#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q3x n GLY 367 N 0.00 -1.98 3.72 0.00 0.00 -1.17 -4.80 105.19 100.95 1q3x n GLY 367 Ca 0.00 -1.36 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 1q3x n GLY 367 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1q3x n PRO 368 N -1.53 2.23 -2.59 1.61 -0.02 -1.26 -4.82 135.00 128.62 1q3x n PRO 368 Ca 0.00 0.78 -0.33 0.00 -2.02 0.00 0.00 63.50 61.93 1q3x n PRO 368 Cb 0.13 -2.41 -0.05 0.00 -0.02 0.00 0.00 33.50 31.16 1q3x n PRO 368 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1q3x s PRO 369 N -1.96 3.99 0.56 0.52 0.04 -1.26 -5.00 135.00 131.89 1q3x s PRO 369 Ca 0.55 1.14 -0.21 0.00 0.04 0.00 0.00 61.00 62.53 1q3x s PRO 369 Cb -0.54 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 31.82 1q3x s PRO 369 CO 0.62 -0.25 1.33 -0.51 0.04 0.00 0.00 177.00 178.24 1q3x s ASP 370 N -2.41 5.17 0.32 6.66 1.11 -1.26 -4.95 116.67 121.32 1q3x s ASP 370 Ca 0.63 2.70 -0.29 0.00 0.18 0.00 0.00 52.55 55.77 1q3x s ASP 370 Cb -0.11 -2.63 -0.10 0.00 1.07 0.00 0.00 42.92 41.14 1q3x s ASP 370 CO 0.21 -1.63 1.29 -0.62 1.18 0.00 0.00 175.17 175.60 1q3x s ASP 371 N -1.09 6.83 -0.32 0.27 -1.08 -1.26 -4.95 116.67 115.07 1q3x s ASP 371 Ca 0.74 2.64 -0.09 0.00 -0.52 0.00 0.00 52.55 55.32 1q3x s ASP 371 Cb -0.39 -2.65 0.00 0.00 -1.46 0.00 0.00 42.92 38.43 1q3x s ASP 371 CO 0.45 -0.49 0.14 -0.22 0.52 0.00 0.00 175.17 175.56 1q3x s LEU 372 N -1.74 4.12 0.19 -1.34 2.96 -1.26 -5.07 118.68 116.54 1q3x s LEU 372 Ca 0.48 -0.66 -0.33 0.00 -0.22 0.00 0.00 54.13 53.41 1q3x s LEU 372 Cb -0.39 -1.97 -0.14 0.00 0.50 0.00 0.00 46.19 44.20 1q3x s LEU 372 CO 0.52 -0.22 1.50 -2.65 -1.32 0.00 0.00 176.35 174.17 1q3x n PRO 373 N 4.95 2.06 -1.68 0.98 -0.02 -1.26 -1.24 135.00 138.78 1q3x n PRO 373 Ca -0.14 0.74 -0.19 0.00 -2.02 0.00 0.00 63.50 61.89 1q3x n PRO 373 Cb 0.48 -2.46 -0.07 0.00 -0.02 0.00 0.00 33.50 31.44 1q3x n PRO 373 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1q3x n SER 374 N 2.88 -5.27 -0.83 2.55 7.64 -1.26 -4.52 113.62 114.80 1q3x n SER 374 Ca 0.15 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.41 1q3x n SER 374 Cb 0.29 -4.40 0.00 0.00 -1.01 0.00 0.00 64.21 59.10 1q3x n SER 374 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1q3x n GLY 375 N -0.74 3.67 3.29 0.23 0.00 -0.38 -1.87 105.19 109.39 1q3x n GLY 375 Ca -0.19 -1.44 -0.09 0.00 0.00 0.00 0.00 46.02 44.29 1q3x n GLY 375 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1q3x s ARG 376 N -1.50 1.07 0.03 1.61 1.70 -0.23 -4.68 118.95 116.95 1q3x s ARG 376 Ca 0.00 -1.20 0.08 0.00 -0.47 0.00 0.00 55.73 54.14 1q3x s ARG 376 Cb 0.00 0.35 -0.02 0.00 -0.57 0.00 0.00 34.95 34.70 1q3x s ARG 376 CO 0.00 -0.37 -0.22 0.14 -1.08 0.00 0.00 175.30 173.77 1q3x s VAL 377 N -3.97 1.77 -0.06 4.99 -7.23 -1.26 -2.16 120.40 112.48 1q3x s VAL 377 Ca 0.17 -1.18 -0.02 0.00 -1.81 0.00 0.00 61.98 59.13 1q3x s VAL 377 Cb 0.04 -1.52 0.04 0.00 0.56 0.00 0.00 36.38 35.50 1q3x s VAL 377 CO -0.01 0.29 0.11 -1.61 -0.31 0.00 0.00 175.10 173.57 1q3x s GLU 378 N -1.05 -0.01 -0.17 4.82 8.01 -0.84 -5.01 118.70 124.44 1q3x s GLU 378 Ca 0.08 0.42 -0.29 0.00 0.01 0.00 0.00 54.97 55.19 1q3x s GLU 378 Cb -0.09 -0.33 -0.03 0.00 -4.31 0.00 0.00 34.13 29.37 1q3x s GLU 378 CO 0.01 -0.27 1.49 0.71 0.01 0.00 0.00 175.26 177.21 1q3x s TYR 379 N 1.90 2.35 0.03 1.61 1.51 -1.26 -1.30 117.35 122.20 1q3x s TYR 379 Ca 0.00 0.63 0.03 0.00 -1.01 0.00 0.00 57.07 56.72 1q3x s TYR 379 Cb -0.12 -3.82 -0.25 0.00 -0.11 0.00 0.00 41.96 37.66 1q3x s TYR 379 CO -0.04 -2.66 0.97 -0.84 -1.11 0.00 0.00 175.55 171.86 1q3x h ILE 380 N 5.79 1.29 0.33 2.71 -2.65 -1.79 -3.37 117.51 119.83 1q3x h ILE 380 Ca -0.32 -2.99 -0.02 0.00 1.03 0.00 0.00 64.86 62.57 1q3x h ILE 380 Cb 1.14 2.73 0.00 0.00 -2.05 0.00 0.00 36.82 38.64 1q3x h ILE 380 CO 0.98 0.81 -0.16 0.74 0.03 0.00 0.00 178.15 180.55 1q3x h THR 381 N 0.03 0.56 0.00 0.16 2.02 -1.90 -3.49 112.91 110.30 1q3x h THR 381 Ca -0.17 -0.69 0.00 0.00 0.77 0.00 0.00 66.41 66.32 1q3x h THR 381 Cb 1.94 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 69.21 1q3x h THR 381 CO 0.14 0.11 0.00 0.61 0.37 0.00 0.00 175.52 176.75 1q3x n GLY 382 N -0.05 0.93 3.63 2.16 0.00 -1.26 -5.07 105.19 105.53 1q3x n GLY 382 Ca -0.09 -0.43 -0.44 0.00 0.00 0.00 0.00 46.02 45.06 1q3x n GLY 382 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1q3x n PRO 383 N -0.04 2.40 -2.56 1.61 -0.02 -1.26 -2.06 135.00 133.06 1q3x n PRO 383 Ca 0.00 0.81 -0.07 0.00 -2.02 0.00 0.00 63.50 62.22 1q3x n PRO 383 Cb 0.00 -3.02 0.01 0.00 -0.02 0.00 0.00 33.50 30.47 1q3x n PRO 383 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1q3x n GLY 384 N 5.04 0.34 3.23 -1.23 0.00 -1.26 -5.03 105.19 106.29 1q3x n GLY 384 Ca 0.25 -0.48 -0.37 0.00 0.00 0.00 0.00 46.02 45.43 1q3x n GLY 384 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1q3x s VAL 385 N -2.80 3.46 -0.03 1.61 -7.23 -0.87 -4.93 120.40 109.61 1q3x s VAL 385 Ca 0.11 -1.24 0.14 0.00 -1.81 0.00 0.00 61.98 59.18 1q3x s VAL 385 Cb -0.05 -2.97 0.26 0.00 0.56 0.00 0.00 36.38 34.17 1q3x s VAL 385 CO 0.14 -0.15 1.11 0.35 -0.31 0.00 0.00 175.10 176.23 1q3x n THR 386 N 4.73 0.35 0.00 5.32 -2.24 -1.26 -4.82 114.28 116.36 1q3x n THR 386 Ca -0.13 -0.93 0.00 0.00 -2.27 0.00 0.00 64.05 60.72 1q3x n THR 386 Cb 0.44 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 1q3x n THR 386 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1q3x n THR 387 N 0.01 0.00 -3.27 4.28 -1.04 -1.26 0.12 114.28 113.13 1q3x n THR 387 Ca 0.06 0.43 0.03 0.00 -2.04 0.00 0.00 64.05 62.53 1q3x n THR 387 Cb 0.90 -1.06 -0.02 0.00 -1.82 0.00 0.00 70.33 68.33 1q3x n THR 387 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 1q3x s TYR 388 N -0.23 -1.16 0.00 -1.42 -0.85 -1.26 -2.86 117.35 109.57 1q3x s TYR 388 Ca 0.00 1.45 0.00 0.00 -0.52 0.00 0.00 57.07 58.00 1q3x s TYR 388 Cb 0.00 0.49 0.00 0.00 0.38 0.00 0.00 41.96 42.83 1q3x s TYR 388 CO 0.00 -0.62 0.00 1.17 -1.52 0.00 0.00 175.55 174.58 1q3x n LYS 389 N 5.38 0.00 -1.99 -3.49 0.00 -1.26 -5.00 118.16 111.79 1q3x n LYS 389 Ca -0.05 0.00 -0.41 0.00 0.00 0.00 0.00 58.31 57.84 1q3x n LYS 389 Cb 0.52 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.53 1q3x n LYS 389 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1q3x s ALA 390 N -2.00 3.60 -0.32 3.14 0.00 -1.26 -4.63 121.76 120.29 1q3x s ALA 390 Ca 0.00 1.37 -0.04 0.00 0.00 0.00 0.00 51.96 53.29 1q3x s ALA 390 Cb 0.00 -3.55 0.05 0.00 0.00 0.00 0.00 23.12 19.62 1q3x s ALA 390 CO 0.00 -0.78 0.05 0.14 0.00 0.00 0.00 175.76 175.17 1q3x s VAL 391 N -0.45 3.31 0.42 0.00 -7.23 -1.26 -1.09 120.40 114.10 1q3x s VAL 391 Ca 0.56 -1.32 0.08 0.00 -1.81 0.00 0.00 61.98 59.49 1q3x s VAL 391 Cb -0.42 -2.91 -0.00 0.00 0.56 0.00 0.00 36.38 33.60 1q3x s VAL 391 CO 0.49 -0.16 0.49 0.27 -0.31 0.00 0.00 175.10 175.88 1q3x s ILE 392 N 1.31 2.89 -0.07 -0.62 -4.36 0.11 -2.27 121.20 118.19 1q3x s ILE 392 Ca -0.03 -1.14 0.01 0.00 -0.26 0.00 0.00 60.65 59.22 1q3x s ILE 392 Cb -0.20 -3.01 0.02 0.00 1.25 0.00 0.00 42.46 40.52 1q3x s ILE 392 CO 0.00 -0.00 -0.07 -1.58 0.24 0.00 0.00 174.94 173.53 1q3x s GLN 393 N -4.26 1.18 -0.02 0.37 2.00 -0.42 -1.43 119.66 117.08 1q3x s GLN 393 Ca 0.52 -0.19 -0.11 0.00 -2.00 0.00 0.00 55.36 53.58 1q3x s GLN 393 Cb -0.07 -1.16 -0.05 0.00 0.80 0.00 0.00 33.01 32.52 1q3x s GLN 393 CO 0.31 -0.12 0.32 0.71 -0.50 0.00 0.00 175.29 176.01 1q3x s TYR 394 N 1.15 3.66 0.02 1.67 1.51 -0.69 -1.99 117.35 122.69 1q3x s TYR 394 Ca -0.07 0.80 -0.08 0.00 -1.01 0.00 0.00 57.07 56.71 1q3x s TYR 394 Cb -0.14 -2.15 -0.00 0.00 -0.11 0.00 0.00 41.96 39.56 1q3x s TYR 394 CO -0.01 0.65 0.15 -1.54 -1.11 0.00 0.00 175.55 173.69 1q3x s SER 395 N -1.23 0.06 0.21 2.29 1.04 -0.92 -4.13 113.70 111.02 1q3x s SER 395 Ca 0.23 -0.34 0.06 0.00 0.48 0.00 0.00 55.95 56.38 1q3x s SER 395 Cb -0.15 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.18 1q3x s SER 395 CO 0.12 -0.47 0.19 0.00 0.98 0.00 0.00 173.24 174.05 1q3x s GLU 397 N -3.49 2.38 0.47 0.00 2.02 -0.78 -4.84 118.70 114.47 1q3x s GLU 397 Ca 0.32 0.52 0.24 0.00 0.02 0.00 0.00 54.97 56.07 1q3x s GLU 397 Cb -0.09 -4.65 1.17 0.00 0.10 0.00 0.00 34.13 30.66 1q3x s GLU 397 CO 0.25 -3.21 1.96 0.93 0.02 0.00 0.00 175.26 175.21 1q3x h GLU 398 N 14.66 0.00 -0.75 1.61 5.08 -1.91 -0.62 114.58 132.65 1q3x h GLU 398 Ca -0.13 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.19 1q3x h GLU 398 Cb 1.12 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.34 1q3x h GLU 398 CO 1.18 0.20 0.32 1.15 -1.00 0.00 0.00 179.01 180.86 1q3x h THR 399 N 0.00 1.25 0.00 1.13 2.02 -2.01 -3.34 112.91 111.95 1q3x h THR 399 Ca -0.00 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 66.44 1q3x h THR 399 Cb 0.52 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1q3x h THR 399 CO 0.03 0.31 0.00 0.49 0.37 0.00 0.00 175.52 176.71 1q3x n PHE 400 N -4.30 0.00 -4.15 3.16 3.01 -1.13 -4.95 117.46 109.10 1q3x n PHE 400 Ca 0.07 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.39 1q3x n PHE 400 Cb 0.16 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.52 1q3x n PHE 400 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 1q3x s TYR 401 N -0.54 0.98 -0.04 1.38 1.51 -0.25 -0.29 117.35 120.10 1q3x s TYR 401 Ca 0.00 -0.64 0.03 0.00 -1.01 0.00 0.00 57.07 55.44 1q3x s TYR 401 Cb 0.00 -0.55 0.00 0.00 -0.11 0.00 0.00 41.96 41.31 1q3x s TYR 401 CO 0.00 -0.03 -0.11 0.95 -1.11 0.00 0.00 175.55 175.25 1q3x s THR 402 N -2.30 0.95 0.21 -0.71 -4.23 -0.08 -4.08 115.64 105.40 1q3x s THR 402 Ca 0.03 -0.43 -0.31 0.00 -1.18 0.00 0.00 61.69 59.80 1q3x s THR 402 Cb -0.04 -0.85 -0.10 0.00 1.34 0.00 0.00 72.50 72.85 1q3x s THR 402 CO -0.00 0.29 1.51 -0.32 -0.54 0.00 0.00 174.62 175.56 1q3x s MET 403 N 0.28 4.23 0.29 3.99 1.75 -1.26 -1.15 119.30 127.43 1q3x s MET 403 Ca -0.05 2.34 0.11 0.00 -1.25 0.00 0.00 55.69 56.84 1q3x s MET 403 Cb -0.11 -3.12 -0.05 0.00 2.84 0.00 0.00 34.83 34.39 1q3x s MET 403 CO 0.01 -0.52 -0.16 0.15 -0.65 0.00 0.00 175.02 173.86 1q3x s LYS 404 N 0.29 1.78 -0.67 4.11 -0.14 0.11 -4.73 119.74 120.50 1q3x s LYS 404 Ca 0.64 -1.75 0.00 0.00 -1.36 0.00 0.00 55.97 53.50 1q3x s LYS 404 Cb -0.43 -1.81 0.00 0.00 -1.68 0.00 0.00 37.83 33.91 1q3x s LYS 404 CO 0.38 0.30 0.00 1.55 -0.76 0.00 0.00 175.35 176.83 1q3x n VAL 405 N -0.68 0.00 -2.79 3.17 3.14 -1.26 -3.57 118.33 116.34 1q3x n VAL 405 Ca -0.05 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.33 1q3x n VAL 405 Cb 0.60 -0.95 0.00 0.00 -1.06 0.00 0.00 33.84 32.43 1q3x n VAL 405 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1q3x n ASN 406 N -0.05 0.00 -0.37 6.55 2.85 -1.26 -5.00 115.26 117.98 1q3x n ASN 406 Ca -0.06 -0.62 0.00 0.00 -0.11 0.00 0.00 54.58 53.78 1q3x n ASN 406 Cb 0.38 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.40 1q3x n ASN 406 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 1q3x n ASP 407 N -0.52 0.00 0.00 1.20 5.75 -1.26 -5.01 116.55 116.71 1q3x n ASP 407 Ca 0.00 -0.84 0.00 0.00 -0.01 0.00 0.00 54.79 53.94 1q3x n ASP 407 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1q3x n ASP 407 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1q3x n GLY 408 N 0.00 2.99 3.63 6.12 0.00 -1.26 -4.89 105.19 111.79 1q3x n GLY 408 Ca 0.00 -0.79 -0.48 0.00 0.00 0.00 0.00 46.02 44.75 1q3x n GLY 408 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1q3x n LYS 409 N 0.00 1.99 -4.07 1.61 0.00 -1.26 -1.70 118.16 114.73 1q3x n LYS 409 Ca 0.00 0.69 -0.13 0.00 0.00 0.00 0.00 58.31 58.87 1q3x n LYS 409 Cb 0.00 -2.70 -0.12 0.00 0.00 0.00 0.00 35.03 32.20 1q3x n LYS 409 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1q3x s TYR 410 N 5.21 0.54 0.12 5.64 1.51 -0.52 -2.12 117.35 127.73 1q3x s TYR 410 Ca 0.97 -0.38 0.04 0.00 -1.01 0.00 0.00 57.07 56.68 1q3x s TYR 410 Cb -0.67 -0.33 -0.04 0.00 -0.11 0.00 0.00 41.96 40.81 1q3x s TYR 410 CO 0.49 -0.07 -0.09 0.54 -1.11 0.00 0.00 175.55 175.30 1q3x s VAL 411 N -1.03 0.98 0.17 0.71 0.11 0.16 0.10 120.40 121.59 1q3x s VAL 411 Ca -0.07 -1.90 -0.07 0.00 -2.93 0.00 0.00 61.98 57.00 1q3x s VAL 411 Cb -0.08 -1.66 -0.06 0.00 -1.53 0.00 0.00 36.38 33.05 1q3x s VAL 411 CO 0.00 -0.72 0.44 0.00 -3.33 0.00 0.00 175.10 171.49 1q3x n GLY 416 N 0.08 2.86 3.22 0.00 0.00 -1.26 -4.42 105.19 105.67 1q3x n GLY 416 Ca -0.02 -0.28 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 1q3x n GLY 416 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1q3x s PHE 417 N -0.35 1.17 -0.05 1.61 -0.12 -1.26 -4.44 117.98 114.54 1q3x s PHE 417 Ca 0.09 -1.20 -0.28 0.00 -0.05 0.00 0.00 56.93 55.49 1q3x s PHE 417 Cb 0.06 -0.65 -0.03 0.00 -0.63 0.00 0.00 43.02 41.78 1q3x s PHE 417 CO -0.00 -0.42 0.90 -1.58 -0.05 0.00 0.00 175.22 174.06 1q3x s TRP 418 N -3.90 3.60 0.13 3.49 0.52 -1.26 -4.92 118.94 116.60 1q3x s TRP 418 Ca 0.30 1.53 0.06 0.00 0.02 0.00 0.00 56.10 58.01 1q3x s TRP 418 Cb 0.07 -3.04 -0.04 0.00 -1.15 0.00 0.00 33.47 29.32 1q3x s TRP 418 CO 0.07 -0.03 -0.13 -0.08 0.02 0.00 0.00 176.95 176.80 1q3x s THR 419 N 1.18 1.30 0.67 2.01 -1.32 -0.30 -4.61 115.64 114.57 1q3x s THR 419 Ca 0.46 -1.77 -0.03 0.00 -1.21 0.00 0.00 61.69 59.15 1q3x s THR 419 Cb -0.19 -1.57 0.08 0.00 -1.51 0.00 0.00 72.50 69.30 1q3x s THR 419 CO 0.23 -0.47 0.95 -0.94 -2.21 0.00 0.00 174.62 172.17 1q3x s SER 420 N -2.56 4.75 0.14 8.08 1.04 0.62 0.38 113.70 126.14 1q3x s SER 420 Ca 0.10 0.07 -0.11 0.00 0.48 0.00 0.00 55.95 56.49 1q3x s SER 420 Cb -0.04 -0.69 -0.03 0.00 0.10 0.00 0.00 66.02 65.36 1q3x s SER 420 CO 0.03 -1.58 1.50 0.77 0.98 0.00 0.00 173.24 174.93 1q3x h SER 421 N -0.42 0.97 -0.04 7.02 4.64 -1.73 -3.25 113.55 120.74 1q3x h SER 421 Ca -0.41 -0.43 -0.23 0.00 -0.47 0.00 0.00 61.79 60.24 1q3x h SER 421 Cb 1.29 -0.27 0.02 0.00 -0.31 0.00 0.00 62.40 63.13 1q3x h SER 421 CO 0.51 1.20 -0.87 0.50 -0.87 0.00 0.00 176.83 177.29 1q3x h LYS 422 N 0.75 0.66 0.00 4.77 3.11 -1.95 -3.47 116.57 120.44 1q3x h LYS 422 Ca 0.08 -0.66 0.00 0.00 -2.81 0.00 0.00 60.65 57.26 1q3x h LYS 422 Cb 0.87 0.17 0.00 0.00 -1.00 0.00 0.00 32.23 32.28 1q3x h LYS 422 CO 0.08 1.26 0.00 0.41 -2.81 0.00 0.00 179.45 178.38 1q3x n GLY 423 N 0.97 0.00 3.67 5.01 0.00 -1.22 -5.17 105.19 108.45 1q3x n GLY 423 Ca -0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 1q3x n GLY 423 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q3x s GLU 424 N 0.00 2.41 -0.17 1.61 2.02 -1.26 -4.87 118.70 118.44 1q3x s GLU 424 Ca 0.00 -1.13 -0.02 0.00 0.02 0.00 0.00 54.97 53.85 1q3x s GLU 424 Cb 0.00 -2.35 -0.10 0.00 0.10 0.00 0.00 34.13 31.78 1q3x s GLU 424 CO 0.00 0.45 -0.17 0.36 0.02 0.00 0.00 175.26 175.91 1q3x n LYS 425 N -0.20 0.40 -1.32 1.61 -0.00 -1.26 0.23 118.16 117.62 1q3x n LYS 425 Ca -0.09 0.12 -0.29 0.00 -0.00 0.00 0.00 58.31 58.04 1q3x n LYS 425 Cb 0.55 -1.27 0.14 0.00 -0.00 0.00 0.00 35.03 34.45 1q3x n LYS 425 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1q3x s SER 426 N -5.93 3.49 0.69 -5.58 1.04 -1.26 -4.62 113.70 101.53 1q3x s SER 426 Ca -0.23 1.31 -0.15 0.00 0.48 0.00 0.00 55.95 57.35 1q3x s SER 426 Cb 0.07 -1.98 0.02 0.00 0.10 0.00 0.00 66.02 64.23 1q3x s SER 426 CO 0.36 -2.60 1.17 -0.76 0.98 0.00 0.00 173.24 172.39 1q3x s LEU 427 N -6.16 3.38 1.13 2.42 1.43 -1.26 -4.94 118.68 114.69 1q3x s LEU 427 Ca 0.63 2.22 -0.13 0.00 -1.03 0.00 0.00 54.13 55.82 1q3x s LEU 427 Cb -0.17 -4.58 0.26 0.00 0.03 0.00 0.00 46.19 41.74 1q3x s LEU 427 CO 0.56 -1.95 1.05 -2.84 0.23 0.00 0.00 176.35 173.39 1q3x s PRO 428 N -3.91 -0.64 -0.13 1.29 0.02 -1.26 -5.05 135.00 125.31 1q3x s PRO 428 Ca 0.72 0.64 0.01 0.00 0.02 0.00 0.00 61.00 62.38 1q3x s PRO 428 Cb -0.26 -1.60 0.02 0.00 0.02 0.00 0.00 34.50 32.68 1q3x s PRO 428 CO 0.42 -3.48 -0.15 0.08 -0.33 0.00 0.00 177.00 173.54 1q3x s VAL 429 N -2.65 1.57 -0.37 3.83 1.01 -1.23 -4.97 120.40 117.59 1q3x s VAL 429 Ca 0.68 -0.65 -0.22 0.00 0.00 0.00 0.00 61.98 61.79 1q3x s VAL 429 Cb -0.22 -1.45 0.01 0.00 0.00 0.00 0.00 36.38 34.72 1q3x s VAL 429 CO 0.62 0.46 0.71 0.00 0.00 0.00 0.00 175.10 176.88 1q3x s GLU 431 N 2.92 3.71 0.27 0.00 2.12 -0.30 -4.85 118.70 122.58 1q3x s GLU 431 Ca 0.28 -0.49 -0.31 0.00 0.36 0.00 0.00 54.97 54.81 1q3x s GLU 431 Cb -0.14 -3.01 -0.12 0.00 0.26 0.00 0.00 34.13 31.12 1q3x s GLU 431 CO 0.16 0.19 1.54 -2.30 -0.54 0.00 0.00 175.26 174.32 1q3x n PRO 432 N 3.70 2.49 -2.11 4.30 -0.02 -1.26 -0.91 135.00 141.19 1q3x n PRO 432 Ca -0.17 0.89 -0.39 0.00 -2.02 0.00 0.00 63.50 61.81 1q3x n PRO 432 Cb 0.52 -2.63 -0.00 0.00 -0.02 0.00 0.00 33.50 31.37 1q3x n PRO 432 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1q3x s VAL 433 N 0.06 2.75 0.19 -1.45 1.01 0.60 -4.87 120.40 118.68 1q3x s VAL 433 Ca 0.66 0.63 0.09 0.00 0.00 0.00 0.00 61.98 63.36 1q3x s VAL 433 Cb -0.55 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 1q3x s VAL 433 CO 0.48 0.06 -0.18 0.00 0.00 0.00 0.00 175.10 175.46 1q3x n GLY 435 N 0.04 0.49 3.78 0.00 0.00 -0.41 -4.74 105.19 104.34 1q3x n GLY 435 Ca -0.11 -0.44 -0.37 0.00 0.00 0.00 0.00 46.02 45.09 1q3x n GLY 435 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1q3x s LEU 436 N -0.19 4.19 -0.09 0.99 1.43 -1.26 -0.91 118.68 122.83 1q3x s LEU 436 Ca 0.00 2.12 -0.16 0.00 -1.03 0.00 0.00 54.13 55.06 1q3x s LEU 436 Cb 0.00 -4.10 0.04 0.00 0.03 0.00 0.00 46.19 42.15 1q3x s LEU 436 CO 0.00 -0.50 0.40 -0.55 0.23 0.00 0.00 176.35 175.92 1q3x s SER 437 N -1.42 -0.36 0.00 2.29 0.15 -1.26 -4.70 113.70 108.40 1q3x s SER 437 Ca 0.57 0.54 0.28 0.00 0.70 0.00 0.00 55.95 58.04 1q3x s SER 437 Cb -0.25 0.62 1.36 0.00 -1.71 0.00 0.00 66.02 66.05 1q3x s SER 437 CO 0.31 -0.30 1.96 0.00 1.20 0.00 0.00 173.24 176.41 1q3x n ALA 438 N 2.10 2.37 -1.71 5.45 0.00 -0.06 -4.75 120.51 123.90 1q3x n ALA 438 Ca -0.17 -0.12 -0.32 0.00 0.00 0.00 0.00 53.44 52.83 1q3x n ALA 438 Cb 0.57 -1.46 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 1q3x n ALA 438 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1q3x s ARG 439 N -2.71 2.15 -0.77 0.00 0.52 -1.26 -4.87 118.95 112.01 1q3x s ARG 439 Ca 0.23 0.92 -0.06 0.00 -0.52 0.00 0.00 55.73 56.30 1q3x s ARG 439 Cb 0.19 -4.62 0.20 0.00 0.52 0.00 0.00 34.95 31.24 1q3x s ARG 439 CO 0.46 -3.39 0.64 -0.08 0.02 0.00 0.00 175.30 172.95 1q3x s THR 440 N 11.85 4.46 1.05 0.02 -1.32 -1.26 -5.16 115.64 125.29 1q3x s THR 440 Ca 0.88 -3.11 -0.17 0.00 -1.21 0.00 0.00 61.69 58.08 1q3x s THR 440 Cb -0.14 -3.81 0.23 0.00 -1.51 0.00 0.00 72.50 67.27 1q3x s THR 440 CO 0.19 -0.99 1.25 0.42 -2.21 0.00 0.00 174.62 173.29 1q3x s THR 441 N -0.41 1.85 0.00 5.08 -4.23 -1.26 -5.31 115.64 111.36 1q3x s THR 441 Ca 0.21 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.72 1q3x s THR 441 Cb -0.14 -2.82 0.00 0.00 1.34 0.00 0.00 72.50 70.88 1q3x s THR 441 CO -0.07 0.00 0.00 -0.38 -0.54 0.00 0.00 174.62 173.63 1q3x n ILE 445 N -4.14 0.00 -3.62 2.99 2.08 0.26 -5.32 119.36 111.61 1q3x n ILE 445 Ca 0.15 0.00 -0.36 0.00 0.56 0.00 0.00 62.75 63.10 1q3x n ILE 445 Cb 0.59 0.00 -0.08 0.00 -0.75 0.00 0.00 39.64 39.41 1q3x n ILE 445 CO 0.00 0.00 0.00 -0.47 0.56 0.00 0.00 176.55 176.64 1q3x s TYR 446 N 0.00 3.43 -1.06 1.39 5.04 0.38 -3.98 117.35 122.54 1q3x s TYR 446 Ca 0.00 0.47 0.00 0.00 -2.44 0.00 0.00 57.07 55.10 1q3x s TYR 446 Cb 0.00 -2.27 0.00 0.00 0.35 0.00 0.00 41.96 40.04 1q3x s TYR 446 CO 0.00 0.24 0.00 0.41 -1.34 0.00 0.00 175.55 174.86 1q3x n GLY 447 N 3.50 0.16 0.00 8.97 0.00 -1.25 -2.06 105.19 114.51 1q3x n GLY 447 Ca -0.14 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1q3x n GLY 447 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3x n GLY 448 N -1.11 3.45 3.49 -0.02 0.00 -1.26 -4.85 105.19 104.89 1q3x n GLY 448 Ca -0.14 -1.96 -0.11 0.00 0.00 0.00 0.00 46.02 43.82 1q3x n GLY 448 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1q3x s GLN 449 N 2.81 1.58 0.01 1.61 -2.07 -0.52 -4.93 119.66 118.15 1q3x s GLN 449 Ca 0.00 -1.45 -0.30 0.00 -1.82 0.00 0.00 55.36 51.79 1q3x s GLN 449 Cb 0.00 0.43 -0.04 0.00 -1.09 0.00 0.00 33.01 32.31 1q3x s GLN 449 CO 0.00 -0.64 1.10 0.21 -1.32 0.00 0.00 175.29 174.65 1q3x s LYS 450 N -3.78 4.47 0.56 9.60 2.20 -1.26 -0.87 119.74 130.65 1q3x s LYS 450 Ca 0.28 1.60 -0.18 0.00 -0.36 0.00 0.00 55.97 57.30 1q3x s LYS 450 Cb 0.01 -3.43 -0.05 0.00 -1.51 0.00 0.00 37.83 32.85 1q3x s LYS 450 CO 0.12 -0.21 1.09 0.00 -0.36 0.00 0.00 175.35 176.00 1q3x s ALA 451 N 1.27 2.71 0.29 3.13 0.00 0.11 -4.90 121.76 124.36 1q3x s ALA 451 Ca 0.55 0.66 0.07 0.00 0.00 0.00 0.00 51.96 53.24 1q3x s ALA 451 Cb -0.25 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.53 1q3x s ALA 451 CO 0.27 -0.75 0.29 0.15 0.00 0.00 0.00 175.76 175.72 1q3x s LYS 452 N -3.52 2.99 0.24 0.00 1.02 -1.26 -4.89 119.74 114.32 1q3x s LYS 452 Ca 0.69 -1.06 -0.31 0.00 0.02 0.00 0.00 55.97 55.30 1q3x s LYS 452 Cb -0.20 -2.63 -0.13 0.00 -0.52 0.00 0.00 37.83 34.34 1q3x s LYS 452 CO 0.29 0.27 1.43 -2.30 -0.92 0.00 0.00 175.35 174.12 1q3x n PRO 453 N -1.34 2.09 -0.17 -1.68 -0.02 -1.26 -1.43 135.00 131.18 1q3x n PRO 453 Ca -0.05 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1q3x n PRO 453 Cb 0.58 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1q3x n PRO 453 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1q3x n GLY 454 N 2.24 2.02 0.08 -1.23 0.00 -1.26 -4.80 105.19 102.24 1q3x n GLY 454 Ca 0.12 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 1q3x n GLY 454 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1q3x h ASP 455 N 0.00 -0.08 -2.14 1.61 3.32 -1.60 -0.13 116.42 117.40 1q3x h ASP 455 Ca 0.00 -0.25 -0.58 0.00 0.02 0.00 0.00 57.03 56.22 1q3x h ASP 455 Cb 0.00 0.02 -0.41 0.00 0.22 0.00 0.00 39.33 39.16 1q3x h ASP 455 CO 0.00 0.21 -0.82 0.49 -1.72 0.00 0.00 179.24 177.40 1q3x n PHE 456 N -5.00 1.82 0.48 4.55 3.01 -1.26 -4.38 117.46 116.67 1q3x n PHE 456 Ca -0.08 -3.89 0.11 0.00 1.01 0.00 0.00 57.45 54.60 1q3x n PHE 456 Cb 0.18 -0.45 0.45 0.00 -0.01 0.00 0.00 39.48 39.65 1q3x n PHE 456 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1q3x n PRO 457 N 1.17 0.16 0.00 -1.08 -0.04 -1.26 -1.34 135.00 132.60 1q3x n PRO 457 Ca 0.26 0.34 0.13 0.00 -0.04 0.00 0.00 63.50 64.19 1q3x n PRO 457 Cb 0.46 -1.78 0.46 0.00 -0.04 0.00 0.00 33.50 32.60 1q3x n PRO 457 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1q3x n TRP 458 N -2.07 0.00 -1.88 0.54 2.14 -0.81 -2.77 117.44 112.60 1q3x n TRP 458 Ca 0.03 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.18 1q3x n TRP 458 Cb 0.25 -0.34 -0.03 0.00 -0.81 0.00 0.00 31.31 30.39 1q3x n TRP 458 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1q3x s GLN 459 N -2.91 4.19 -0.03 -2.67 2.00 -0.45 -1.08 119.66 118.71 1q3x s GLN 459 Ca 0.15 2.43 0.04 0.00 -2.00 0.00 0.00 55.36 55.99 1q3x s GLN 459 Cb 0.19 -3.13 -0.01 0.00 0.80 0.00 0.00 33.01 30.86 1q3x s GLN 459 CO 0.59 -0.64 -0.15 0.08 -0.50 0.00 0.00 175.29 174.67 1q3x s VAL 460 N 1.08 1.25 -0.18 1.34 1.01 -0.70 -4.42 120.40 119.78 1q3x s VAL 460 Ca 0.71 -0.64 -0.11 0.00 0.00 0.00 0.00 61.98 61.94 1q3x s VAL 460 Cb -0.45 -1.06 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 1q3x s VAL 460 CO 0.32 0.36 0.18 -0.22 0.00 0.00 0.00 175.10 175.74 1q3x s LEU 461 N -0.10 4.24 -0.20 3.92 2.96 0.92 -1.26 118.68 129.16 1q3x s LEU 461 Ca 0.00 0.34 0.01 0.00 -0.22 0.00 0.00 54.13 54.26 1q3x s LEU 461 Cb -0.09 -2.17 0.03 0.00 0.50 0.00 0.00 46.19 44.46 1q3x s LEU 461 CO 0.01 0.19 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.42 1q3x s ILE 462 N 0.22 2.18 0.19 6.68 1.01 -0.67 -0.81 121.20 130.00 1q3x s ILE 462 Ca 0.11 -1.06 0.03 0.00 0.00 0.00 0.00 60.65 59.73 1q3x s ILE 462 Cb -0.12 -2.00 0.03 0.00 0.01 0.00 0.00 42.46 40.38 1q3x s ILE 462 CO 0.00 0.41 0.24 0.18 0.00 0.00 0.00 174.94 175.77 1q3x n LEU 463 N 4.59 0.00 0.00 2.97 4.77 -0.63 -3.07 117.00 125.64 1q3x n LEU 463 Ca -0.19 -0.84 0.00 0.00 -0.03 0.00 0.00 56.01 54.95 1q3x n LEU 463 Cb 0.48 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1q3x n LEU 463 CO 0.25 -0.53 0.00 0.61 -1.33 0.00 0.00 177.39 176.39 1q3x n GLY 464 N 2.73 3.05 0.00 -0.72 0.00 -1.26 -4.34 105.19 104.64 1q3x n GLY 464 Ca 0.04 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.21 1q3x n GLY 464 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3x n GLY 465 N 0.00 2.45 3.85 -0.02 0.00 -1.26 -5.04 105.19 105.18 1q3x n GLY 465 Ca 0.00 -1.76 -0.31 0.00 0.00 0.00 0.00 46.02 43.94 1q3x n GLY 465 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1q3x s THR 466 N 4.36 4.53 -0.01 2.61 -4.23 -1.26 -4.94 115.64 116.69 1q3x s THR 466 Ca 0.00 0.88 -0.38 0.00 -1.18 0.00 0.00 61.69 61.00 1q3x s THR 466 Cb 0.00 -3.74 -0.17 0.00 1.34 0.00 0.00 72.50 69.92 1q3x s THR 466 CO 0.00 -1.02 1.38 0.41 -0.54 0.00 0.00 174.62 174.85 1q3x n THR 467 N -2.66 0.05 -4.05 3.99 -1.04 -1.26 -4.90 114.28 104.41 1q3x n THR 467 Ca 0.06 -0.01 -0.12 0.00 -2.04 0.00 0.00 64.05 61.94 1q3x n THR 467 Cb 0.54 -0.74 -0.05 0.00 -1.82 0.00 0.00 70.33 68.26 1q3x n THR 467 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1q3x s ALA 468 N 1.03 0.36 0.28 2.41 0.00 -1.17 -4.08 121.76 120.57 1q3x s ALA 468 Ca 0.89 -1.26 -0.00 0.00 0.00 0.00 0.00 51.96 51.58 1q3x s ALA 468 Cb -1.05 1.12 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 1q3x s ALA 468 CO 0.53 -0.81 0.30 0.00 0.00 0.00 0.00 175.76 175.78 1q3x s ALA 469 N -3.46 1.10 0.10 0.00 0.00 0.85 -1.66 121.76 118.70 1q3x s ALA 469 Ca 0.28 -1.66 -0.02 0.00 0.00 0.00 0.00 51.96 50.55 1q3x s ALA 469 Cb -0.00 1.32 0.01 0.00 0.00 0.00 0.00 23.12 24.45 1q3x s ALA 469 CO 0.15 -0.69 0.18 0.41 0.00 0.00 0.00 175.76 175.81 1q3x n GLY 470 N -0.45 2.29 2.94 0.00 0.00 -0.39 -3.81 105.19 105.76 1q3x n GLY 470 Ca 0.03 -1.26 -0.21 0.00 0.00 0.00 0.00 46.02 44.58 1q3x n GLY 470 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3x s ALA 471 N -1.61 0.79 0.22 4.61 0.00 0.65 -1.72 121.76 124.70 1q3x s ALA 471 Ca 0.06 -0.16 -0.31 0.00 0.00 0.00 0.00 51.96 51.55 1q3x s ALA 471 Cb -0.01 -0.41 -0.11 0.00 0.00 0.00 0.00 23.12 22.59 1q3x s ALA 471 CO 0.05 0.05 1.60 -1.17 0.00 0.00 0.00 175.76 176.28 1q3x s LEU 472 N 0.70 4.37 -0.02 0.00 2.96 -0.24 -0.07 118.68 126.37 1q3x s LEU 472 Ca -0.10 2.78 0.08 0.00 -0.22 0.00 0.00 54.13 56.66 1q3x s LEU 472 Cb -0.13 -3.61 -0.02 0.00 0.50 0.00 0.00 46.19 42.93 1q3x s LEU 472 CO 0.01 -0.87 -0.25 -0.76 -1.32 0.00 0.00 176.35 173.16 1q3x s LEU 473 N 0.53 2.11 0.00 -0.68 1.43 0.24 -1.41 118.68 120.89 1q3x s LEU 473 Ca 0.68 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 53.34 1q3x s LEU 473 Cb -0.46 -1.36 0.00 0.00 0.03 0.00 0.00 46.19 44.40 1q3x s LEU 473 CO 0.37 0.32 0.00 -1.22 0.23 0.00 0.00 176.35 176.05 1q3x n TYR 474 N 2.43 -0.45 -0.72 0.29 4.02 -1.26 -1.97 117.16 119.50 1q3x n TYR 474 Ca -0.16 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 57.82 1q3x n TYR 474 Cb 0.51 0.10 0.37 0.00 -0.02 0.00 0.00 39.34 40.30 1q3x n TYR 474 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1q3x n ASP 475 N -3.46 5.05 -0.27 7.72 5.68 -1.26 -4.45 116.55 125.57 1q3x n ASP 475 Ca 0.00 -2.61 0.00 0.00 -0.50 0.00 0.00 54.79 51.68 1q3x n ASP 475 Cb 0.00 -0.61 0.00 0.00 -1.14 0.00 0.00 41.12 39.37 1q3x n ASP 475 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1q3x n ASN 476 N 0.94 0.00 -4.21 -1.12 6.94 -1.18 -0.02 115.26 116.62 1q3x n ASN 476 Ca 0.26 -1.19 -0.18 0.00 -0.02 0.00 0.00 54.58 53.45 1q3x n ASN 476 Cb 0.99 -0.04 -0.11 0.00 -2.36 0.00 0.00 39.78 38.25 1q3x n ASN 476 CO 0.00 0.00 0.00 0.26 -1.03 0.00 0.00 177.26 176.49 1q3x s TRP 477 N 0.00 1.28 -0.09 -2.53 0.52 -0.83 -0.56 118.94 116.74 1q3x s TRP 477 Ca 0.00 -0.54 0.01 0.00 0.02 0.00 0.00 56.10 55.59 1q3x s TRP 477 Cb 0.00 -0.69 0.02 0.00 -1.15 0.00 0.00 33.47 31.65 1q3x s TRP 477 CO 0.00 0.09 -0.09 0.08 0.02 0.00 0.00 176.95 177.05 1q3x s VAL 478 N -1.86 1.02 -0.09 4.03 1.01 0.59 -0.59 120.40 124.50 1q3x s VAL 478 Ca 0.04 -0.34 -0.21 0.00 0.00 0.00 0.00 61.98 61.47 1q3x s VAL 478 Cb -0.06 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1q3x s VAL 478 CO 0.02 0.35 0.60 -0.22 0.00 0.00 0.00 175.10 175.86 1q3x s LEU 479 N 1.26 4.29 0.00 3.92 2.96 0.89 -0.91 118.68 131.09 1q3x s LEU 479 Ca -0.04 1.02 -0.01 0.00 -0.22 0.00 0.00 54.13 54.88 1q3x s LEU 479 Cb -0.14 -2.91 0.00 0.00 0.50 0.00 0.00 46.19 43.64 1q3x s LEU 479 CO -0.03 -0.07 0.18 1.07 -1.32 0.00 0.00 176.35 176.17 1q3x n THR 480 N 3.77 0.00 -3.27 3.68 5.66 -0.84 -0.25 114.28 123.03 1q3x n THR 480 Ca -0.04 -0.62 -0.37 0.00 -3.05 0.00 0.00 64.05 59.97 1q3x n THR 480 Cb 0.51 0.39 -0.06 0.00 -1.55 0.00 0.00 70.33 69.62 1q3x n THR 480 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1q3x s ALA 481 N -1.97 3.56 0.22 1.79 0.00 -1.26 -1.37 121.76 122.72 1q3x s ALA 481 Ca 0.10 0.01 -0.09 0.00 0.00 0.00 0.00 51.96 51.98 1q3x s ALA 481 Cb -0.00 -2.64 0.20 0.00 0.00 0.00 0.00 23.12 20.68 1q3x s ALA 481 CO 0.07 0.40 1.87 0.00 0.00 0.00 0.00 175.76 178.10 1q3x h ALA 482 N 4.08 0.99 0.00 0.00 0.00 -1.70 -2.57 119.26 120.05 1q3x h ALA 482 Ca -0.49 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 1q3x h ALA 482 Cb 1.20 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1q3x h ALA 482 CO 0.64 0.31 -0.11 1.12 0.00 0.00 0.00 179.25 181.21 1q3x h HIS 483 N 0.96 0.00 0.00 0.00 2.07 -1.92 0.39 115.15 116.64 1q3x h HIS 483 Ca 0.30 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.74 1q3x h HIS 483 Cb -0.02 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.95 1q3x h HIS 483 CO -0.03 0.11 -0.37 0.00 -3.07 0.00 0.00 177.93 174.58 1q3x h ALA 484 N 1.89 0.99 0.00 6.11 0.00 -1.84 -3.34 119.26 123.07 1q3x h ALA 484 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1q3x h ALA 484 Cb 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1q3x h ALA 484 CO 0.01 0.46 0.00 1.33 0.00 0.00 0.00 179.25 181.05 1q3x n VAL 485 N -3.52 0.00 -0.07 0.00 0.24 -0.90 -4.83 118.33 109.25 1q3x n VAL 485 Ca -0.00 -0.37 -0.07 0.00 -2.04 0.00 0.00 64.34 61.85 1q3x n VAL 485 Cb 0.51 1.25 -0.01 0.00 -1.47 0.00 0.00 33.84 34.12 1q3x n VAL 485 CO 0.00 0.00 0.00 0.22 -2.14 0.00 0.00 176.83 174.91 1q3x h TYR 486 N 0.00 -0.08 -0.55 6.34 3.20 -1.06 -1.30 116.97 123.52 1q3x h TYR 486 Ca 0.00 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.85 1q3x h TYR 486 Cb 0.12 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 1q3x h TYR 486 CO 0.00 -0.08 0.18 1.49 -1.64 0.00 0.00 178.16 178.11 1q3x h GLU 487 N 0.04 0.85 -0.48 1.82 4.81 -1.86 -2.23 114.58 117.53 1q3x h GLU 487 Ca 0.13 -0.18 -0.12 0.00 -0.13 0.00 0.00 59.36 59.06 1q3x h GLU 487 Cb 0.19 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1q3x h GLU 487 CO -0.25 0.77 -0.16 1.96 -0.73 0.00 0.00 179.01 180.59 1q3x h GLN 488 N 0.76 0.95 -0.48 1.92 4.20 -1.84 -2.20 115.11 118.41 1q3x h GLN 488 Ca 0.18 -0.39 -0.04 0.00 0.06 0.00 0.00 58.65 58.46 1q3x h GLN 488 Cb 0.27 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 1q3x h GLN 488 CO -0.01 1.05 0.14 1.57 -0.67 0.00 0.00 178.83 180.92 1q3x h LYS 489 N 0.80 0.76 -0.09 1.46 2.10 -1.12 -2.16 116.57 118.32 1q3x h LYS 489 Ca 0.11 -0.17 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 1q3x h LYS 489 Cb 0.73 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 31.96 1q3x h LYS 489 CO 0.06 0.72 0.00 0.72 -2.00 0.00 0.00 179.45 178.95 1q3x n HIS 490 N -4.51 0.12 0.15 0.07 8.25 -0.85 -1.15 115.22 117.29 1q3x n HIS 490 Ca 0.01 -0.06 0.10 0.00 -0.26 0.00 0.00 57.72 57.51 1q3x n HIS 490 Cb 0.20 0.00 0.19 0.00 1.12 0.00 0.00 29.99 31.50 1q3x n HIS 490 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1q3x