 -1.74 117.35 121.70 3h3r s TYR 482 Ca 0.04 0.51 -0.29 0.00 -0.52 0.00 0.00 57.07 56.81 3h3r s TYR 482 Cb -0.14 0.07 -0.04 0.00 0.38 0.00 0.00 41.96 42.22 3h3r s TYR 482 CO -0.08 -0.14 0.93 -1.17 -1.52 0.00 0.00 175.55 173.57 3h3r s LEU 483 N -0.09 4.42 -0.15 -3.49 0.20 0.10 -0.34 118.68 119.34 3h3r s LEU 483 Ca -0.02 1.65 0.02 0.00 0.69 0.00 0.00 54.13 56.47 3h3r s LEU 483 Cb -0.02 -3.51 0.01 0.00 -0.43 0.00 0.00 46.19 42.24 3h3r s LEU 483 CO 0.01 -0.15 -0.21 -0.55 -0.29 0.00 0.00 176.35 175.15 3h3r s SER 484 N 0.51 3.09 0.00 3.68 0.15 0.11 -1.64 113.70 119.61 3h3r s SER 484 Ca 0.48 -0.61 0.01 0.00 0.70 0.00 0.00 55.95 56.53 3h3r s SER 484 Cb -0.22 -1.44 -0.01 0.00 -1.71 0.00 0.00 66.02 62.65 3h3r s SER 484 CO 0.27 0.06 -0.04 0.54 1.20 0.00 0.00 173.24 175.27 3h3r s VAL 485 N 0.92 0.31 -0.13 4.45 0.11 -0.50 -1.57 120.40 123.99 3h3r s VAL 485 Ca -0.05 -0.31 0.00 0.00 -2.93 0.00 0.00 61.98 58.70 3h3r s VAL 485 Cb -0.15 -0.30 -0.01 0.00 -1.53 0.00 0.00 36.38 34.39 3h3r s VAL 485 CO -0.04 -0.00 -0.14 -0.51 -3.33 0.00 0.00 175.10 171.07 3h3r s ILE 486 N -0.31 2.92 0.03 7.04 2.07 -0.64 -1.12 121.20 131.20 3h3r s ILE 486 Ca -0.01 -0.71 0.00 0.00 -1.41 0.00 0.00 60.65 58.53 3h3r s ILE 486 Cb -0.03 -2.22 -0.03 0.00 0.13 0.00 0.00 42.46 40.32 3h3r s ILE 486 CO -0.00 0.53 -0.04 -0.13 -1.91 0.00 0.00 174.94 173.39 3h3r s ARG 487 N 0.39 0.43 -0.21 3.50 1.81 0.00 -4.87 118.95 119.99 3h3r s ARG 487 Ca -0.11 -0.79 -0.09 0.00 -1.72 0.00 0.00 55.73 53.02 3h3r s ARG 487 Cb -0.16 0.05 -0.04 0.00 -0.45 0.00 0.00 34.95 34.34 3h3r s ARG 487 CO 0.06 -0.04 0.11 0.21 -0.68 0.00 0.00 175.30 174.95 3h3r s LYS 488 N -2.06 3.98 -0.33 3.54 2.20 -1.26 -1.32 119.74 124.49 3h3r s LYS 488 Ca -0.09 -0.32 -0.13 0.00 -0.36 0.00 0.00 55.97 55.06 3h3r s LYS 488 Cb -0.06 -3.37 -0.02 0.00 -1.51 0.00 0.00 37.83 32.87 3h3r s LYS 488 CO -0.03 0.13 0.27 0.42 -0.36 0.00 0.00 175.35 175.78 3h3r s ILE 489 N 0.80 5.26 0.67 5.43 -1.09 0.27 -4.98 121.20 127.55 3h3r s ILE 489 Ca 0.05 -0.08 -0.17 0.00 -2.23 0.00 0.00 60.65 58.22 3h3r s ILE 489 Cb -0.13 -3.72 -0.01 0.00 -1.58 0.00 0.00 42.46 37.02 3h3r s ILE 489 CO 0.02 0.00 1.11 -0.81 -1.23 0.00 0.00 174.94 174.04 3h3r n PRO 490 N 5.18 0.82 -2.86 2.79 -0.04 -1.26 -1.66 135.00 137.96 3h3r n PRO 490 Ca -0.12 0.33 -0.40 0.00 -0.04 0.00 0.00 63.50 63.28 3h3r n PRO 490 Cb 0.50 -2.35 -0.05 0.00 -0.04 0.00 0.00 33.50 31.56 3h3r n PRO 490 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h3r s ALA 491 N -1.59 3.36 -0.96 0.55 0.00 -1.26 -4.77 121.76 117.09 3h3r s ALA 491 Ca 0.78 0.46 0.11 0.00 0.00 0.00 0.00 51.96 53.31 3h3r s ALA 491 Cb -0.37 -3.10 0.31 0.00 0.00 0.00 0.00 23.12 19.96 3h3r s ALA 491 CO 0.45 0.16 1.26 1.28 0.00 0.00 0.00 175.76 178.91 3h3r n LEU 492 N 2.05 2.94 -4.53 0.00 4.77 -1.26 -4.93 117.00 116.03 3h3r n LEU 492 Ca -0.02 -1.98 -0.28 0.00 -0.03 0.00 0.00 56.01 53.70 3h3r n LEU 492 Cb 0.49 -0.23 -0.10 0.00 -2.33 0.00 0.00 43.42 41.24 3h3r n LEU 492 CO 0.48 0.73 -0.45 0.42 -1.33 0.00 0.00 177.39 177.25 3h3r s THR 493 N -1.00 3.01 0.30 -5.08 -4.23 -1.26 -5.06 115.64 102.32 3h3r s THR 493 Ca 0.24 -1.65 0.08 0.00 -1.18 0.00 0.00 61.69 59.18 3h3r s THR 493 Cb 0.12 -2.46 0.03 0.00 1.34 0.00 0.00 72.50 71.53 3h3r s THR 493 CO 0.16 -0.05 1.69 1.05 -0.54 0.00 0.00 174.62 176.93 3h3r h GLU 494 N 3.18 0.14 0.00 3.99 4.11 -2.03 -3.31 114.58 120.66 3h3r h GLU 494 Ca -0.47 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 58.88 3h3r h GLU 494 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 3h3r h GLU 494 CO 0.51 0.58 -1.07 0.09 0.07 0.00 0.00 179.01 179.20 3h3r n ASN 495 N -3.98 2.44 -4.76 3.06 5.03 -1.26 -5.00 115.26 110.79 3h3r n ASN 495 Ca -0.02 -0.19 -0.39 0.00 0.87 0.00 0.00 54.58 54.85 3h3r n ASN 495 Cb 0.51 1.25 -0.04 0.00 -1.02 0.00 0.00 39.78 40.48 3h3r n ASN 495 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 3h3r s ASP 496 N -2.55 7.05 0.53 6.41 1.01 -1.25 -4.99 116.67 122.88 3h3r s ASP 496 Ca -0.01 2.25 -0.19 0.00 0.71 0.00 0.00 52.55 55.31 3h3r s ASP 496 Cb 0.05 -2.62 -0.06 0.00 1.01 0.00 0.00 42.92 41.30 3h3r s ASP 496 CO 0.31 -0.30 1.07 -2.16 0.21 0.00 0.00 175.17 174.31 3h3r s PRO 497 N -1.78 3.53 0.63 8.23 0.04 -1.26 -4.76 135.00 139.63 3h3r s PRO 497 Ca 0.49 1.41 -0.15 0.00 0.04 0.00 0.00 61.00 62.79 3h3r s PRO 497 Cb -0.30 -2.05 -0.02 0.00 0.04 0.00 0.00 34.50 32.17 3h3r s PRO 497 CO 0.39 -0.66 1.07 -1.21 0.04 0.00 0.00 177.00 176.63 3h3r s GLU 498 N -3.43 3.10 -0.12 4.56 2.02 -1.26 -4.60 118.70 118.96 3h3r s GLU 498 Ca 0.68 1.23 0.01 0.00 0.02 0.00 0.00 54.97 56.92 3h3r s GLU 498 Cb -0.19 -2.00 -0.01 0.00 0.10 0.00 0.00 34.13 32.03 3h3r s GLU 498 CO 0.26 -0.99 -0.17 0.99 0.02 0.00 0.00 175.26 175.37 3h3r s THR 499 N -2.49 2.70 -0.07 3.63 2.01 -0.67 -4.29 115.64 116.46 3h3r s THR 499 Ca 0.64 -0.79 -0.04 0.00 0.31 0.00 0.00 61.69 61.81 3h3r s THR 499 Cb -0.17 -2.10 -0.04 0.00 0.01 0.00 0.00 72.50 70.20 3h3r s THR 499 CO 0.41 0.54 0.10 0.26 -0.69 0.00 0.00 174.62 175.24 3h3r s TRP 500 N 0.33 3.43 -0.02 4.92 0.52 -0.29 0.96 118.94 128.79 3h3r s TRP 500 Ca -0.14 0.36 -0.01 0.00 0.02 0.00 0.00 56.10 56.34 3h3r s TRP 500 Cb -0.17 -1.85 0.01 0.00 -1.15 0.00 0.00 33.47 30.32 3h3r s TRP 500 CO 0.07 0.63 0.04 -1.50 0.02 0.00 0.00 176.95 176.20 3h3r s ILE 501 N -1.07 -0.02 -0.16 2.03 2.07 -0.43 0.23 121.20 123.84 3h3r s ILE 501 Ca 0.18 0.09 -0.01 0.00 -1.41 0.00 0.00 60.65 59.50 3h3r s ILE 501 Cb -0.12 -0.08 -0.01 0.00 0.13 0.00 0.00 42.46 42.38 3h3r s ILE 501 CO 0.08 0.04 -0.12 -0.69 -1.91 0.00 0.00 174.94 172.34 3h3r s VAL 502 N 0.46 3.00 -0.15 4.00 1.01 0.25 -0.82 120.40 128.15 3h3r s VAL 502 Ca -0.04 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.27 3h3r s VAL 502 Cb -0.05 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 3h3r s VAL 502 CO -0.01 0.50 -0.09 0.00 0.00 0.00 0.00 175.10 175.49 3h3r s ASN 504 N 0.58 3.56 -0.07 0.00 0.02 0.52 -1.41 114.94 118.15 3h3r s ASN 504 Ca -0.06 -0.83 -0.06 0.00 -1.02 0.00 0.00 52.86 50.89 3h3r s ASN 504 Cb -0.15 -1.52 0.02 0.00 0.02 0.00 0.00 41.25 39.62 3h3r s ASN 504 CO 0.03 -0.05 0.19 0.72 0.02 0.00 0.00 177.10 178.01 3h3r s PHE 505 N 1.25 -0.21 0.29 2.20 -0.12 -0.65 -0.29 117.98 120.44 3h3r s PHE 505 Ca 0.01 0.53 -0.30 0.00 -0.05 0.00 0.00 56.93 57.13 3h3r s PHE 505 Cb -0.15 0.05 -0.11 0.00 -0.63 0.00 0.00 43.02 42.18 3h3r s PHE 505 CO -0.10 -0.12 1.54 -1.12 -0.05 0.00 0.00 175.22 175.37 3h3r s SER 506 N 0.33 6.45 0.27 1.98 0.01 -0.55 -0.72 113.70 121.47 3h3r s SER 506 Ca -0.02 2.88 0.03 0.00 1.31 0.00 0.00 55.95 60.15 3h3r s SER 506 Cb -0.03 -2.63 -0.06 0.00 0.21 0.00 0.00 66.02 63.51 3h3r s SER 506 CO -0.01 -0.85 0.06 0.68 0.41 0.00 0.00 173.24 173.52 3h3r s VAL 507 N -0.08 0.90 0.24 3.43 -7.23 -0.71 -4.82 120.40 112.12 3h3r s VAL 507 Ca 0.61 -2.01 -0.01 0.00 -1.81 0.00 0.00 61.98 58.76 3h3r s VAL 507 Cb -0.46 -2.61 -0.04 0.00 0.56 0.00 0.00 36.38 33.83 3h3r s VAL 507 CO 0.48 -0.09 0.44 -1.81 -0.31 0.00 0.00 175.10 173.80 3h3r s ASP 508 N -3.37 6.39 -0.23 4.85 1.01 -1.26 -4.60 116.67 119.46 3h3r s ASP 508 Ca 0.35 0.46 -0.14 0.00 0.71 0.00 0.00 52.55 53.93 3h3r s ASP 508 Cb 0.08 -2.03 0.07 0.00 1.01 0.00 0.00 42.92 42.04 3h3r s ASP 508 CO 0.13 -0.10 0.56 -2.28 0.21 0.00 0.00 175.17 173.69 3h3r s HIS 509 N -1.96 -0.82 0.57 4.23 2.46 -1.26 -5.04 115.29 113.47 3h3r s HIS 509 Ca 0.40 1.72 0.26 0.00 0.47 0.00 0.00 55.06 57.90 3h3r s HIS 509 Cb -0.11 0.43 1.64 0.00 -0.13 0.00 0.00 32.58 34.42 3h3r s HIS 509 CO 0.30 -0.42 2.19 -0.44 -2.47 0.00 0.00 174.74 173.89 3h3r h ASP 510 N 6.81 0.00 1.30 9.88 3.32 -2.01 -0.97 116.42 134.76 3h3r h ASP 510 Ca -0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.73 3h3r h ASP 510 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 3h3r h ASP 510 CO 0.21 0.00 0.00 0.28 -1.72 0.00 0.00 179.24 178.01 3h3r h SER 511 N 0.00 0.00 -2.09 6.45 0.02 -1.99 -3.35 113.55 112.59 3h3r h SER 511 Ca 0.03 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.42 3h3r h SER 511 Cb 0.16 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.29 3h3r h SER 511 CO -0.00 0.00 -0.91 0.00 -1.14 0.00 0.00 176.83 174.78 3h3r n ALA 512 N -1.86 3.12 -1.16 3.77 0.00 -0.37 -5.11 120.51 118.90 3h3r n ALA 512 Ca 0.04 -3.97 -0.29 0.00 0.00 0.00 0.00 53.44 49.23 3h3r n ALA 512 Cb 0.38 -0.85 0.19 0.00 0.00 0.00 0.00 19.45 19.16 3h3r n ALA 512 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3h3r s PRO 513 N -2.01 0.22 0.58 0.00 0.04 -1.24 -4.55 135.00 128.04 3h3r s PRO 513 Ca 0.39 0.45 -0.21 0.00 0.04 0.00 0.00 61.00 61.67 3h3r s PRO 513 Cb 0.20 -1.72 -0.04 0.00 0.04 0.00 0.00 34.50 32.99 3h3r s PRO 513 CO -0.08 -2.86 1.35 1.28 0.04 0.00 0.00 177.00 176.73 3h3r n LEU 514 N -4.25 5.74 -4.33 -3.56 4.77 -1.26 -5.02 117.00 109.08 3h3r n LEU 514 Ca 0.05 0.94 -0.20 0.00 -0.03 0.00 0.00 56.01 56.78 3h3r n LEU 514 Cb 0.58 -1.58 -0.09 0.00 -2.33 0.00 0.00 43.42 40.00 3h3r n LEU 514 CO 0.57 -0.67 -0.17 0.54 -1.33 0.00 0.00 177.39 176.33 3h3r s ASN 515 N -1.04 1.67 0.00 -1.43 2.20 -1.26 -5.06 114.94 110.02 3h3r s ASN 515 Ca 0.75 -1.64 0.26 0.00 -0.94 0.00 0.00 52.86 51.28 3h3r s ASN 515 Cb -0.40 0.48 0.67 0.00 -2.00 0.00 0.00 41.25 40.00 3h3r s ASN 515 CO 0.47 -0.96 1.53 -0.46 -2.94 0.00 0.00 177.10 174.73 3h3r n ASN 516 N -1.18 2.18 -0.04 3.54 6.94 -1.26 -4.08 115.26 121.36 3h3r n ASN 516 Ca 0.03 -1.73 -0.21 0.00 -0.02 0.00 0.00 54.58 52.64 3h3r n ASN 516 Cb 0.64 -0.03 -0.13 0.00 -2.36 0.00 0.00 39.78 37.90 3h3r n ASN 516 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3h3r n ARG 517 N 0.70 0.71 -4.33 -3.83 1.74 -1.26 -5.01 116.66 105.38 3h3r n ARG 517 Ca 0.17 0.27 -0.28 0.00 -0.77 0.00 0.00 57.85 57.24 3h3r n ARG 517 Cb 0.46 -1.66 -0.11 0.00 -1.02 0.00 0.00 32.46 30.13 3h3r n ARG 517 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h3r s VAL 519 N -1.52 5.11 -0.48 0.00 1.01 -0.08 -4.63 120.40 119.81 3h3r s VAL 519 Ca 0.22 1.00 -0.28 0.00 0.00 0.00 0.00 61.98 62.91 3h3r s VAL 519 Cb -0.09 -3.83 0.03 0.00 0.00 0.00 0.00 36.38 32.49 3h3r s VAL 519 CO 0.12 0.38 1.11 -0.60 0.00 0.00 0.00 175.10 176.11 3h3r s ARG 520 N 0.23 3.69 0.62 2.72 6.06 -1.26 -0.92 118.95 130.09 3h3r s ARG 520 Ca 0.27 0.50 -0.10 0.00 -2.50 0.00 0.00 55.73 53.90 3h3r s ARG 520 Cb -0.16 -3.91 -0.02 0.00 0.06 0.00 0.00 34.95 30.92 3h3r s ARG 520 CO 0.12 -1.36 0.99 0.00 -2.50 0.00 0.00 175.30 172.55 3h3r s ALA 521 N 4.36 3.12 -0.03 6.12 0.00 -0.46 -4.56 121.76 130.31 3h3r s ALA 521 Ca 0.46 -0.30 0.06 0.00 0.00 0.00 0.00 51.96 52.18 3h3r s ALA 521 Cb -0.07 -2.93 -0.01 0.00 0.00 0.00 0.00 23.12 20.10 3h3r s ALA 521 CO 0.31 -0.77 -0.21 0.15 0.00 0.00 0.00 175.76 175.25 3h3r s LYS 522 N -5.13 1.83 0.08 0.00 -0.14 -0.22 -4.62 119.74 111.53 3h3r s LYS 522 Ca 0.54 -0.74 0.03 0.00 -1.36 0.00 0.00 55.97 54.45 3h3r s LYS 522 Cb -0.11 -1.69 -0.03 0.00 -1.68 0.00 0.00 37.83 34.32 3h3r s LYS 522 CO 0.51 0.40 -0.10 0.96 -0.76 0.00 0.00 175.35 176.36 3h3r s ILE 523 N -0.34 0.83 -0.28 2.17 -4.36 -1.26 -0.54 121.20 117.42 3h3r s ILE 523 Ca 0.04 -1.48 -0.03 0.00 -0.26 0.00 0.00 60.65 58.93 3h3r s ILE 523 Cb -0.10 -1.15 0.11 0.00 1.25 0.00 0.00 42.46 42.57 3h3r s ILE 523 CO 0.00 -0.50 0.20 0.21 0.24 0.00 0.00 174.94 175.09 3h3r s ASN 524 N -2.18 2.68 0.07 4.36 2.47 -0.48 -1.49 114.94 120.37 3h3r s ASN 524 Ca 0.01 -1.01 0.07 0.00 0.42 0.00 0.00 52.86 52.35 3h3r s ASN 524 Cb -0.05 0.02 -0.03 0.00 -1.45 0.00 0.00 41.25 39.74 3h3r s ASN 524 CO -0.00 -0.41 -0.19 -0.69 -3.72 0.00 0.00 177.10 172.09 3h3r s VAL 525 N 2.21 1.53 -0.06 -5.21 1.01 0.60 -1.47 120.40 119.01 3h3r s VAL 525 Ca 0.09 -1.33 -0.05 0.00 0.00 0.00 0.00 61.98 60.69 3h3r s VAL 525 Cb -0.15 -1.38 0.02 0.00 0.00 0.00 0.00 36.38 34.87 3h3r s VAL 525 CO -0.33 0.00 0.15 0.00 0.00 0.00 0.00 175.10 174.93 3h3r s ALA 526 N -1.03 -0.36 -0.16 5.51 0.00 -0.49 -0.35 121.76 124.88 3h3r s ALA 526 Ca 0.05 0.48 -0.02 0.00 0.00 0.00 0.00 51.96 52.47 3h3r s ALA 526 Cb -0.09 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 3h3r s ALA 526 CO 0.03 -0.09 -0.08 1.41 0.00 0.00 0.00 175.76 177.03 3h3r s MET 527 N 0.28 3.47 -0.13 0.00 1.75 0.18 -0.88 119.30 123.97 3h3r s MET 527 Ca -0.02 -0.62 0.00 0.00 -1.25 0.00 0.00 55.69 53.81 3h3r s MET 527 Cb -0.03 -2.82 0.02 0.00 2.84 0.00 0.00 34.83 34.84 3h3r s MET 527 CO -0.01 0.11 -0.12 0.42 -0.65 0.00 0.00 175.02 174.77 3h3r s ILE 528 N 0.67 1.37 -0.02 10.11 1.01 -0.25 -0.58 121.20 133.51 3h3r s ILE 528 Ca -0.04 -0.51 0.04 0.00 0.00 0.00 0.00 60.65 60.14 3h3r s ILE 528 Cb -0.15 -1.31 -0.01 0.00 0.01 0.00 0.00 42.46 41.01 3h3r s ILE 528 CO 0.02 0.42 -0.13 0.00 0.00 0.00 0.00 174.94 175.25 3h3r s GLN 530 N -0.15 1.00 -0.18 0.00 -0.21 -0.71 -1.14 119.66 118.28 3h3r s GLN 530 Ca 0.02 -0.41 -0.17 0.00 0.02 0.00 0.00 55.36 54.82 3h3r s GLN 530 Cb -0.07 -0.95 -0.04 0.00 1.00 0.00 0.00 33.01 32.95 3h3r s GLN 530 CO 0.00 0.22 0.44 0.99 -2.12 0.00 0.00 175.29 174.82 3h3r s THR 531 N -0.16 5.18 -0.21 -0.19 2.01 -1.26 -0.48 115.64 120.53 3h3r s THR 531 Ca 0.02 0.82 -0.10 0.00 0.31 0.00 0.00 61.69 62.74 3h3r s THR 531 Cb -0.06 -3.77 -0.05 0.00 0.01 0.00 0.00 72.50 68.63 3h3r s THR 531 CO -0.00 0.26 0.15 -0.76 -0.69 0.00 0.00 174.62 173.57 3h3r s LEU 532 N 1.18 4.18 -0.08 4.42 1.43 0.41 -4.71 118.68 125.52 3h3r s LEU 532 Ca 0.22 0.20 0.02 0.00 -1.03 0.00 0.00 54.13 53.55 3h3r s LEU 532 Cb -0.15 -2.11 -0.02 0.00 0.03 0.00 0.00 46.19 43.94 3h3r s LEU 532 CO 0.09 0.14 -0.14 -0.69 0.23 0.00 0.00 176.35 175.97 3h3r s VAL 533 N 0.58 3.01 -0.26 -1.59 1.01 -1.26 -1.79 120.40 120.10 3h3r s VAL 533 Ca 0.08 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.36 3h3r s VAL 533 Cb -0.12 -2.20 0.06 0.00 0.00 0.00 0.00 36.38 34.12 3h3r s VAL 533 CO 0.00 0.57 -0.07 -0.94 0.00 0.00 0.00 175.10 174.66 3h3r s SER 534 N -0.35 4.25 0.42 3.32 1.04 0.09 -5.03 113.70 117.44 3h3r s SER 534 Ca 0.03 -1.39 -0.21 0.00 0.48 0.00 0.00 55.95 54.86 3h3r s SER 534 Cb -0.12 -1.41 -0.15 0.00 0.10 0.00 0.00 66.02 64.44 3h3r s SER 534 CO 0.02 -0.23 0.16 -2.65 0.98 0.00 0.00 173.24 171.52 3h3r n PRO 535 N 4.51 0.11 0.00 4.02 -0.02 -1.26 -4.70 135.00 137.65 3h3r n PRO 535 Ca -0.11 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 3h3r n PRO 535 Cb 0.43 -1.11 0.00 0.00 -0.02 0.00 0.00 33.50 32.80 3h3r n PRO 535 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3h3r n PRO 536 N 1.18 3.30 -1.68 0.52 -0.04 -1.26 -5.03 135.00 131.99 3h3r n PRO 536 Ca 0.11 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 63.12 3h3r n PRO 536 Cb 0.41 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.83 3h3r n PRO 536 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3h3r n GLU 537 N 0.00 2.48 0.00 0.54 0.00 -1.26 -4.85 120.64 117.55 3h3r n GLU 537 Ca 0.00 0.90 0.00 0.00 0.00 0.00 0.00 57.16 58.06 3h3r n GLU 537 Cb 0.00 -2.75 0.00 0.00 0.00 0.00 0.00 31.44 28.69 3h3r n GLU 537 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3h3r n GLY 538 N 4.04 3.31 2.00 -1.84 0.00 -1.26 -2.23 105.19 109.21 3h3r n GLY 538 Ca 0.19 -0.14 -0.06 0.00 0.00 0.00 0.00 46.02 46.00 3h3r n GLY 538 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3h3r n ASN 539 N 3.59 4.78 -4.84 1.61 3.02 -1.26 -4.97 115.26 117.19 3h3r n ASN 539 Ca 0.00 -3.25 -0.32 0.00 -0.03 0.00 0.00 54.58 50.98 3h3r n ASN 539 Cb 0.00 -0.75 -0.01 0.00 -0.61 0.00 0.00 39.78 38.41 3h3r n ASN 539 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3h3r s GLN 540 N -3.02 3.67 0.39 3.52 -0.21 -0.95 -5.05 119.66 118.02 3h3r s GLN 540 Ca 0.55 0.97 -0.02 0.00 0.02 0.00 0.00 55.36 56.89 3h3r s GLN 540 Cb 0.44 -2.09 -0.04 0.00 1.00 0.00 0.00 33.01 32.33 3h3r s GLN 540 CO 0.13 -0.51 0.63 -1.21 -2.12 0.00 0.00 175.29 172.22 3h3r s GLU 541 N -4.34 3.52 0.22 2.91 2.02 -1.26 -4.70 118.70 117.06 3h3r s GLU 541 Ca 0.59 -0.12 -0.32 0.00 0.02 0.00 0.00 54.97 55.14 3h3r s GLU 541 Cb -0.12 -2.56 -0.13 0.00 0.10 0.00 0.00 34.13 31.42 3h3r s GLU 541 CO 0.38 0.03 1.49 -0.89 0.02 0.00 0.00 175.26 176.29 3h3r n ILE 542 N -1.89 0.64 -4.69 -1.63 2.08 -1.26 -4.91 119.36 107.70 3h3r n ILE 542 Ca -0.03 -0.16 -0.31 0.00 0.56 0.00 0.00 62.75 62.81 3h3r n ILE 542 Cb 0.56 -1.56 -0.07 0.00 -0.75 0.00 0.00 39.64 37.82 3h3r n ILE 542 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 3h3r n SER 543 N 2.58 2.68 0.06 4.38 3.41 -1.26 -5.01 113.62 120.46 3h3r n SER 543 Ca 0.13 -3.29 0.09 0.00 -0.26 0.00 0.00 58.87 55.54 3h3r n SER 543 Cb 0.31 0.62 0.37 0.00 -0.26 0.00 0.00 64.21 65.25 3h3r n SER 543 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3h3r n ARG 544 N -1.18 0.08 0.02 4.33 1.74 -1.26 -1.03 116.66 119.35 3h3r n ARG 544 Ca -0.16 0.34 0.13 0.00 -0.77 0.00 0.00 57.85 57.39 3h3r n ARG 544 Cb 0.66 -1.66 0.55 0.00 -1.02 0.00 0.00 32.46 30.99 3h3r n ARG 544 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3h3r n ASP 545 N -1.81 0.16 -1.21 0.55 8.00 -1.26 -3.25 116.55 117.73 3h3r n ASP 545 Ca 0.03 0.52 0.11 0.00 0.71 0.00 0.00 54.79 56.15 3h3r n ASP 545 Cb 0.18 -0.56 0.27 0.00 -0.02 0.00 0.00 41.12 40.99 3h3r n ASP 545 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3h3r n ASN 546 N -1.65 3.67 -4.23 -2.24 3.02 -0.20 -4.97 115.26 108.65 3h3r n ASN 546 Ca 0.06 -1.99 -0.22 0.00 -0.03 0.00 0.00 54.58 52.41 3h3r n ASN 546 Cb 0.34 -0.37 -0.13 0.00 -0.61 0.00 0.00 39.78 39.01 3h3r n ASN 546 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 3h3r s ILE 547 N -1.17 1.47 -0.02 2.41 -4.36 -1.20 -0.73 121.20 117.59 3h3r s ILE 547 Ca 0.43 -1.39 -0.01 0.00 -0.26 0.00 0.00 60.65 59.42 3h3r s ILE 547 Cb 0.23 -1.35 0.02 0.00 1.25 0.00 0.00 42.46 42.61 3h3r s ILE 547 CO 0.31 -0.08 0.04 -0.22 0.24 0.00 0.00 174.94 175.23 3h3r s LEU 548 N -1.72 1.40 -0.23 0.37 2.96 -0.74 -0.99 118.68 119.73 3h3r s LEU 548 Ca 0.03 0.08 -0.08 0.00 -0.22 0.00 0.00 54.13 53.94 3h3r s LEU 548 Cb -0.10 0.06 -0.04 0.00 0.50 0.00 0.00 46.19 46.61 3h3r s LEU 548 CO 0.03 -0.08 0.10 0.00 -1.32 0.00 0.00 176.35 175.08 3h3r s LYS 550 N 1.07 4.11 -0.09 0.00 1.02 0.36 -0.50 119.74 125.72 3h3r s LYS 550 Ca 0.05 0.47 0.02 0.00 0.02 0.00 0.00 55.97 56.53 3h3r s LYS 550 Cb -0.14 -3.64 -0.02 0.00 -0.52 0.00 0.00 37.83 33.51 3h3r s LYS 550 CO 0.04 -0.37 -0.13 0.42 -0.92 0.00 0.00 175.35 174.39 3h3r s ILE 551 N 2.36 3.08 -0.16 2.17 1.01 0.61 -1.73 121.20 128.53 3h3r s ILE 551 Ca 0.24 -0.69 0.02 0.00 0.00 0.00 0.00 60.65 60.23 3h3r s ILE 551 Cb -0.16 -2.25 0.01 0.00 0.01 0.00 0.00 42.46 40.08 3h3r s ILE 551 CO 0.09 0.56 -0.20 -0.89 0.00 0.00 0.00 174.94 174.49 3h3r s THR 552 N -0.22 2.13 -0.11 2.92 2.01 -0.22 -1.09 115.64 121.07 3h3r s THR 552 Ca 0.01 -0.94 0.04 0.00 0.31 0.00 0.00 61.69 61.10 3h3r s THR 552 Cb -0.13 -1.87 0.00 0.00 0.01 0.00 0.00 72.50 70.51 3h3r s THR 552 CO 0.03 0.54 -0.23 -0.47 -0.69 0.00 0.00 174.62 173.80 3h3r s TYR 553 N 0.98 2.58 -0.04 4.92 5.04 0.26 -1.09 117.35 130.00 3h3r s TYR 553 Ca -0.03 -1.08 0.03 0.00 -2.44 0.00 0.00 57.07 53.56 3h3r s TYR 553 Cb -0.15 -1.73 0.00 0.00 0.35 0.00 0.00 41.96 40.44 3h3r s TYR 553 CO -0.05 -0.44 -0.13 0.14 -1.34 0.00 0.00 175.55 173.73 3h3r s VAL 554 N 0.41 1.11 -0.06 3.14 -7.23 -0.06 -0.25 120.40 117.46 3h3r s VAL 554 Ca -0.17 -0.53 -0.00 0.00 -1.81 0.00 0.00 61.98 59.46 3h3r s VAL 554 Cb -0.18 -0.98 0.02 0.00 0.56 0.00 0.00 36.38 35.81 3h3r s VAL 554 CO 0.07 0.33 -0.03 0.00 -0.31 0.00 0.00 175.10 175.16 3h3r s ALA 555 N 0.17 0.78 -0.25 1.32 0.00 -0.07 -1.39 121.76 122.33 3h3r s ALA 555 Ca -0.05 -0.16 0.01 0.00 0.00 0.00 0.00 51.96 51.77 3h3r s ALA 555 Cb -0.11 -0.62 0.06 0.00 0.00 0.00 0.00 23.12 22.46 3h3r s ALA 555 CO 0.02 -0.24 -0.04 -0.80 0.00 0.00 0.00 175.76 174.69 3h3r s ASN 556 N 1.43 3.95 -0.04 0.00 0.01 -0.55 -0.85 114.94 118.89 3h3r s ASN 556 Ca -0.03 -1.27 0.04 0.00 -0.71 0.00 0.00 52.86 