n ASP 491 N -0.27 3.18 -3.48 0.41 9.92 -0.84 -4.97 116.55 120.50 1q3x n ASP 491 Ca 0.11 -1.92 -0.26 0.00 -0.53 0.00 0.00 54.79 52.19 1q3x n ASP 491 Cb 0.14 -0.23 0.01 0.00 -0.64 0.00 0.00 41.12 40.40 1q3x n ASP 491 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1q3x n ALA 492 N 1.17 -1.12 -3.02 2.24 0.00 -0.30 -4.96 120.51 114.52 1q3x n ALA 492 Ca 0.16 0.17 -0.34 0.00 0.00 0.00 0.00 53.44 53.43 1q3x n ALA 492 Cb 0.52 -3.63 -0.12 0.00 0.00 0.00 0.00 19.45 16.22 1q3x n ALA 492 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1q3x s SER 493 N -2.92 4.90 0.36 0.00 0.01 -0.94 -5.07 113.70 110.04 1q3x s SER 493 Ca 0.47 -0.15 -0.28 0.00 1.31 0.00 0.00 55.95 57.30 1q3x s SER 493 Cb -0.24 -1.82 -0.11 0.00 0.21 0.00 0.00 66.02 64.06 1q3x s SER 493 CO 0.58 0.11 1.40 0.00 0.41 0.00 0.00 173.24 175.74 1q3x s ALA 494 N 0.72 3.53 0.02 1.44 0.00 -1.26 -4.53 121.76 121.68 1q3x s ALA 494 Ca -0.00 1.42 -0.25 0.00 0.00 0.00 0.00 51.96 53.13 1q3x s ALA 494 Cb -0.14 -3.55 -0.05 0.00 0.00 0.00 0.00 23.12 19.38 1q3x s ALA 494 CO 0.02 -0.86 0.78 -0.51 0.00 0.00 0.00 175.76 175.20 1q3x s LEU 495 N -1.97 4.42 -0.53 0.00 1.43 -1.26 -4.90 118.68 115.87 1q3x s LEU 495 Ca 0.51 1.44 -0.28 0.00 -1.03 0.00 0.00 54.13 54.77 1q3x s LEU 495 Cb -0.43 -3.26 0.03 0.00 0.03 0.00 0.00 46.19 42.56 1q3x s LEU 495 CO 0.58 -0.04 1.11 -0.62 0.23 0.00 0.00 176.35 177.62 1q3x s ASP 496 N 0.21 6.50 -0.13 2.29 -1.08 -1.26 -2.84 116.67 120.36 1q3x s ASP 496 Ca 0.40 0.17 0.01 0.00 -0.52 0.00 0.00 52.55 52.61 1q3x s ASP 496 Cb -0.20 -2.53 -0.01 0.00 -1.46 0.00 0.00 42.92 38.72 1q3x s ASP 496 CO 0.23 -1.33 -0.16 -0.63 0.52 0.00 0.00 175.17 173.81 1q3x s ILE 497 N 4.53 2.76 -0.04 4.11 1.01 -0.83 -1.60 121.20 131.14 1q3x s ILE 497 Ca 0.42 -0.76 0.03 0.00 0.00 0.00 0.00 60.65 60.34 1q3x s ILE 497 Cb -0.08 -2.14 0.00 0.00 0.01 0.00 0.00 42.46 40.25 1q3x s ILE 497 CO 0.27 0.53 -0.12 -0.13 0.00 0.00 0.00 174.94 175.49 1q3x s ARG 498 N 0.45 1.37 0.35 2.79 0.52 0.01 -0.63 118.95 123.82 1q3x s ARG 498 Ca -0.11 -0.41 0.07 0.00 -0.52 0.00 0.00 55.73 54.76 1q3x s ARG 498 Cb -0.16 -1.21 -0.03 0.00 0.52 0.00 0.00 34.95 34.07 1q3x s ARG 498 CO 0.05 0.12 0.27 0.00 0.02 0.00 0.00 175.30 175.76 1q3x s MET 499 N 0.29 1.81 -0.21 3.54 0.23 -0.60 -0.06 119.30 124.30 1q3x s MET 499 Ca -0.06 -2.06 0.00 0.00 -1.03 0.00 0.00 55.69 52.53 1q3x s MET 499 Cb -0.11 0.22 0.00 0.00 -1.53 0.00 0.00 34.83 33.41 1q3x s MET 499 CO 0.02 -0.65 0.00 0.41 -2.03 0.00 0.00 175.02 172.77 1q3x n GLY 500 N -0.68 0.48 3.14 3.16 0.00 -1.26 -0.69 105.19 109.35 1q3x n GLY 500 Ca 0.06 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.70 1q3x n GLY 500 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1q3x s THR 501 N -1.79 1.15 -0.10 2.61 -1.32 -1.26 -4.80 115.64 110.13 1q3x s THR 501 Ca 0.00 -0.87 0.16 0.00 -1.21 0.00 0.00 61.69 59.77 1q3x s THR 501 Cb 0.00 -1.01 -0.18 0.00 -1.51 0.00 0.00 72.50 69.80 1q3x s THR 501 CO 0.00 0.13 0.68 0.18 -2.21 0.00 0.00 174.62 173.40 1q3x n LEU 502 N 2.20 0.73 -4.61 9.08 4.77 -1.26 -4.85 117.00 123.07 1q3x n LEU 502 Ca -0.17 0.33 -0.40 0.00 -0.03 0.00 0.00 56.01 55.75 1q3x n LEU 502 Cb 0.55 0.15 -0.08 0.00 -2.33 0.00 0.00 43.42 41.70 1q3x n LEU 502 CO 0.23 0.25 0.16 -0.54 -1.33 0.00 0.00 177.39 176.16 1q3x s LYS 503 N -2.80 4.00 0.26 3.23 1.02 -1.26 -0.86 119.74 123.33 1q3x s LYS 503 Ca -0.04 0.14 -0.03 0.00 0.02 0.00 0.00 55.97 56.06 1q3x s LYS 503 Cb 0.08 -3.67 0.40 0.00 -0.52 0.00 0.00 37.83 34.12 1q3x s LYS 503 CO 0.82 -0.34 1.88 -0.09 -0.92 0.00 0.00 175.35 176.70 1q3x h ARG 504 N 8.13 1.12 -0.55 1.68 2.43 -1.45 -2.91 114.38 122.83 1q3x h ARG 504 Ca -0.30 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 1q3x h ARG 504 Cb 1.15 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 1q3x h ARG 504 CO 0.68 0.74 0.00 1.28 -1.51 0.00 0.00 179.97 181.17 1q3x n LEU 505 N -4.52 4.42 -4.78 3.80 4.77 -1.26 -4.98 117.00 114.46 1q3x n LEU 505 Ca 0.15 -2.49 -0.37 0.00 -0.03 0.00 0.00 56.01 53.27 1q3x n LEU 505 Cb 0.18 -0.53 -0.04 0.00 -2.33 0.00 0.00 43.42 40.71 1q3x n LEU 505 CO 0.32 0.78 0.75 -0.55 -1.33 0.00 0.00 177.39 177.36 1q3x s SER 506 N -1.07 6.74 0.00 -1.43 0.15 -1.10 -4.94 113.70 112.04 1q3x s SER 506 Ca 0.46 2.10 0.25 0.00 0.70 0.00 0.00 55.95 59.46 1q3x s SER 506 Cb 0.31 -2.59 1.10 0.00 -1.71 0.00 0.00 66.02 63.12 1q3x s SER 506 CO 0.21 -0.51 1.81 -0.81 1.20 0.00 0.00 173.24 175.14 1q3x n PRO 507 N 0.01 0.04 -3.66 5.44 -0.04 -1.26 -4.72 135.00 130.82 1q3x n PRO 507 Ca 0.05 0.07 -0.39 0.00 -0.04 0.00 0.00 63.50 63.18 1q3x n PRO 507 Cb 0.49 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.33 1q3x n PRO 507 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1q3x s HIS 508 N -2.95 3.23 0.15 0.54 3.76 -1.26 -5.04 115.29 113.72 1q3x s HIS 508 Ca 0.13 -1.05 -0.25 0.00 -0.15 0.00 0.00 55.06 53.75 1q3x s HIS 508 Cb 0.17 -2.37 0.06 0.00 1.11 0.00 0.00 32.58 31.54 1q3x s HIS 508 CO 0.45 -0.65 0.90 1.52 -0.85 0.00 0.00 174.74 176.11 1q3x s TYR 509 N 1.51 -0.19 -0.21 1.40 -0.85 -1.26 -4.72 117.35 113.04 1q3x s TYR 509 Ca 0.01 -0.12 -0.21 0.00 -0.52 0.00 0.00 57.07 56.24 1q3x s TYR 509 Cb -0.19 0.63 -0.02 0.00 0.38 0.00 0.00 41.96 42.76 1q3x s TYR 509 CO 0.05 -0.85 0.64 0.99 -1.52 0.00 0.00 175.55 174.86 1q3x s THR 510 N -3.38 5.01 -0.07 -3.49 2.01 0.14 -4.94 115.64 110.91 1q3x s THR 510 Ca 0.11 1.20 -0.20 0.00 0.31 0.00 0.00 61.69 63.11 1q3x s THR 510 Cb -0.02 -3.95 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 1q3x s THR 510 CO 0.01 0.09 0.56 -1.58 -0.69 0.00 0.00 174.62 173.00 1q3x s GLN 511 N 2.04 4.33 0.14 4.92 2.00 -1.26 -1.56 119.66 130.28 1q3x s GLN 511 Ca 0.29 0.63 0.04 0.00 -2.00 0.00 0.00 55.36 54.31 1q3x s GLN 511 Cb -0.16 -3.40 -0.04 0.00 0.80 0.00 0.00 33.01 30.21 1q3x s GLN 511 CO 0.10 0.23 -0.09 0.00 -0.50 0.00 0.00 175.29 175.02 1q3x s ALA 512 N 0.34 1.34 -0.00 1.58 0.00 0.20 -5.02 121.76 120.20 1q3x s ALA 512 Ca 0.30 -1.46 0.02 0.00 0.00 0.00 0.00 51.96 50.82 1q3x s ALA 512 Cb -0.17 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.02 1q3x s ALA 512 CO 0.14 -0.13 -0.07 -1.58 0.00 0.00 0.00 175.76 174.13 1q3x s TRP 513 N -3.39 0.59 0.28 0.00 0.52 -1.26 -1.96 118.94 113.73 1q3x s TRP 513 Ca 0.16 -0.13 -0.29 0.00 0.02 0.00 0.00 56.10 55.86 1q3x s TRP 513 Cb 0.03 -0.38 -0.10 0.00 -1.15 0.00 0.00 33.47 31.88 1q3x s TRP 513 CO -0.01 -0.01 1.14 -1.54 0.02 0.00 0.00 176.95 176.55 1q3x s SER 514 N -0.21 7.18 -0.18 2.95 1.04 -1.13 -1.43 113.70 121.91 1q3x s SER 514 Ca 0.02 2.34 0.12 0.00 0.48 0.00 0.00 55.95 58.91 1q3x s SER 514 Cb -0.03 -2.63 -0.20 0.00 0.10 0.00 0.00 66.02 63.26 1q3x s SER 514 CO -0.00 -0.22 0.00 1.21 0.98 0.00 0.00 173.24 175.21 1q3x n GLU 515 N 1.20 1.03 -3.63 4.02 2.13 0.11 -4.62 120.64 120.87 1q3x n GLU 515 Ca -0.01 0.02 -0.15 0.00 0.66 0.00 0.00 57.16 57.68 1q3x n GLU 515 Cb 0.44 -1.45 -0.07 0.00 0.27 0.00 0.00 31.44 30.63 1q3x n GLU 515 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1q3x s ALA 516 N -2.43 -1.39 -0.13 4.31 0.00 -1.15 -5.00 121.76 115.98 1q3x s ALA 516 Ca -0.13 1.10 0.02 0.00 0.00 0.00 0.00 51.96 52.94 1q3x s ALA 516 Cb 0.06 -0.22 0.02 0.00 0.00 0.00 0.00 23.12 22.98 1q3x s ALA 516 CO 0.67 -0.31 -0.17 0.08 0.00 0.00 0.00 175.76 176.02 1q3x s VAL 517 N -0.85 1.70 -0.29 0.00 1.01 -1.26 -0.91 120.40 119.79 1q3x s VAL 517 Ca -0.09 -0.75 -0.07 0.00 0.00 0.00 0.00 61.98 61.07 1q3x s VAL 517 Cb -0.03 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.81 1q3x s VAL 517 CO 0.06 0.48 0.09 -0.36 0.00 0.00 0.00 175.10 175.37 1q3x s PHE 518 N 1.06 3.15 -0.17 5.22 0.40 0.13 -4.97 117.98 122.79 1q3x s PHE 518 Ca -0.04 -0.85 -0.12 0.00 -0.60 0.00 0.00 56.93 55.32 1q3x s PHE 518 Cb -0.15 -2.27 -0.05 0.00 0.51 0.00 0.00 43.02 41.06 1q3x s PHE 518 CO -0.04 -0.54 0.20 0.42 0.70 0.00 0.00 175.22 175.97 1q3x s ILE 519 N 1.53 5.36 0.21 0.64 1.01 -1.26 -0.79 121.20 127.91 1q3x s ILE 519 Ca 0.03 0.36 -0.32 0.00 0.00 0.00 0.00 60.65 60.72 1q3x s ILE 519 Cb -0.17 -3.54 -0.14 0.00 0.01 0.00 0.00 42.46 38.62 1q3x s ILE 519 CO 0.03 0.43 1.32 1.57 0.00 0.00 0.00 174.94 178.29 1q3x n HIS 520 N 3.42 1.83 1.23 3.97 -0.00 -0.83 -4.82 115.22 120.02 1q3x n HIS 520 Ca -0.14 0.52 0.12 0.00 -0.00 0.00 0.00 57.72 58.22 1q3x n HIS 520 Cb 0.52 -2.39 0.64 0.00 -0.00 0.00 0.00 29.99 28.76 1q3x n HIS 520 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.34 175.49 1q3x n GLU 521 N 1.94 0.42 0.00 1.57 0.00 -1.26 -2.10 120.64 121.21 1q3x n GLU 521 Ca 0.13 0.05 0.12 0.00 0.00 0.00 0.00 57.16 57.46 1q3x n GLU 521 Cb 0.29 -1.50 0.22 0.00 0.00 0.00 0.00 31.44 30.44 1q3x n GLU 521 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1q3x n GLY 522 N 0.77 -0.14 3.74 -1.84 0.00 -1.26 -4.92 105.19 101.55 1q3x n GLY 522 Ca 0.13 -0.53 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 1q3x n GLY 522 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1q3x s TYR 523 N -2.39 3.80 -0.31 1.61 5.04 -0.89 -4.71 117.35 119.50 1q3x s TYR 523 Ca 0.24 1.78 0.01 0.00 -2.44 0.00 0.00 57.07 56.66 1q3x s TYR 523 Cb 0.19 -3.10 0.09 0.00 0.35 0.00 0.00 41.96 39.50 1q3x s TYR 523 CO 0.50 0.05 0.05 0.95 -1.34 0.00 0.00 175.55 175.76 1q3x s THR 524 N -0.43 1.56 0.10 4.34 -4.23 -1.26 -5.00 115.64 110.71 1q3x s THR 524 Ca 0.46 -1.73 -0.36 0.00 -1.18 0.00 0.00 61.69 58.88 1q3x s THR 524 Cb -0.26 -2.09 -0.15 0.00 1.34 0.00 0.00 72.50 71.34 1q3x s THR 524 CO 0.32 -0.52 1.47 1.57 -0.54 0.00 0.00 174.62 176.92 1q3x n HIS 525 N 4.58 1.87 -1.02 3.99 -0.00 -1.26 -1.56 115.22 121.82 1q3x n HIS 525 Ca -0.02 0.46 -0.01 0.00 0.46 0.00 0.00 57.72 58.62 1q3x n HIS 525 Cb 0.42 -2.43 -0.00 0.00 -0.12 0.00 0.00 29.99 27.86 1q3x n HIS 525 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 1q3x n ASP 526 N 3.14 -3.90 -3.22 0.26 8.00 -1.26 -4.92 116.55 114.65 1q3x n ASP 526 Ca 0.18 0.02 -0.24 0.00 0.71 0.00 0.00 54.79 55.46 1q3x n ASP 526 Cb 0.23 -1.47 -0.06 0.00 -0.02 0.00 0.00 41.12 39.80 1q3x n ASP 526 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1q3x n ALA 527 N 1.01 2.91 0.00 2.24 0.00 -0.60 -5.09 120.51 120.98 1q3x n ALA 527 Ca -0.01 -3.82 0.00 0.00 0.00 0.00 0.00 53.44 49.61 1q3x n ALA 527 Cb 0.16 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.76 1q3x n ALA 527 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q3x n GLY 528 N 0.91 -1.90 0.27 0.00 0.00 -1.26 -4.71 105.19 98.50 1q3x n GLY 528 Ca 0.25 -1.51 0.09 0.00 0.00 0.00 0.00 46.02 44.85 1q3x n GLY 528 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1q3x n PHE 529 N -2.37 0.23 -1.85 1.61 3.01 -1.26 -4.69 117.46 112.13 1q3x n PHE 529 Ca 0.00 -0.95 -0.41 0.00 1.01 0.00 0.00 57.45 57.09 1q3x n PHE 529 Cb 0.00 -0.19 -0.02 0.00 -0.01 0.00 0.00 39.48 39.27 1q3x n PHE 529 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1q3x s ASP 530 N -2.59 6.45 -1.31 4.37 2.15 -1.26 -2.14 116.67 122.34 1q3x s ASP 530 Ca 0.33 2.89 -0.02 0.00 0.43 0.00 0.00 52.55 56.18 1q3x s ASP 530 Cb 0.29 -2.64 0.00 0.00 -0.30 0.00 0.00 42.92 40.27 1q3x s ASP 530 CO 0.04 -0.84 0.23 0.59 -0.17 0.00 0.00 175.17 175.02 1q3x n ASN 531 N 1.89 -4.98 -4.47 -0.34 3.02 -1.26 -4.22 115.26 104.89 1q3x n ASN 531 Ca 0.06 -0.11 -0.41 0.00 -0.03 0.00 0.00 54.58 54.09 1q3x n ASN 531 Cb 0.39 -3.97 -0.01 0.00 -0.61 0.00 0.00 39.78 35.58 1q3x n ASN 531 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1q3x n ASP 532 N -1.33 4.53 -3.71 6.41 2.03 -0.91 -4.22 116.55 119.35 1q3x n ASP 532 Ca -0.14 -2.88 -0.14 0.00 0.52 0.00 0.00 54.79 52.15 1q3x n ASP 532 Cb 0.62 -1.73 -0.09 0.00 -0.72 0.00 0.00 41.12 39.21 1q3x n ASP 532 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1q3x s ILE 533 N 5.05 0.03 0.05 5.18 2.07 -1.26 -4.04 121.20 128.29 1q3x s ILE 533 Ca 0.55 -0.28 -0.14 0.00 -1.41 0.00 0.00 60.65 59.37 1q3x s ILE 533 Cb 0.05 -0.67 0.02 0.00 0.13 0.00 0.00 42.46 41.99 1q3x s ILE 533 CO 0.07 -0.15 0.32 0.00 -1.91 0.00 0.00 174.94 173.27 1q3x s ALA 534 N -0.91 -0.72 -0.07 1.50 0.00 -0.47 -1.97 121.76 119.12 1q3x s ALA 534 Ca -0.10 0.01 0.05 0.00 0.00 0.00 0.00 51.96 51.92 1q3x s ALA 534 Cb -0.04 0.35 -0.00 0.00 0.00 0.00 0.00 23.12 23.43 1q3x s ALA 534 CO 0.04 -0.44 -0.22 -0.51 0.00 0.00 0.00 175.76 174.64 1q3x s LEU 535 N -2.14 2.01 -0.20 0.00 1.43 0.03 -1.99 118.68 117.81 1q3x s LEU 535 Ca -0.04 -0.48 -0.06 0.00 -1.03 0.00 0.00 54.13 52.53 1q3x s LEU 535 Cb -0.00 -1.26 -0.03 0.00 0.03 0.00 0.00 46.19 44.93 1q3x s LEU 535 CO -0.04 0.18 0.02 -0.63 0.23 0.00 0.00 176.35 176.11 1q3x s ILE 536 N 0.11 4.13 -0.12 -0.59 1.01 -0.09 0.19 121.20 125.83 1q3x s ILE 536 Ca -0.09 -0.25 -0.20 0.00 0.00 0.00 0.00 60.65 60.11 1q3x s ILE 536 Cb -0.15 -2.87 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 1q3x s ILE 536 CO 0.05 0.42 0.55 -0.75 0.00 0.00 0.00 174.94 175.21 1q3x s LYS 537 N 0.98 4.34 0.31 2.79 2.20 -0.09 -0.30 119.74 129.97 1q3x s LYS 537 Ca 0.02 0.56 -0.17 0.00 -0.36 0.00 0.00 55.97 56.02 1q3x s LYS 537 Cb -0.14 -3.47 -0.09 0.00 -1.51 0.00 0.00 37.83 32.62 1q3x s LYS 537 CO 0.02 0.07 0.77 -0.51 -0.36 0.00 0.00 175.35 175.33 1q3x s LEU 538 N 0.89 4.12 0.07 5.43 1.43 0.28 0.06 118.68 130.96 1q3x s LEU 538 Ca 0.29 1.38 0.24 0.00 -1.03 0.00 0.00 54.13 55.01 1q3x s LEU 538 Cb -0.16 -4.02 0.98 0.00 0.03 0.00 0.00 46.19 43.02 1q3x s LEU 538 CO 0.12 -0.17 1.76 -0.46 0.23 0.00 0.00 176.35 177.84 1q3x n ASN 539 N -0.12 0.24 -3.92 2.29 6.94 -0.52 -4.66 115.26 115.52 1q3x n ASN 539 Ca 0.03 0.53 -0.09 0.00 -0.02 0.00 0.00 54.58 55.03 1q3x n ASN 539 Cb 0.53 -0.59 -0.09 0.00 -2.36 0.00 0.00 39.78 37.26 1q3x n ASN 539 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 1q3x s ASN 540 N -3.45 0.17 0.22 0.53 -0.87 -1.26 -5.04 114.94 105.24 1q3x s ASN 540 Ca 0.11 -0.55 -0.30 0.00 -1.57 0.00 0.00 52.86 50.54 1q3x s ASN 540 Cb 0.14 0.25 -0.10 0.00 -0.02 0.00 0.00 41.25 41.52 1q3x s ASN 540 CO 0.47 -0.55 1.47 -0.54 -2.57 0.00 0.00 177.10 175.38 1q3x s LYS 541 N -2.83 4.26 0.35 -0.60 1.02 -1.26 -4.75 119.74 115.92 1q3x s LYS 541 Ca -0.03 2.31 -0.26 0.00 0.02 0.00 0.00 55.97 58.00 1q3x s LYS 541 Cb 0.00 -3.13 -0.09 0.00 -0.52 0.00 0.00 37.83 34.09 1q3x s LYS 541 CO -0.06 -0.47 1.06 0.08 -0.92 0.00 0.00 175.35 175.04 1q3x s VAL 542 N 0.32 3.68 -0.30 3.17 1.01 0.97 -5.01 120.40 124.24 1q3x s VAL 542 Ca 0.62 1.43 -0.29 0.00 0.00 0.00 0.00 61.98 63.74 1q3x s VAL 542 Cb -0.42 -3.81 0.01 0.00 0.00 0.00 0.00 36.38 32.15 1q3x s VAL 542 CO 0.40 0.15 1.20 0.68 0.00 0.00 0.00 175.10 177.52 1q3x s VAL 543 N -1.47 4.32 -0.22 2.92 -7.23 -1.26 -4.88 120.40 112.58 1q3x s VAL 543 Ca 0.52 1.51 -0.26 0.00 -1.81 0.00 0.00 61.98 61.95 1q3x s VAL 543 Cb -0.25 -4.26 -0.00 0.00 0.56 0.00 0.00 36.38 32.42 1q3x s VAL 543 CO 0.32 -0.45 0.87 -0.63 -0.31 0.00 0.00 175.10 174.91 1q3x s ILE 544 N 3.96 4.81 0.07 -0.62 -1.09 -1.26 -4.82 121.20 122.26 1q3x s ILE 544 Ca 0.51 1.68 0.01 0.00 -2.23 0.00 0.00 60.65 60.62 1q3x s ILE 544 Cb -0.15 -4.16 -0.01 0.00 -1.58 0.00 0.00 42.46 36.56 1q3x s ILE 544 CO 0.19 -0.07 0.07 -0.46 -1.23 0.00 0.00 174.94 173.44 1q3x n ASN 545 N 5.89 -0.18 0.11 3.58 0.23 -0.50 -4.95 115.26 119.45 1q3x n ASN 545 Ca 0.07 -1.48 0.16 0.00 -0.53 0.00 0.00 54.58 52.80 1q3x n ASN 545 Cb 0.47 0.40 0.70 0.00 -2.08 0.00 0.00 39.78 39.28 1q3x n ASN 545 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1q3x h SER 546 N 0.45 0.00 0.50 0.53 0.02 -2.01 -0.80 113.55 112.24 1q3x h SER 546 Ca -0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1q3x h SER 546 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.81 1q3x h SER 546 CO 0.08 0.00 -0.90 0.59 -1.14 0.00 0.00 176.83 175.45 1q3x n ASN 547 N -4.33 0.63 -3.65 3.07 3.02 -1.26 -4.57 115.26 108.16 1q3x n ASN 547 Ca 0.05 -0.18 -0.29 0.00 -0.03 0.00 0.00 54.58 54.12 1q3x n ASN 547 Cb 0.41 0.64 -0.15 0.00 -0.61 0.00 0.00 39.78 40.06 1q3x n ASN 547 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1q3x s ILE 548 N -3.17 0.43 -0.01 2.41 1.01 -0.31 -4.46 121.20 117.10 1q3x s ILE 548 Ca 0.05 -1.01 -0.04 0.00 0.00 0.00 0.00 60.65 59.65 1q3x s ILE 548 Cb 0.15 -1.29 0.00 0.00 0.01 0.00 0.00 42.46 41.33 1q3x s ILE 548 CO 0.78 -0.63 0.09 0.42 0.00 0.00 0.00 174.94 175.59 1q3x s THR 549 N 1.85 0.06 0.71 2.92 -4.23 -1.11 -1.41 115.64 114.42 1q3x s THR 549 Ca 0.08 -0.46 -0.12 0.00 -1.18 0.00 0.00 61.69 60.01 1q3x s THR 549 Cb -0.17 -0.28 0.02 0.00 1.34 0.00 0.00 72.50 73.42 1q3x s THR 549 CO -0.27 -0.25 1.09 -2.16 -0.54 0.00 0.00 174.62 172.48 1q3x s PRO 550 N -0.81 2.63 0.51 3.99 0.04 -1.26 -1.92 135.00 138.18 1q3x s PRO 550 Ca -0.09 1.21 -0.16 0.00 0.04 0.00 0.00 61.00 62.00 1q3x s PRO 550 Cb -0.05 -1.94 -0.08 0.00 0.04 0.00 0.00 34.50 32.47 1q3x s PRO 550 CO 0.00 -1.36 0.97 -1.50 0.04 0.00 0.00 177.00 175.16 1q3x s ILE 551 N -2.70 4.57 0.17 0.56 1.10 -0.50 -1.29 121.20 123.09 1q3x s ILE 551 Ca 0.63 1.15 -0.25 0.00 -0.51 0.00 0.00 60.65 61.66 1q3x s ILE 551 Cb -0.18 -3.73 -0.08 0.00 0.15 0.00 0.00 42.46 38.62 1q3x s ILE 551 CO 0.49 -0.70 0.78 0.00 -2.11 0.00 0.00 174.94 173.40 1q3x s LEU 553 N -1.15 4.13 0.14 0.00 1.43 -1.26 -1.30 118.68 120.67 1q3x s LEU 553 Ca 0.36 2.21 -0.31 0.00 -1.03 0.00 0.00 54.13 55.35 1q3x s LEU 553 Cb -0.23 -4.14 -0.09 0.00 0.03 0.00 0.00 46.19 41.75 1q3x s LEU 553 CO 0.26 -0.66 1.56 -2.16 0.23 0.00 0.00 176.35 175.59 1q3x s PRO 554 N -2.47 4.23 0.97 1.29 0.04 -1.26 -4.85 135.00 132.94 1q3x s PRO 554 Ca 0.59 2.32 -0.14 0.00 0.04 0.00 0.00 61.00 63.80 1q3x s PRO 554 Cb -0.26 -3.26 0.17 0.00 0.04 0.00 0.00 34.50 31.19 1q3x s PRO 554 CO 0.33 -0.61 1.18 1.03 0.04 0.00 0.00 177.00 178.97 1q3x s ARG 555 N 1.45 0.67 0.25 4.56 3.00 -1.26 -4.91 118.95 122.71 1q3x s ARG 555 Ca 0.70 0.04 -0.03 0.00 0.00 0.00 0.00 55.73 56.44 1q3x s ARG 555 Cb -0.42 -1.81 0.41 0.00 0.00 0.00 0.00 34.95 33.13 1q3x s ARG 555 CO 0.31 -2.47 1.83 1.57 0.00 0.00 0.00 175.30 176.54 1q3x h LYS 556 N -1.69 0.87 -0.49 3.54 2.10 -2.01 -1.54 116.57 117.35 1q3x h LYS 556 Ca -0.48 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.12 1q3x h LYS 556 Cb 1.30 -0.20 0.00 0.00 -0.90 0.00 0.00 32.23 32.43 1q3x h LYS 556 CO 0.52 0.58 0.00 0.39 -2.00 0.00 0.00 179.45 178.93 1q3x n GLU 557 N -4.67 2.24 0.33 0.07 4.71 -1.26 -4.29 120.64 117.76 1q3x n GLU 557 Ca 0.14 -1.64 0.22 0.00 -0.01 0.00 0.00 57.16 55.87 1q3x n GLU 557 Cb 0.26 -1.44 1.18 0.00 -1.01 0.00 0.00 31.44 30.43 1q3x n GLU 557 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1q3x h ALA 558 N 3.72 1.00 -0.09 0.62 0.00 -1.63 -1.32 119.26 121.56 1q3x h ALA 558 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1q3x h ALA 558 Cb 0.72 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1q3x h ALA 558 CO 0.05 0.00 0.09 0.93 0.00 0.00 0.00 179.25 180.32 1q3x h GLU 559 N 0.00 0.00 0.00 0.00 4.39 -1.81 -0.93 114.58 116.23 1q3x h GLU 559 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1q3x h GLU 559 Cb 0.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1q3x h GLU 559 CO 0.00 0.00 0.00 0.77 -1.16 0.00 0.00 179.01 178.62 1q3x h SER 560 N 0.00 0.00 -0.33 1.42 0.02 -1.59 -0.46 113.55 112.61 1q3x h SER 560 Ca 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1q3x h SER 560 Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1q3x h SER 560 CO -0.00 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.18 1q3x n PHE 561 N -2.86 0.43 -2.43 3.45 3.01 -0.36 -4.54 117.46 114.16 1q3x n PHE 561 Ca -0.01 -0.28 -0.17 0.00 1.01 0.00 0.00 57.45 57.99 1q3x n PHE 561 Cb 0.14 -0.01 0.02 0.00 -0.01 0.00 0.00 39.48 39.62 1q3x n PHE 561 CO 0.00 0.00 0.00 -1.33 1.01 0.00 0.00 176.76 176.44 1q3x n MET 562 N 1.11 2.76 -3.11 -1.08 2.81 -0.18 -4.71 117.12 114.72 1q3x n MET 562 Ca 0.15 -3.97 -0.23 0.00 -1.81 0.00 0.00 57.70 51.84 1q3x n MET 562 Cb 0.50 -1.96 0.00 0.00 -0.71 0.00 0.00 33.22 31.06 1q3x n MET 562 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1q3x s ARG 563 N -3.54 3.23 0.05 0.03 1.81 -1.23 -4.95 118.95 114.35 1q3x s ARG 563 Ca 0.41 -0.41 -0.38 0.00 -1.72 0.00 0.00 55.73 53.63 1q3x s ARG 563 Cb 0.40 -2.59 -0.18 0.00 -0.45 0.00 0.00 34.95 32.13 1q3x s ARG 563 CO -0.04 -0.12 1.21 2.41 -0.68 0.00 0.00 175.30 178.08 1q3x n THR 564 N -1.98 0.05 -0.31 0.02 -1.04 -1.26 -0.36 114.28 109.39 1q3x n THR 564 Ca -0.01 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1q3x n THR 564 Cb 0.57 -0.47 0.00 0.00 -1.82 0.00 0.00 70.33 68.61 1q3x n THR 564 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1q3x n ASP 565 N 2.08 0.00 -4.77 8.00 8.00 -0.28 -4.93 116.55 124.64 1q3x n ASP 565 Ca 0.19 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.34 1q3x n ASP 565 Cb 0.15 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.25 1q3x n ASP 565 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1q3x s ASP 566 N -3.49 5.66 -0.23 -2.24 1.01 0.51 -4.66 116.67 113.23 1q3x s ASP 566 Ca 0.00 2.16 -0.10 0.00 0.71 0.00 0.00 52.55 55.31 1q3x s ASP 566 Cb 0.00 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.30 1q3x s ASP 566 CO 0.00 -1.26 0.15 -0.63 0.21 