50.89 3h3r s ASN 556 Cb -0.13 -1.21 -0.00 0.00 0.41 0.00 0.00 41.25 40.31 3h3r s ASN 556 CO -0.03 -0.25 -0.15 -0.69 -1.51 0.00 0.00 177.10 174.47 3h3r s VAL 557 N 1.36 1.31 -0.35 1.60 1.01 -1.26 -1.39 120.40 122.68 3h3r s VAL 557 Ca -0.04 -0.64 -0.05 0.00 0.00 0.00 0.00 61.98 61.25 3h3r s VAL 557 Cb -0.19 -1.14 0.06 0.00 0.00 0.00 0.00 36.38 35.12 3h3r s VAL 557 CO -0.07 0.38 0.12 0.21 0.00 0.00 0.00 175.10 175.74 3h3r s ASN 558 N 0.14 5.22 0.00 3.32 3.84 0.30 -4.73 114.94 123.04 3h3r s ASN 558 Ca -0.05 -1.43 0.24 0.00 0.21 0.00 0.00 52.86 51.83 3h3r s ASN 558 Cb -0.12 -1.83 1.21 0.00 -0.55 0.00 0.00 41.25 39.97 3h3r s ASN 558 CO 0.02 -0.38 1.81 -0.81 -2.79 0.00 0.00 177.10 174.95 3h3r n PRO 559 N 4.72 0.32 -0.75 0.43 -0.04 -1.26 -1.06 135.00 137.36 3h3r n PRO 559 Ca -0.10 0.06 0.10 0.00 -0.04 0.00 0.00 63.50 63.52 3h3r n PRO 559 Cb 0.43 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.37 3h3r n PRO 559 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h3r n GLY 560 N 0.80 -1.60 7.00 0.55 0.00 -1.26 -4.24 105.19 106.43 3h3r n GLY 560 Ca 0.11 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.79 3h3r n GLY 560 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h3r n GLY 561 N -2.69 1.19 2.92 -0.02 0.00 -1.26 -4.70 105.19 100.63 3h3r n GLY 561 Ca 0.00 -0.63 -0.12 0.00 0.00 0.00 0.00 46.02 45.28 3h3r n GLY 561 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3h3r s TRP 562 N 0.00 0.01 0.10 1.61 -0.00 -1.26 -5.10 118.94 114.30 3h3r s TRP 562 Ca 0.00 -0.01 -0.18 0.00 -0.00 0.00 0.00 56.10 55.91 3h3r s TRP 562 Cb 0.00 -0.02 0.04 0.00 -0.00 0.00 0.00 33.47 33.49 3h3r s TRP 562 CO 0.00 -0.05 0.44 0.00 -0.00 0.00 0.00 176.95 177.34 3h3r s ALA 563 N -0.23 -1.07 0.35 5.86 0.00 -1.26 -5.05 121.76 120.35 3h3r s ALA 563 Ca -0.03 0.17 -0.29 0.00 0.00 0.00 0.00 51.96 51.81 3h3r s ALA 563 Cb -0.02 0.61 -0.11 0.00 0.00 0.00 0.00 23.12 23.60 3h3r s ALA 563 CO -0.00 -0.60 1.43 -2.14 0.00 0.00 0.00 175.76 174.44 3h3r s PRO 564 N -3.37 4.21 0.11 0.00 0.02 -1.26 -4.90 135.00 129.81 3h3r s PRO 564 Ca 0.00 2.43 -0.19 0.00 0.02 0.00 0.00 61.00 63.26 3h3r s PRO 564 Cb 0.01 -3.02 -0.06 0.00 0.02 0.00 0.00 34.50 31.44 3h3r s PRO 564 CO -0.09 -0.41 1.70 0.00 -0.33 0.00 0.00 177.00 177.87 3h3r h ALA 565 N 3.41 0.30 -0.11 -1.55 0.00 -1.99 -1.36 119.26 117.96 3h3r h ALA 565 Ca -0.50 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.32 3h3r h ALA 565 Cb 1.23 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3h3r h ALA 565 CO 0.67 -0.16 -0.02 0.66 0.00 0.00 0.00 179.25 180.40 3h3r h SER 566 N 0.26 0.14 -0.05 0.00 4.64 -1.99 -1.10 113.55 115.46 3h3r h SER 566 Ca 0.08 -0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.27 3h3r h SER 566 Cb 0.08 -0.04 0.01 0.00 -0.31 0.00 0.00 62.40 62.14 3h3r h SER 566 CO -0.01 0.19 -0.43 0.58 -0.87 0.00 0.00 176.83 176.28 3h3r h VAL 567 N 0.16 1.42 -0.77 0.95 2.07 -1.79 -2.01 116.25 116.29 3h3r h VAL 567 Ca 0.04 -1.87 -0.01 0.00 0.82 0.00 0.00 66.70 65.68 3h3r h VAL 567 Cb 0.14 2.41 -0.04 0.00 -1.52 0.00 0.00 31.29 32.28 3h3r h VAL 567 CO 0.00 0.54 0.43 -0.07 0.02 0.00 0.00 177.57 178.49 3h3r h LEU 568 N -0.11 0.96 -0.88 2.57 3.38 -0.85 -0.71 115.31 119.68 3h3r h LEU 568 Ca -0.04 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 3h3r h LEU 568 Cb 1.11 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 3h3r h LEU 568 CO 0.09 0.77 -0.23 0.03 0.09 0.00 0.00 178.44 179.20 3h3r h ARG 569 N 1.07 0.57 -0.17 1.13 3.08 -1.22 -1.86 114.38 116.98 3h3r h ARG 569 Ca 0.27 -0.21 -0.17 0.00 0.07 0.00 0.00 59.98 59.94 3h3r h ARG 569 Cb 0.02 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 3h3r h ARG 569 CO -0.04 0.76 -0.60 0.00 -1.07 0.00 0.00 179.97 179.02 3h3r h ALA 570 N 1.25 0.64 -0.30 0.04 0.00 -1.07 -2.60 119.26 117.23 3h3r h ALA 570 Ca 0.08 -0.54 -0.12 0.00 0.00 0.00 0.00 54.91 54.33 3h3r h ALA 570 Cb 0.67 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3h3r