0.00 0.00 175.17 173.64 1q3x s ILE 567 N -1.83 5.37 0.41 0.77 -1.09 -1.26 -0.92 121.20 122.65 1q3x s ILE 567 Ca 0.72 0.18 0.07 0.00 -2.23 0.00 0.00 60.65 59.40 1q3x s ILE 567 Cb -0.23 -3.49 -0.07 0.00 -1.58 0.00 0.00 42.46 37.08 1q3x s ILE 567 CO 0.28 0.37 0.09 -0.83 -1.23 0.00 0.00 174.94 173.63 1q3x s GLY 568 N 0.89 2.42 -0.10 6.18 0.00 0.03 -4.67 107.32 112.08 1q3x s GLY 568 Ca 0.08 -2.21 0.01 0.00 0.00 0.00 0.00 44.72 42.60 1q3x s GLY 568 CO 0.03 -2.01 -0.13 -1.59 0.00 0.00 0.00 173.10 169.41 1q3x s THR 569 N -2.65 1.32 -0.15 0.90 2.01 0.37 -0.47 115.64 116.97 1q3x s THR 569 Ca 0.38 -0.53 -0.07 0.00 0.31 0.00 0.00 61.69 61.78 1q3x s THR 569 Cb 0.07 -1.23 -0.04 0.00 0.01 0.00 0.00 72.50 71.31 1q3x s THR 569 CO 0.20 0.41 0.09 0.00 -0.69 0.00 0.00 174.62 174.63 1q3x s ALA 570 N 1.12 3.59 0.08 7.40 0.00 -0.46 -1.26 121.76 132.23 1q3x s ALA 570 Ca -0.05 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 51.26 1q3x s ALA 570 Cb -0.14 -1.93 -0.03 0.00 0.00 0.00 0.00 23.12 21.02 1q3x s ALA 570 CO -0.03 0.36 -0.16 -1.54 0.00 0.00 0.00 175.76 174.39 1q3x s SER 571 N -0.22 1.94 0.00 0.00 1.04 -1.26 -0.83 113.70 114.38 1q3x s SER 571 Ca 0.09 -0.63 0.00 0.00 0.48 0.00 0.00 55.95 55.89 1q3x s SER 571 Cb -0.12 -0.08 0.00 0.00 0.10 0.00 0.00 66.02 65.92 1q3x s SER 571 CO 0.01 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.81 1q3x n GLY 572 N 1.26 -1.01 0.93 7.32 0.00 -0.30 -4.76 105.19 108.62 1q3x n GLY 572 Ca -0.20 -1.13 0.08 0.00 0.00 0.00 0.00 46.02 44.76 1q3x n GLY 572 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1q3x n TRP 573 N -0.39 0.90 -0.98 1.61 8.01 -1.26 -1.42 117.44 123.90 1q3x n TRP 573 Ca 0.00 -0.72 -0.20 0.00 -1.31 0.00 0.00 57.50 55.27 1q3x n TRP 573 Cb 0.00 -0.22 0.16 0.00 -2.01 0.00 0.00 31.31 29.24 1q3x n TRP 573 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1q3x n GLY 574 N 0.04 -2.47 3.70 6.99 0.00 -1.25 -1.44 105.19 110.75 1q3x n GLY 574 Ca 0.19 -1.51 -0.43 0.00 0.00 0.00 0.00 46.02 44.27 1q3x n GLY 574 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1q3x n LEU 575 N 0.00 3.53 0.00 0.99 4.77 -0.08 -2.52 117.00 123.69 1q3x n LEU 575 Ca 0.10 1.20 -0.04 0.00 -0.03 0.00 0.00 56.01 57.25 1q3x n LEU 575 Cb 0.39 -1.48 0.01 0.00 -2.33 0.00 0.00 43.42 40.01 1q3x n LEU 575 CO 0.27 -0.46 0.06 0.35 -1.33 0.00 0.00 177.39 176.28 1q3x n THR 576 N 0.55 0.00 0.29 -5.08 -2.24 -0.73 -0.57 114.28 106.49 1q3x n THR 576 Ca 0.05 -0.35 0.15 0.00 -2.27 0.00 0.00 64.05 61.64 1q3x n THR 576 Cb 0.36 -0.83 0.73 0.00 -2.10 0.00 0.00 70.33 68.49 1q3x n THR 576 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1q3x h GLN 577 N 0.00 0.00 0.00 -0.78 4.15 -1.90 -1.51 115.11 115.08 1q3x h GLN 577 Ca -0.05 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1q3x h GLN 577 Cb 0.22 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.91 1q3x h GLN 577 CO 0.07 0.00 0.00 0.00 -1.93 0.00 0.00 178.83 176.97 1q3x h ARG 578 N 0.00 0.00 0.00 1.69 3.08 -1.96 -3.47 114.38 113.72 1q3x h ARG 578 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1q3x h ARG 578 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1q3x h ARG 578 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1q3x n GLY 579 N 0.32 0.73 3.30 0.04 0.00 -0.57 -5.07 105.19 103.94 1q3x n GLY 579 Ca 0.02 -0.21 -0.21 0.00 0.00 0.00 0.00 46.02 45.61 1q3x n GLY 579 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1q3x s PHE 580 N -2.00 1.69 0.84 1.61 0.40 -1.26 -4.89 117.98 114.36 1q3x s PHE 580 Ca 0.00 -0.48 -0.13 0.00 -0.60 0.00 0.00 56.93 55.71 1q3x s PHE 580 Cb 0.00 -0.87 0.05 0.00 0.51 0.00 0.00 43.02 42.71 1q3x s PHE 580 CO 0.00 0.25 0.84 1.28 0.70 0.00 0.00 175.22 178.29 1q3x n LEU 581 N 0.51 2.29 -4.90 -0.37 4.77 -1.26 -1.78 117.00 116.26 1q3x n LEU 581 Ca -0.15 0.50 -0.31 0.00 -0.03 0.00 0.00 56.01 56.02 1q3x n LEU 581 Cb 0.56 -1.36 -0.05 0.00 -2.33 0.00 0.00 43.42 40.25 1q3x n LEU 581 CO 0.27 -2.57 0.09 0.00 -1.33 0.00 0.00 177.39 173.85 1q3x s ALA 582 N -2.20 3.73 0.00 -1.18 0.00 -0.52 -4.81 121.76 116.77 1q3x s ALA 582 Ca 0.67 -0.52 -0.06 0.00 0.00 0.00 0.00 51.96 52.05 1q3x s ALA 582 Cb -0.28 -2.20 -0.29 0.00 0.00 0.00 0.00 23.12 20.35 1q3x s ALA 582 CO 0.58 0.57 0.85 0.00 0.00 0.00 0.00 175.76 177.76 1q3x h ARG 583 N 2.57 0.31 -6.21 0.00 2.47 -1.95 -3.46 114.38 108.11 1q3x h ARG 583 Ca -0.46 -0.52 -0.65 0.00 -1.26 0.00 0.00 59.98 57.08 1q3x h ARG 583 Cb 1.17 0.19 -0.11 0.00 -1.65 0.00 0.00 29.97 29.58 1q3x h ARG 583 CO 0.71 1.19 -0.63 -0.80 0.56 0.00 0.00 179.97 181.00 1q3x s ASN 584 N -7.11 5.31 0.10 7.04 0.01 -1.26 -1.15 114.94 117.89 1q3x s ASN 584 Ca -0.10 -0.04 -0.33 0.00 -0.71 0.00 0.00 52.86 51.68 1q3x s ASN 584 Cb 0.06 -1.38 -0.13 0.00 0.41 0.00 0.00 41.25 40.21 1q3x s ASN 584 CO 0.86 0.21 1.71 -0.11 -1.51 0.00 0.00 177.10 178.26 1q3x n LEU 585 N 0.76 3.47 -4.67 0.60 7.94 -0.04 -4.78 117.00 120.27 1q3x n LEU 585 Ca -0.11 1.04 -0.24 0.00 -1.11 0.00 0.00 56.01 55.58 1q3x n LEU 585 Cb 0.52 -1.46 -0.08 0.00 0.53 0.00 0.00 43.42 42.94 1q3x n LEU 585 CO 0.40 -0.09 -0.26 -0.04 -1.11 0.00 0.00 177.39 176.29 1q3x s MET 586 N 2.01 2.17 0.07 1.96 -1.94 -0.51 -0.71 119.30 122.34 1q3x s MET 586 Ca 0.82 -1.72 -0.13 0.00 -1.71 0.00 0.00 55.69 52.95 1q3x s MET 586 Cb -0.62 -1.99 0.02 0.00 2.01 0.00 0.00 34.83 34.25 1q3x s MET 586 CO 0.40 0.09 0.29 1.52 -0.01 0.00 0.00 175.02 177.31 1q3x s TYR 587 N -2.51 -0.06 0.00 -0.03 -0.85 -0.05 -1.15 117.35 112.70 1q3x s TYR 587 Ca 0.36 -0.18 -0.02 0.00 -0.52 0.00 0.00 57.07 56.71 1q3x s TYR 587 Cb 0.00 0.08 -0.01 0.00 0.38 0.00 0.00 41.96 42.41 1q3x s TYR 587 CO 0.21 -0.54 0.03 0.14 -1.52 0.00 0.00 175.55 173.86 1q3x s VAL 588 N -3.04 0.07 -0.12 -3.49 -7.23 -0.01 -1.43 120.40 105.15 1q3x s VAL 588 Ca -0.02 -0.54 -0.19 0.00 -1.81 0.00 0.00 61.98 59.43 1q3x s VAL 588 Cb 0.01 -0.23 -0.04 0.00 0.56 0.00 0.00 36.38 36.68 1q3x s VAL 588 CO -0.06 -0.30 0.50 -1.81 -0.31 0.00 0.00 175.10 173.12 1q3x s ASP 589 N -0.91 6.71 0.01 4.85 1.01 -1.26 -1.36 116.67 125.72 1q3x s ASP 589 Ca -0.10 0.84 -0.00 0.00 0.71 0.00 0.00 52.55 54.00 1q3x s ASP 589 Cb -0.06 -2.30 -0.01 0.00 1.01 0.00 0.00 42.92 41.56 1q3x s ASP 589 CO -0.00 -0.01 -0.01 0.27 0.21 0.00 0.00 175.17 175.62 1q3x s ILE 590 N 0.66 0.07 0.24 0.77 -4.36 0.39 -4.95 121.20 114.02 1q3x s ILE 590 Ca 0.27 -0.61 -0.24 0.00 -0.26 0.00 0.00 60.65 59.81 1q3x s ILE 590 Cb -0.15 -0.19 -0.09 0.00 1.25 0.00 0.00 42.46 43.28 1q3x s ILE 590 CO 0.11 -0.33 0.82 -2.16 0.24 0.00 0.00 174.94 173.62 1q3x s PRO 591 N -0.98 4.48 0.28 0.37 0.04 -1.26 -0.79 135.00 137.14 1q3x s PRO 591 Ca -0.11 1.13 -0.30 0.00 0.04 0.00 0.00 61.00 61.77 1q3x s PRO 591 Cb -0.07 -2.98 -0.11 0.00 0.04 0.00 0.00 34.50 31.39 1q3x s PRO 591 CO -0.01 0.41 1.48 0.42 0.04 0.00 0.00 177.00 179.34 1q3x s ILE 592 N -1.44 2.45 -0.09 0.56 1.01 -0.10 -1.67 121.20 121.93 1q3x s ILE 592 Ca 0.43 0.39 -0.03 0.00 0.00 0.00 0.00 60.65 61.43 1q3x s ILE 592 Cb -0.20 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 1q3x s ILE 592 CO 0.24 0.07 0.06 -0.69 0.00 0.00 0.00 174.94 174.62 1q3x s VAL 593 N -0.19 4.80 0.17 2.92 1.01 0.95 -1.12 120.40 128.93 1q3x s VAL 593 Ca 0.59 -0.10 -0.33 0.00 0.00 0.00 0.00 61.98 62.14 1q3x s VAL 593 Cb -0.44 -3.07 -0.15 0.00 0.00 0.00 0.00 36.38 32.72 1q3x s VAL 593 CO 0.47 0.58 1.26 -0.67 0.00 0.00 0.00 175.10 176.74 1q3x n ASP 594 N 1.96 1.73 -0.21 3.32 2.03 -1.26 -4.43 116.55 119.69 1q3x n ASP 594 Ca -0.18 1.13 -0.09 0.00 0.52 0.00 0.00 54.79 56.17 1q3x n ASP 594 Cb 0.54 -1.26 0.02 0.00 -0.72 0.00 0.00 41.12 39.70 1q3x n ASP 594 CO 0.00 0.00 0.00 -0.74 -1.92 0.00 0.00 177.20 174.54 1q3x h HIS 595 N 3.86 1.07 -0.68 -0.67 -0.00 -1.97 -0.59 115.15 116.17 1q3x h HIS 595 Ca -0.44 -0.16 -0.03 0.00 -0.00 0.00 0.00 60.37 59.74 1q3x h HIS 595 Cb 1.33 -0.29 -0.03 0.00 -0.00 0.00 0.00 27.41 28.41 1q3x h HIS 595 CO 0.56 0.93 0.31 0.37 -0.00 0.00 0.00 177.93 180.10 1q3x h GLN 596 N 0.90 0.99 -0.34 5.26 4.15 -1.99 0.11 115.11 124.19 1q3x h GLN 596 Ca 0.18 -0.16 -0.08 0.00 0.77 0.00 0.00 58.65 59.37 1q3x h GLN 596 Cb 0.45 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.95 1q3x h GLN 596 CO 0.02 0.80 -0.11 -0.22 -1.93 0.00 0.00 178.83 177.38 1q3x h LYS 597 N 0.95 0.59 -0.17 1.69 3.64 -1.83 -0.54 116.57 120.89 1q3x h LYS 597 Ca 0.23 -0.18 -0.21 0.00 -1.27 0.00 0.00 60.65 59.22 1q3x h LYS 597 Cb 0.15 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1q3x h LYS 597 CO -0.03 0.70 -0.73 0.00 -2.27 0.00 0.00 179.45 177.12 1q3x h THR 599 N 0.54 0.96 -0.13 0.00 2.02 -0.40 -2.67 112.91 113.22 1q3x h THR 599 Ca -0.04 -0.06 -0.03 0.00 0.77 0.00 0.00 66.41 67.05 1q3x h THR 599 Cb 1.35 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.51 1q3x h THR 599 CO 0.15 0.03 -0.07 0.00 0.37 0.00 0.00 175.52 176.01 1q3x h ALA 600 N 1.13 1.64 0.00 6.16 0.00 -1.13 -1.98 119.26 125.07 1q3x h ALA 600 Ca 0.09 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1q3x h ALA 600 Cb 0.05 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1q3x h ALA 600 CO -0.09 0.26 -0.09 0.00 0.00 0.00 0.00 179.25 179.33 1q3x h ALA 601 N 1.74 1.16 -0.36 0.00 0.00 -1.21 -2.48 119.26 118.11 1q3x h ALA 601 Ca 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1q3x h ALA 601 Cb 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1q3x h ALA 601 CO 0.01 0.12 0.00 0.66 0.00 0.00 0.00 179.25 180.04 1q3x n TYR 602 N -3.43 0.48 -2.34 0.00 4.02 -0.77 -4.74 117.16 110.39 1q3x n TYR 602 Ca -0.01 -0.49 -0.42 0.00 -0.01 0.00 0.00 57.90 56.97 1q3x n TYR 602 Cb 0.25 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.55 1q3x n TYR 602 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 1q3x n GLU 603 N 0.58 3.81 -3.57 -0.72 2.13 -0.94 -4.68 120.64 117.26 1q3x n GLU 603 Ca 0.12 -3.60 -0.08 0.00 0.66 0.00 0.00 57.16 54.27 1q3x n GLU 603 Cb 0.43 -2.86 -0.04 0.00 0.27 0.00 0.00 31.44 29.25 1q3x n GLU 603 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 1q3x s LYS 604 N -0.07 0.54 0.45 5.31 -2.85 -1.26 -5.04 119.74 116.82 1q3x s LYS 604 Ca 0.41 -0.04 -0.24 0.00 -1.00 0.00 0.00 55.97 55.09 1q3x s LYS 604 Cb 0.10 0.25 -0.09 0.00 -2.06 0.00 0.00 37.83 36.04 1q3x s LYS 604 CO 0.00 -0.20 1.22 -0.35 0.10 0.00 0.00 175.35 176.12 1q3x n PRO 605 N 0.28 1.75 -0.62 1.78 -0.04 -1.26 -1.06 135.00 135.84 1q3x n PRO 605 Ca -0.07 0.63 0.07 0.00 -0.04 0.00 0.00 63.50 64.09 1q3x n PRO 605 Cb 0.59 -2.34 0.32 0.00 -0.04 0.00 0.00 33.50 32.02 1q3x n PRO 605 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1q3x n PRO 606 N -0.14 3.70 -2.63 0.54 -0.04 -1.26 -5.10 135.00 130.06 1q3x n PRO 606 Ca 0.08 -2.48 -0.41 0.00 -0.04 0.00 0.00 63.50 60.65 1q3x n PRO 606 Cb 0.41 -1.95 -0.04 0.00 -0.04 0.00 0.00 33.50 31.88 1q3x n PRO 606 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1q3x s TYR 607 N -2.09 3.67 0.61 0.54 1.51 -0.22 -5.03 117.35 116.34 1q3x s TYR 607 Ca 0.44 1.66 -0.18 0.00 -1.01 0.00 0.00 57.07 57.97 1q3x s TYR 607 Cb 0.30 -3.17 -0.03 0.00 -0.11 0.00 0.00 41.96 38.95 1q3x s TYR 607 CO 0.17 -0.24 1.18 -1.25 -1.11 0.00 0.00 175.55 174.31 1q3x s PRO 608 N 0.37 2.94 0.29 -1.71 0.04 -1.26 -4.51 135.00 131.15 1q3x s PRO 608 Ca 0.51 1.73 -0.28 0.00 0.04 0.00 0.00 61.00 63.00 1q3x s PRO 608 Cb -0.25 -1.94 -0.14 0.00 0.04 0.00 0.00 34.50 32.22 1q3x s PRO 608 CO 0.30 -1.21 1.06 2.89 0.04 0.00 0.00 177.00 180.08 1q3x n ARG 609 N -1.75 1.47 -3.36 4.56 0.00 -1.26 -2.90 116.66 113.42 1q3x n ARG 609 Ca 0.13 0.52 -0.19 0.00 -0.00 0.00 0.00 57.85 58.31 1q3x n ARG 609 Cb 0.50 -1.93 0.06 0.00 -0.00 0.00 0.00 32.46 31.10 1q3x n ARG 609 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1q3x n GLY 610 N 1.21 -0.22 0.16 2.89 0.00 -1.26 -4.93 105.19 103.03 1q3x n GLY 610 Ca 0.09 0.05 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 1q3x n GLY 610 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1q3x h SER 611 N -2.13 0.41 -3.63 1.61 0.02 -1.86 -3.41 113.55 104.56 1q3x h SER 611 Ca -0.45 -0.29 -0.62 0.00 -0.84 0.00 0.00 61.79 59.60 1q3x h SER 611 Cb 1.29 -0.12 -0.13 0.00 0.14 0.00 0.00 62.40 63.57 1q3x h SER 611 CO 0.44 1.04 -0.12 -0.69 -1.14 0.00 0.00 176.83 176.36 1q3x s VAL 612 N -3.48 5.12 0.48 2.27 1.01 -1.26 -4.75 120.40 119.78 1q3x s VAL 612 Ca -0.05 0.74 0.04 0.00 0.00 0.00 0.00 61.98 62.72 1q3x s VAL 612 Cb 0.10 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 1q3x s VAL 612 CO 0.84 0.13 0.10 0.42 0.00 0.00 0.00 175.10 176.59 1q3x s THR 613 N 2.14 1.63 -0.97 3.92 -4.23 -1.26 -4.98 115.64 111.90 1q3x s THR 613 Ca 0.19 -1.86 0.11 0.00 -1.18 0.00 0.00 61.69 58.95 1q3x s THR 613 Cb -0.16 -2.49 0.09 0.00 1.34 0.00 0.00 72.50 71.29 1q3x s THR 613 CO 0.09 0.00 1.35 0.00 -0.54 0.00 0.00 174.62 175.53 1q3x n ALA 614 N -1.28 1.48 -0.35 3.99 0.00 -1.26 -1.84 120.51 121.24 1q3x n ALA 614 Ca -0.10 -0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.36 1q3x n ALA 614 Cb 0.66 -1.18 0.29 0.00 0.00 0.00 0.00 19.45 19.22 1q3x n ALA 614 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1q3x n ASN 615 N -1.54 4.36 -4.07 0.00 3.02 -1.26 -4.91 115.26 110.86 1q3x n ASN 615 Ca 0.02 -2.67 -0.14 0.00 -0.03 0.00 0.00 54.58 51.76 1q3x n ASN 615 Cb 0.12 -0.64 -0.12 0.00 -0.61 0.00 0.00 39.78 38.54 1q3x n ASN 615 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1q3x s MET 616 N -2.26 0.57 0.23 3.52 -1.94 -0.77 -0.90 119.30 117.75 1q3x s MET 616 Ca 0.39 -0.73 0.10 0.00 -1.71 0.00 0.00 55.69 53.74 1q3x s MET 616 Cb 0.30 -0.39 -0.05 0.00 2.01 0.00 0.00 34.83 36.70 1q3x s MET 616 CO 0.11 0.08 -0.18 -0.48 -0.01 0.00 0.00 175.02 174.54 1q3x s LEU 617 N -1.46 2.54 0.14 -0.03 2.34 0.59 -4.76 118.68 118.05 1q3x s LEU 617 Ca -0.08 -0.98 0.11 0.00 0.06 0.00 0.00 54.13 53.24 1q3x s LEU 617 Cb -0.09 -0.92 -0.04 0.00 -0.56 0.00 0.00 46.19 44.58 1q3x s LEU 617 CO 0.01 -0.03 -0.26 0.00 -1.06 0.00 0.00 176.35 175.00 1q3x s ALA 619 N -1.19 -1.05 0.00 0.00 0.00 -0.66 -0.04 121.76 118.82 1q3x s ALA 619 Ca 0.16 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.34 1q3x s ALA 619 Cb -0.10 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.31 1q3x s ALA 619 CO 0.07 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.03 1q3x n GLY 620 N 2.96 -0.71 3.76 0.00 0.00 -0.67 -2.08 105.19 108.45 1q3x n GLY 620 Ca -0.14 -1.55 -0.24 0.00 0.00 0.00 0.00 46.02 44.08 1q3x n GLY 620 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1q3x s LEU 621 N 0.00 3.62 0.51 0.99 1.43 -1.26 -4.44 118.68 119.53 1q3x s LEU 621 Ca 0.00 -0.30 0.21 0.00 -1.03 0.00 0.00 54.13 53.01 1q3x s LEU 621 Cb 0.00 -2.20 1.33 0.00 0.03 0.00 0.00 46.19 45.35 1q3x s LEU 621 CO 0.00 0.03 2.10 -0.33 0.23 0.00 0.00 176.35 178.38 1q3x h GLU 622 N 2.12 0.00 0.00 1.70 4.39 -1.97 -2.96 114.58 117.85 1q3x h GLU 622 Ca -0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1q3x h GLU 622 Cb 1.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1q3x h GLU 622 CO 0.61 0.09 -0.64 0.66 -1.16 0.00 0.00 179.01 178.57 1q3x h SER 623 N 0.00 0.00 0.00 1.42 4.64 -1.93 -0.76 113.55 116.92 1q3x h SER 623 Ca -0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1q3x h SER 623 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1q3x h SER 623 CO 0.01 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 1q3x n GLY 624 N 1.17 0.82 0.33 -0.77 0.00 -1.12 -3.66 105.19 101.96 1q3x n GLY 624 Ca 0.02 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.24 1q3x n GLY 624 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1q3x h GLY 625 N 0.00 0.00 -6.26 -0.02 0.00 -1.85 -3.38 103.07 91.56 1q3x h GLY 625 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.97 1q3x h GLY 625 CO 0.00 0.00 -0.75 0.54 0.00 0.00 0.00 176.54 176.33 1q3x s LYS 626 N -4.28 0.46 0.09 4.80 1.02 -1.26 -3.90 119.74 116.67 1q3x s LYS 626 Ca -0.05 0.00 -0.26 0.00 0.02 0.00 0.00 55.97 55.68 1q3x s LYS 626 Cb 0.13 -0.57 0.08 0.00 -0.52 0.00 0.00 37.83 36.95 1q3x s LYS 626 CO 0.44 -0.10 0.84 0.34 -0.92 0.00 0.00 175.35 175.95 1q3x s ASP 627 N 0.89 -0.34 0.05 2.83 2.15 -0.87 -4.14 116.67 117.23 1q3x s ASP 627 Ca -0.10 -0.16 0.03 0.00 0.43 0.00 0.00 52.55 52.75 1q3x s ASP 627 Cb -0.13 0.48 -0.04 0.00 -0.30 0.00 0.00 42.92 42.93 1q3x s ASP 627 CO -0.01 -0.82 0.02 -0.94 -0.17 0.00 0.00 175.17 173.25 1q3x s SER 628 N -2.70 5.18 0.41 -0.34 1.04 -1.26 -0.47 113.70 115.56 1q3x s SER 628 Ca 0.07 -0.06 0.03 0.00 0.48 0.00 0.00 55.95 56.46 1q3x s SER 628 Cb -0.01 -1.32 -0.01 0.00 0.10 0.00 0.00 66.02 64.77 1q3x s SER 628 CO -0.05 0.22 0.11 0.00 0.98 0.00 0.00 173.24 174.50 1q3x n ARG 630 N -0.94 0.13 0.00 0.00 0.63 -1.26 -0.42 116.66 114.80 1q3x n ARG 630 Ca -0.09 0.05 0.00 0.00 -0.92 0.00 0.00 57.85 56.89 1q3x n ARG 630 Cb 0.58 -1.56 0.00 0.00 0.45 0.00 0.00 32.46 31.93 1q3x n ARG 630 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1q3x n GLY 631 N 1.93 3.34 0.01 5.14 0.00 -1.26 -0.90 105.19 113.45 1q3x n GLY 631 Ca 0.21 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1q3x n GLY 631 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1q3x n ASP 632 N 0.00 0.42 -4.54 1.61 10.43 0.44 -3.90 116.55 121.02 1q3x n ASP 632 Ca 0.00 -0.05 -0.59 0.00 2.57 0.00 0.00 54.79 56.72 1q3x n ASP 632 Cb 0.00 0.07 -0.08 0.00 1.84 0.00 0.00 41.12 42.95 1q3x n ASP 632 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1q3x n SER 633 N -1.56 0.34 0.00 -2.24 7.64 -1.26 -1.68 113.62 114.86 1q3x n SER 633 Ca 0.06 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.09 1q3x n SER 633 Cb 0.35 -0.95 0.00 0.00 -1.01 0.00 0.00 64.21 62.59 1q3x n SER 633 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1q3x n GLY 634 N 1.90 2.42 3.74 0.23 0.00 -0.57 -0.10 105.19 112.80 1q3x n GLY 634 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 1q3x n GLY 634 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1q3x s GLY 635 N -2.18 2.81 -0.11 -0.02 0.00 -0.68 -3.96 107.32 103.18 1q3x s GLY 635 Ca 0.00 1.15 -0.28 0.00 0.00 0.00 0.00 44.72 45.60 1q3x s GLY 635 CO 0.00 1.57 0.92 0.00 0.00 0.00 0.00 173.10 175.60 1q3x s ALA 636 N -1.47 3.41 -0.45 3.20 0.00 -1.26 -0.40 121.76 124.78 1q3x s ALA 636 Ca 0.81 0.27 -0.25 0.00 0.00 0.00 0.00 51.96 52.78 1q3x s ALA 636 Cb -0.36 -3.32 0.03 0.00 0.00 0.00 0.00 23.12 19.47 1q3x s ALA 636 CO 0.39 -0.53 0.92 -1.17 0.00 0.00 0.00 175.76 175.36 1q3x s LEU 637 N 1.84 4.01 0.11 0.00 2.96 0.11 -4.31 118.68 123.40 1q3x s LEU 637 Ca 0.45 0.15 0.03 0.00 -0.22 0.00 0.00 54.13 54.54 1q3x s LEU 637 Cb -0.18 -3.20 -0.04 0.00 0.50 0.00 0.00 46.19 43.28 1q3x s LEU 637 CO 0.17 -1.03 0.17 0.68 -1.32 0.00 0.00 176.35 175.02 1q3x s VAL 638 N 3.72 4.89 0.09 1.68 -7.23 -0.39 -1.35 120.40 121.82 1q3x s VAL 638 Ca 0.37 -0.74 0.04 0.00 -1.81 0.00 0.00 61.98 59.84 1q3x s VAL 638 Cb -0.10 -3.43 -0.03 0.00 0.56 0.00 0.00 36.38 33.37 1q3x s VAL 638 CO 0.26 0.03 -0.11 -0.36 -0.31 0.00 0.00 175.10 174.60 1q3x s PHE 639 N -1.58 1.11 -0.31 2.82 0.40 -0.06 -0.47 117.98 119.88 1q3x s PHE 639 Ca 0.32 -0.60 -0.14 0.00 -0.60 0.00 0.00 56.93 55.91 1q3x s PHE 639 Cb -0.12 -0.61 -0.03 0.00 0.51 0.00 0.00 43.02 42.78 1q3x s PHE 639 CO 0.25 0.02 0.33 -1.17 0.70 0.00 0.00 175.22 175.36 1q3x s LEU 640 N -2.28 4.26 -0.61 -0.37 2.96 -1.26 -0.80 118.68 120.58 1q3x s LEU 640 Ca 0.04 -0.05 -0.27 0.00 -0.22 0.00 0.00 54.13 53.62 1q3x s LEU 640 Cb -0.05 -2.32 0.00 0.00 0.50 0.00 0.00 46.19 44.32 1q3x s LEU 640 CO 0.01 -0.24 1.58 -0.62 -1.32 0.00 0.00 176.35 175.75 1q3x s ASP 641 N 1.71 5.78 0.06 3.68 -1.08 -0.73 -4.86 116.67 121.24 1q3x s ASP 641 Ca 0.12 0.18 0.15 0.00 -0.52 0.00 0.00 52.55 52.48 1q3x s ASP 641 Cb -0.16 -2.54 0.64 0.00 -1.46 0.00 0.00 42.92 39.39 1q3x s ASP 641 CO 0.11 -2.01 1.47 -1.54 0.52 0.00 0.00 175.17 173.72 1q3x n SER 642 N 10.83 0.15 -0.03 -0.34 3.41 -1.26 0.12 113.62 126.49 1q3x n SER 642 Ca 0.14 0.54 -0.22 0.00 -0.26 0.00 0.00 58.87 59.07 1q3x n SER 642 Cb 0.50 -0.57 -0.13 0.00 -0.26 0.00 0.00 64.21 63.75 1q3x n SER 642 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1q3x n GLU 643 N -1.67 0.69 0.16 4.33 -0.58 -1.26 -4.17 120.64 118.14 1q3x n GLU 643 Ca 0.03 0.35 0.11 0.00 -0.42 0.00 0.00 57.16 57.23 1q3x n GLU 643 Cb 0.16 -1.71 0.08 0.00 -0.57 0.00 0.00 31.44 29.39 1q3x n GLU 643 CO 0.00 0.00 0.00 1.79 -0.48 0.00 0.00 177.13 178.44 1q3x h THR 644 N -0.28 0.05 -3.89 2.62 1.35 -1.96 -3.47 112.91 107.32 1q3x h THR 644 Ca -0.41 -1.08 -0.29 0.00 -0.55 0.00 0.00 66.41 64.08 1q3x h THR 644 Cb 1.80 1.78 0.07 0.00 -1.73 0.00 0.00 68.15 70.07 1q3x h THR 644 CO -0.02 0.03 -0.47 -0.62 -0.25 0.00 0.00 175.52 174.19 1q3x n GLU 645 N -2.90 -4.57 -4.72 4.72 1.02 0.12 -5.02 120.64 109.28 1q3x n GLU 645 Ca 0.02 0.64 -0.24 0.00 -0.02 0.00 0.00 57.16 57.55 1q3x n GLU 645 Cb 0.56 -5.00 -0.15 0.00 -0.02 0.00 0.00 31.44 26.83 1q3x n GLU 645 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1q3x s ARG 646 N -5.64 1.33 0.41 3.49 1.81 -1.16 -4.88 118.95 114.31 1q3x s ARG 646 Ca 0.31 -0.69 -0.19 0.00 -1.72 0.00 0.00 55.73 53.44 1q3x s ARG 646 Cb -0.14 -1.32 -0.10 0.00 -0.45 0.00 0.00 34.95 32.94 1q3x s ARG 646 CO 0.39 0.35 0.89 -1.58 -0.68 0.00 0.00 175.30 174.67 1q3x s TRP 647 N -0.53 3.34 0.06 -0.53 0.52 -0.09 -1.77 118.94 119.95 1q3x s TRP 647 Ca 0.06 1.47 -0.02 0.00 0.02 0.00 0.00 56.10 57.64 1q3x s TRP 647 Cb -0.07 -2.75 -0.04 0.00 -1.15 0.00 0.00 33.47 29.46 1q3x s TRP 647 CO 0.00 -0.08 -0.00 -0.59 0.02 0.00 0.00 176.95 176.30 1q3x s PHE 648 N -2.17 0.54 -0.34 -1.98 -0.12 0.02 -3.04 117.98 110.89 1q3x s PHE 648 Ca 0.59 -1.05 -0.19 0.00 -0.05 0.00 0.00 56.93 56.23 1q3x s PHE 648 Cb -0.09 -0.37 -0.01 0.00 -0.63 0.00 0.00 43.02 41.92 1q3x s PHE 648 CO 0.16 -0.41 0.54 0.54 -0.05 0.00 0.00 175.22 176.00 1q3x s VAL 649 N -3.93 5.00 -0.03 -2.49 0.11 -0.42 -0.88 120.40 117.75 1q3x s VAL 649 Ca 0.09 0.46 0.19 0.00 -2.93 0.00 0.00 61.98 59.79 1q3x s VAL 649 Cb 0.08 -3.97 -0.29 0.00 -1.53 0.00 0.00 36.38 30.67 1q3x s VAL 649 CO -0.08 -0.20 0.40 0.61 -3.33 0.00 0.00 175.10 172.49 1q3x n GLY 650 N 4.72 -0.86 3.19 6.54 0.00 -0.45 -4.16 105.19 114.16 1q3x n GLY 650 Ca -0.04 -0.44 -0.08 0.00 0.00 0.00 0.00 46.02 45.46 1q3x n GLY 650 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1q3x s GLY 651 N -4.21 0.31 -0.08 -0.02 0.00 -0.82 -2.26 107.32 100.25 1q3x s GLY 651 Ca -0.07 -0.88 0.03 0.00 0.00 0.00 0.00 44.72 43.81 1q3x s GLY 651 CO 0.78 -0.99 -0.19 -0.42 0.00 0.00 0.00 173.10 172.28 1q3x s ILE 652 N -3.91 1.63 -0.16 0.90 1.01 -1.01 0.08 121.20 119.74 1q3x s ILE 652 Ca 0.09 -0.78 -0.30 0.00 0.00 0.00 0.00 60.65 59.66 1q3x s ILE 652 Cb 0.06 -1.43 -0.07 0.00 0.01 0.00 0.00 42.46 41.02 1q3x s ILE 652 CO -0.08 0.47 2.13 0.52 0.00 0.00 0.00 174.94 177.97 1q3x n VAL 653 N 3.57 0.45 0.02 2.92 0.31 0.46 -1.67 118.33 124.39 1q3x n VAL 653 Ca -0.20 -0.33 -0.01 0.00 -0.01 0.00 0.00 64.34 63.79 1q3x n VAL 653 Cb 0.52 -2.33 -0.00 0.00 -0.91 0.00 0.00 33.84 31.12 1q3x n VAL 653 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1q3x n SER 654 N 10.05 0.73 -3.11 4.52 2.88 -1.13 -1.52 113.62 126.04 1q3x n SER 654 Ca 0.28 0.10 -0.09 0.00 -1.33 0.00 0.00 58.87 57.83 1q3x n SER 654 Cb 0.40 -0.26 0.01 0.00 -0.75 0.00 0.00 64.21 63.61 1q3x n SER 654 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1q3x s TRP 655 N -1.66 0.19 -0.63 0.66 1.48 -0.90 -4.96 118.94 113.12 1q3x s TRP 655 Ca -0.02 -0.78 0.00 0.00 -1.06 0.00 0.00 56.10 54.24 1q3x s TRP 655 Cb 0.00 0.71 0.00 0.00 -1.16 0.00 0.00 33.47 33.02 1q3x s TRP 655 CO 0.03 -1.47 0.00 0.41 -4.06 0.00 0.00 176.95 171.86 1q3x n GLY 656 N -0.52 -1.22 3.77 3.67 0.00 -1.26 -0.29 105.19 109.34 1q3x n GLY 656 Ca -0.07 -0.84 -0.32 0.00 0.00 0.00 0.00 46.02 44.79 1q3x n GLY 656 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1q3x s SER 657 N -4.00 4.95 0.21 1.61 1.04 -1.26 -4.95 113.70 111.30 1q3x s SER 657 Ca 0.00 1.92 -0.09 0.00 0.48 0.00 0.00 55.95 58.25 1q3x s SER 657 Cb 0.00 -2.54 0.21 0.00 0.10 0.00 0.00 66.02 63.79 1q3x s SER 657 CO 0.00 -1.74 1.84 -0.03 0.98 0.00 0.00 173.24 174.29 1q3x h MET 658 N -0.37 0.80 -6.01 4.02 4.05 -2.01 -3.40 114.93 112.01 1q3x h MET 658 Ca -0.46 -0.05 -0.57 0.00 -0.28 0.00 0.00 59.70 58.35 1q3x h MET 658 Cb 1.24 -0.18 -0.06 0.00 -0.80 0.00 0.00 31.60 31.80 1q3x h MET 658 CO 0.53 0.53 0.28 -0.80 0.23 0.00 0.00 176.91 177.69 1q3x s ASN 659 N -5.71 7.00 0.26 1.39 0.01 -1.26 -4.96 114.94 111.68 1q3x s ASN 659 Ca -0.13 1.22 -0.29 0.00 -0.71 0.00 0.00 52.86 52.95 1q3x s ASN 659 Cb 0.16 -2.45 -0.09 0.00 0.41 0.00 0.00 41.25 39.27 1q3x s ASN 659 CO 0.77 -0.29 0.99 0.00 -1.51 0.00 0.00 177.10 177.06 1q3x n GLY 661 N 1.32 0.15 3.72 0.00 0.00 -1.26 -4.99 105.19 104.12 1q3x n GLY 661 Ca -0.01 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 1q3x n GLY 661 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1q3x s GLU 662 N -4.25 4.50 0.25 1.61 2.12 -1.23 -4.39 118.70 117.32 1q3x s GLU 662 Ca 0.00 1.68 -0.31 0.00 0.36 0.00 0.00 54.97 56.70 1q3x s GLU 662 Cb 0.00 -3.35 -0.12 0.00 0.26 0.00 0.00 34.13 30.92 1q3x s GLU 662 CO 0.00 -0.13 1.64 0.00 -0.54 0.00 0.00 175.26 176.23 1q3x n ALA 663 N 3.56 2.56 -0.93 6.30 0.00 -1.24 -2.42 120.51 128.34 1q3x n ALA 663 Ca 0.07 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1q3x n ALA 663 Cb 0.47 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.45 1q3x n ALA 663 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q3x n GLY 664 N 3.01 0.58 2.96 0.00 0.00 -0.29 -4.89 105.19 106.55 1q3x n GLY 664 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1q3x n GLY 664 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1q3x s GLN 665 N -0.37 2.27 0.55 1.61 -1.52 -1.02 -4.82 119.66 116.36 1q3x s GLN 665 Ca 0.00 -2.89 -0.20 0.00 -1.95 0.00 0.00 55.36 50.32 1q3x s GLN 665 Cb 0.00 -3.43 -0.05 0.00 -0.22 0.00 0.00 33.01 29.31 1q3x s GLN 665 CO 0.00 -1.18 1.21 0.71 -0.25 0.00 0.00 175.29 175.77 1q3x s TYR 666 N -0.71 2.52 0.40 0.91 1.51 -1.26 -4.61 117.35 116.10 1q3x s TYR 666 Ca 0.20 1.51 -0.26 0.00 -1.01 0.00 0.00 57.07 57.50 1q3x s TYR 666 Cb -0.17 -3.47 -0.09 0.00 -0.11 0.00 0.00 41.96 38.11 1q3x s TYR 666 CO -0.06 -2.05 1.35 0.20 -1.11 0.00 0.00 175.55 173.87 1q3x s GLY 667 N -1.49 2.94 -0.13 0.71 0.00 -0.88 -4.64 107.32 103.82 1q3x s GLY 667 Ca 0.73 1.33 0.01 0.00 0.00 0.00 0.00 44.72 46.78 1q3x s GLY 667 CO 0.34 1.94 -0.15 0.14 0.00 0.00 0.00 173.10 175.37 1q3x s VAL 668 N -1.22 2.81 0.03 1.40 1.01 0.60 -1.66 120.40 123.37 1q3x s VAL 668 Ca 0.56 -0.74 0.08 0.00 0.00 0.00 0.00 61.98 61.88 1q3x s VAL 668 Cb -0.40 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.78 1q3x s VAL 668 CO 0.53 0.53 -0.24 -0.31 0.00 0.00 0.00 175.10 175.60 1q3x s TYR 669 N 0.47 2.13 0.19 5.22 1.51 0.17 -2.12 117.35 124.92 1q3x s TYR 669 Ca -0.11 -0.40 -0.32 0.00 -1.01 0.00 0.00 57.07 55.24 1q3x s TYR 669 Cb -0.16 -1.30 -0.11 0.00 -0.11 0.00 0.00 41.96 40.28 1q3x s TYR 669 CO 0.05 0.08 1.65 0.99 -1.11 0.00 0.00 175.55 177.21 1q3x s THR 670 N -0.74 2.31 -0.92 -0.71 2.01 -0.67 -0.30 115.64 116.62 1q3x s THR 670 Ca 0.10 0.22 -0.23 0.00 0.31 0.00 0.00 61.69 62.09 1q3x s THR 670 Cb -0.09 -3.14 0.06 0.00 0.01 0.00 0.00 72.50 69.33 1q3x s THR 670 CO 0.01 0.02 1.34 -0.75 -0.69 0.00 0.00 174.62 174.55 1q3x s LYS 671 N 1.15 3.47 0.31 4.92 2.20 -0.08 -2.42 119.74 129.30 1q3x s LYS 671 Ca 0.72 -0.99 0.03 0.00 -0.36 0.00 0.00 55.97 55.38 1q3x s LYS 671 Cb -0.47 -4.96 0.62 0.00 -1.51 0.00 0.00 37.83 31.51 1q3x s LYS 671 CO 0.32 -2.11 1.87 0.28 -0.36 0.00 0.00 175.35 175.35 1q3x h VAL 672 N 6.44 0.95 0.00 4.02 2.07 -1.77 -1.93 116.25 126.03 1q3x h VAL 672 Ca 0.05 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 1q3x h VAL 672 Cb 1.02 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1q3x h VAL 672 CO 1.34 0.17 -0.04 -0.29 0.02 0.00 0.00 177.57 178.77 1q3x h ILE 673 N 0.93 0.63 0.00 4.57 2.10 -1.87 0.16 117.51 124.02 1q3x h ILE 673 Ca 0.44 -0.16 0.00 0.00 1.08 0.00 0.00 64.86 66.22 1q3x h ILE 673 Cb 0.44 1.10 0.00 0.00 -1.09 0.00 0.00 36.82 37.27 1q3x h ILE 673 CO -0.20 0.04 0.00 0.78 -1.08 0.00 0.00 178.15 177.68 1q3x h ASN 674 N 0.00 0.00 -0.23 2.19 4.21 -1.75 -3.20 115.58 116.81 1q3x h ASN 674 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1q3x h ASN 674 Cb 0.10 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.30 1q3x h ASN 674 CO 0.01 0.00 0.00 -1.22 -1.29 0.00 0.00 177.43 174.93 1q3x n TYR 675 N -2.84 0.38 -0.11 1.19 4.02 0.54 -4.69 117.16 115.66 1q3x n TYR 675 Ca -0.00 -0.57 -0.06 0.00 -0.01 0.00 0.00 57.90 57.26 1q3x n TYR 675 Cb 0.20 -0.07 0.02 0.00 -0.02 0.00 0.00 39.34 39.46 1q3x n TYR 675 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 1q3x h ILE 676 N 1.39 0.85 -0.57 -0.72 1.08 -1.54 0.16 117.51 118.17 1q3x h ILE 676 Ca 0.00 -0.09 0.02 0.00 -0.39 0.00 0.00 64.86 64.41 1q3x h ILE 676 Cb 0.78 0.58 -0.04 0.00 -3.07 0.00 0.00 36.82 35.07 1q3x h ILE 676 CO 0.03 0.05 0.35 -0.65 -0.69 0.00 0.00 178.15 177.23 1q3x h PRO 677 N 0.25 0.68 -0.07 2.37 0.11 -1.87 0.11 132.00 133.58 1q3x h PRO 677 Ca 0.18 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1q3x h PRO 677 Cb 0.18 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.13 1q3x h PRO 677 CO -0.20 0.45 0.04 2.35 -0.21 0.00 0.00 178.00 180.43 1q3x h TRP 678 N 0.70 0.09 -0.24 0.65 7.01 -1.79 0.11 115.95 122.48 1q3x h TRP 678 Ca 0.22 0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.25 1q3x h TRP 678 Cb -0.00 -0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 27.00 1q3x h TRP 678 CO -0.05 0.08 0.08 0.82 -2.79 0.00 0.00 178.44 176.58 1q3x h ILE 679 N 0.07 0.93 -0.41 2.65 2.04 -0.44 -1.89 117.51 120.47 1q3x h ILE 679 Ca 0.03 -0.07 -0.09 0.00 1.00 0.00 0.00 64.86 65.73 1q3x h ILE 679 Cb 0.02 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 1q3x h ILE 679 CO -0.01 0.03 -0.11 -0.33 0.00 0.00 0.00 178.15 177.74 1q3x h GLU 680 N 0.19 0.73 -0.21 2.37 5.08 -0.66 -1.26 114.58 120.82 1q3x h GLU 680 Ca 0.11 -0.23 0.04 0.00 -1.00 0.00 0.00 59.36 58.27 1q3x h GLU 680 Cb 0.08 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 1q3x h GLU 680 CO -0.11 0.81 -0.05 -0.97 -1.00 0.00 0.00 179.01 177.69 1q3x h ASN 681 N 0.66 -0.18 -0.06 1.42 -0.00 -0.49 -1.13 115.58 115.80 1q3x h ASN 681 Ca 0.11 0.06 -0.06 0.00 -0.00 0.00 0.00 56.30 56.41 1q3x h ASN 681 Cb 0.57 0.12 0.00 0.00 -0.00 0.00 0.00 38.32 39.01 1q3x h ASN 681 CO 0.04 -0.06 -0.20 0.40 -0.00 0.00 0.00 177.43 177.60 1q3x h ILE 682 N 0.01 1.43 -0.51 2.57 2.04 -1.14 -2.12 117.51 119.79 1q3x h ILE 682 Ca 0.10 -1.59 -0.04 0.00 1.00 0.00 0.00 64.86 64.33 1q3x h ILE 682 Cb 0.15 2.30 -0.02 0.00 -0.74 0.00 0.00 36.82 38.50 1q3x h ILE 682 CO -0.21 0.45 0.14 0.40 0.00 0.00 0.00 178.15 178.93 1q3x h ILE 683 N -0.26 1.21 0.00 -0.67 2.04 -1.28 -1.69 117.51 116.86 1q3x h ILE 683 Ca -0.01 -0.72 -0.14 0.00 1.00 0.00 0.00 64.86 65.00 1q3x h ILE 683 Cb 0.82 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 1q3x h ILE 683 CO 0.04 0.27 -0.64 0.77 0.00 0.00 0.00 178.15 178.59 1q3x h SER 684 N 0.74 0.00 0.60 1.72 4.64 -1.22 -3.30 113.55 116.73 1q3x h SER 684 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1q3x h SER 684 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1q3x h SER 684 CO -0.01 0.64 -0.81 -0.67 -0.87 0.00 0.00 176.83 175.11 1q3x n ASP 685 N -3.47 0.64 0.00 4.97 2.03 -0.80 -5.09 116.55 114.83 1q3x n ASP 685 Ca 0.00 -0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.22 1q3x n ASP 685 Cb 0.71 0.49 0.00 0.00 -0.72 0.00 0.00 41.12 41.60 1q3x n ASP 685 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77