h ALA 570 CO 0.05 0.70 -0.31 -0.39 0.00 0.00 0.00 179.25 179.30 3h3r h VAL 571 N 0.42 1.28 -0.54 0.00 -1.51 -0.86 -2.04 116.25 113.01 3h3r h VAL 571 Ca -0.00 -1.42 -0.00 0.00 -1.23 0.00 0.00 66.70 64.04 3h3r h VAL 571 Cb 1.16 1.39 -0.03 0.00 -2.13 0.00 0.00 31.29 31.68 3h3r h VAL 571 CO 0.11 0.46 0.32 0.00 -1.23 0.00 0.00 177.57 177.23 3h3r h ALA 572 N 1.13 0.68 0.00 5.19 0.00 -1.37 0.73 119.26 125.62 3h3r h ALA 572 Ca 0.06 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3h3r h ALA 572 Cb 0.80 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3h3r h ALA 572 CO 0.07 0.17 -0.30 0.87 0.00 0.00 0.00 179.25 180.06 3h3r h LYS 573 N 0.72 0.00 0.00 0.00 1.57 -1.16 -2.73 116.57 114.97 3h3r h LYS 573 Ca 0.19 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.94 3h3r h LYS 573 Cb -0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 3h3r h LYS 573 CO -0.04 0.30 -0.19 -0.09 -0.57 0.00 0.00 179.45 178.87 3h3r h ARG 574 N 0.00 0.00 0.05 3.15 2.43 -1.14 -3.39 114.38 115.48 3h3r h ARG 574 Ca -0.00 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 58.91 3h3r h ARG 574 Cb 0.55 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 3h3r h ARG 574 CO 0.04 0.97 -1.30 0.93 -1.51 0.00 0.00 179.97 179.09 3h3r h GLU 575 N -1.00 0.11 -0.10 0.20 4.39 -0.84 -3.19 114.58 114.14 3h3r h GLU 575 Ca -0.05 -0.19 -0.06 0.00 0.34 0.00 0.00 59.36 59.39 3h3r h GLU 575 Cb 1.01 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 3h3r h GLU 575 CO -0.03 0.98 -0.18 1.88 -1.16 0.00 0.00 179.01 180.50 3h3r h TYR 576 N 0.03 0.38 -0.50 4.33 0.05 -1.69 -1.28 116.97 118.30 3h3r h TYR 576 Ca -0.14 -0.14 -0.08 0.00 0.05 0.00 0.00 58.73 58.43 3h3r h TYR 576 Cb 1.91 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 39.56 3h3r h TYR 576 CO 0.03 0.79 -0.00 -1.35 -1.05 0.00 0.00 178.16 176.57 3h3r h PRO 577 N -0.13 0.84 -0.61 4.88 0.11 -1.76 -1.35 132.00 133.98 3h3r h PRO 577 Ca 0.01 -0.23 -0.05 0.00 0.11 0.00 0.00 66.00 65.83 3h3r h PRO 577 Cb 0.76 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.75 3h3r h PRO 577 CO 0.04 0.84 0.18 -0.22 -0.21 0.00 0.00 178.00 178.64 3h3r h LYS 578 N 0.78 0.95 -0.33 1.05 3.64 -1.55 -1.66 116.57 119.45 3h3r h LYS 578 Ca 0.15 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3h3r h LYS 578 Cb 0.47 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 3h3r h LYS 578 CO 0.02 0.85 0.22 0.35 -2.27 0.00 0.00 179.45 178.62 3h3r h PHE 579 N 0.87 0.41 -0.27 1.91 3.57 -1.05 -2.01 116.94 120.38 3h3r h PHE 579 Ca 0.20 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.57 3h3r h PHE 579 Cb 0.30 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 3h3r h PHE 579 CO 0.02 0.26 -0.38 -0.07 -2.23 0.00 0.00 178.31 175.91 3h3r h LEU 580 N 0.44 0.65 -0.21 0.59 3.38 -0.84 0.22 115.31 119.55 3h3r h LEU 580 Ca 0.12 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 3h3r h LEU 580 Cb -0.05 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 3h3r h LEU 580 CO -0.03 0.97 -0.12 0.50 0.09 0.00 0.00 178.44 179.85 3h3r h LYS 581 N 0.51 0.46 -0.08 1.13 3.64 -1.34 -1.86 116.57 119.04 3h3r h LYS 581 Ca 0.05 -0.21 -0.03 0.00 -1.27 0.00 0.00 60.65 59.19 3h3r h LYS 581 Cb 0.89 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.70 3h3r h LYS 581 CO 0.08 0.75 -0.05 -0.09 -2.27 0.00 0.00 179.45 177.87 3h3r h ARG 582 N 0.16 0.18 0.17 1.90 2.43 -1.15 -1.89 114.38 116.18 3h3r h ARG 582 Ca 0.05 -0.08 0.01 0.00 -0.81 0.00 0.00 59.98 59.14 3h3r h ARG 582 Cb 0.63 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.15 3h3r h ARG 582 CO 0.03 0.57 -0.24 0.35 -1.51 0.00 0.00 179.97 179.18 3h3r h PHE 583 N -0.21 -0.63 -0.47 2.20 3.57 -1.06 -1.13 116.94 119.22 3h3r h PHE 583 Ca 0.02 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 3h3r h PHE 583 Cb 0.52 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.49 3h3r h PHE 583 CO 0.07 -0.34 0.17 1.79 -2.23 0.00 0.00 178.31 177.78 3h3r h THR 584 N -0.47 1.18 0.00 4.41 1.35 -1.37 -1.82 112.91 116.19 3h3r h THR 584 Ca 0.01 -0.58 -0.12 0.00 -0.55 0.00 0.00 66.41 65.18 3h3r h THR 584 Cb 0.46 0.64 -0.02 0.00 -1.73 0.00 0.00 68.15 67.51 3h3r h THR 584 CO -0.10 0.22 -0.57 0.28 -0.25 0.00 0.00 175.52 175.10 3h3r h SER 585 N 0.66 0.00 -0.23 5.36 0.02 -1.22 -2.33 113.55 115.81 3h3r h SER 585 Ca 0.16 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.05 3h3r h SER 585 Cb 0.16 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 3h3r h SER 585 CO -0.01 0.57 -0.10 0.22 -1.14 0.00 0.00 176.83 176.37 3h3r h TYR 586 N 0.00 0.55 -0.31 3.45 3.20 -0.44 -1.18 116.97 122.24 3h3r h TYR 586 Ca -0.01 -0.13 0.03 0.00 3.14 0.00 0.00 58.73 61.76 3h3r h TYR 586 Cb 1.06 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 39.17 3h3r h TYR 586 CO 0.00 0.74 0.12 0.28 -1.64 0.00 0.00 178.16 177.66 3h3r h VAL 587 N 0.20 0.94 -0.73 1.81 2.07 -1.21 -0.73 116.25 118.60 3h3r h VAL 587 Ca 0.05 -0.09 0.10 0.00 0.82 0.00 0.00 66.70 67.59 3h3r h VAL 587 Cb 0.59 0.65 -0.08 0.00 -1.52 0.00 0.00 31.29 30.93 3h3r h VAL 587 CO 0.03 0.05 0.36 1.56 0.02 0.00 0.00 177.57 179.59 3h3r h GLN 588 N 0.27 0.57 -0.42 1.57 4.20 -1.36 -0.47 115.11 119.46 3h3r h GLN 588 Ca 0.13 -0.03 -0.13 0.00 0.06 0.00 0.00 58.65 58.68 3h3r h GLN 588 Cb 0.08 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 3h3r h GLN 588 CO -0.12 0.38 -0.25 0.93 -0.67 0.00 0.00 178.83 179.09 3h3r h GLU 589 N 0.59 0.92 0.00 1.46 5.08 -0.75 -2.31 114.58 119.57 3h3r h GLU 589 Ca 0.37 -0.42 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 3h3r h GLU 589 Cb 0.43 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 3h3r h GLU 589 CO -0.29 1.08 -0.18 0.87 -1.00 0.00 0.00 179.01 179.48 3h3r h LYS 590 N 0.75 0.00 0.00 2.33 1.79 -0.95 -3.27 116.57 117.22 3h3r h LYS 590 Ca 0.09 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 3h3r h LYS 590 Cb 0.83 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.48 3h3r h LYS 590 CO 0.07 0.18 -1.43 0.25 -1.08 0.00 0.00 179.45 177.44 3h3r n THR 591 N -3.20 0.14 -1.66 -0.16 -2.24 -0.20 -4.91 114.28 102.05 3h3r n THR 591 Ca 0.02 -0.36 -0.47 0.00 -2.27 0.00 0.00 64.05 60.97 3h3r n THR 591 Cb 0.52 0.15 -0.04 0.00 -2.10 0.00 0.00 70.33 68.86 3h3r n THR 591 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h3r n ALA 592 N -2.02 1.00 -0.25 6.98 0.00 -0.88 -1.15 120.51 124.19 3h3r n ALA 592 Ca -0.01 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.88 3h3r n ALA 592 Cb 0.50 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.65 3h3r n ALA 592 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h3r n GLY 593 N 3.09 2.04 3.94 0.00 0.00 -1.26 -5.00 105.19 107.99 3h3r n GLY 593 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 3h3r n GLY 593 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h3r s LYS 594 N -0.16 3.46 0.39 1.61 1.02 -0.30 -5.06 119.74 120.70 3h3r s LYS 594 Ca 0.00 -0.53 -0.27 0.00 0.02 0.00 0.00 55.97 55.19 3h3r s LYS 594 Cb 0.00 -2.91 -0.11 0.00 -0.52 0.00 0.00 37.83 34.29 3h3r s LYS 594 CO 0.00 0.46 1.29 -2.30 -0.92 0.00 0.00 175.35 173.89 3h3r n PRO 595 N -0.71 2.05 -2.70 -1.68 -0.02 -1.26 -4.91 135.00 125.77 3h3r n PRO 595 Ca -0.06 0.72 -0.42 0.00 -2.02 0.00 0.00 63.50 61.72 3h3r n PRO 595 Cb 0.54 -2.38 -0.03 0.00 -0.02 0.00 0.00 33.50 31.62 3h3r n PRO 595 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3h3r s ILE 596 N -1.15 4.78 -0.51 4.25 1.01 -1.26 -5.01 121.20 123.30 3h3r s ILE 596 Ca 0.58 2.01 -0.21 0.00 0.00 0.00 0.00 60.65 63.04 3h3r s ILE 596 Cb -0.53 -4.30 0.05 0.00 0.01 0.00 0.00 42.46 37.69 3h3r s ILE 596 CO 0.60 -0.01 0.73 -0.22 0.00 0.00 0.00 174.94 176.04 3h3r s LEU 597 N 2.10 4.64 0.00 2.97 2.96 -1.26 -5.15 118.68 124.93 3h3r s LEU 597 Ca 0.47 -0.68 0.30 0.00 -0.22 0.00 0.00 54.13 54.01 3h3r s LEU 597 Cb -0.18 -2.60 1.45 0.00 0.50 0.00 0.00 46.19 45.36 3h3r s LEU 597 CO 0.17 -0.99 1.97 0.49 -1.32 0.00 0.00 176.35 176.67