#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f9t s ASN 386 N 0.00 5.45 -0.02 1.61 0.01 -1.21 -4.84 114.94 115.93 1f9t s ASN 386 Ca 0.00 2.27 0.04 0.00 -0.71 0.00 0.00 52.86 54.46 1f9t s ASN 386 Cb 0.00 -2.59 -0.00 0.00 0.41 0.00 0.00 41.25 39.07 1f9t s ASN 386 CO 0.00 -1.41 -0.13 -0.63 -1.51 0.00 0.00 177.10 173.42 1f9t s ILE 387 N -1.70 1.03 0.04 0.60 1.01 -1.26 -1.59 121.20 119.32 1f9t s ILE 387 Ca 0.75 -0.53 -0.02 0.00 0.00 0.00 0.00 60.65 60.85 1f9t s ILE 387 Cb -0.27 -0.88 -0.03 0.00 0.01 0.00 0.00 42.46 41.30 1f9t s ILE 387 CO 0.30 0.30 0.01 0.00 0.00 0.00 0.00 174.94 175.55 1f9t s ARG 388 N -0.09 0.56 -0.06 2.79 1.70 -0.70 -5.00 118.95 118.16 1f9t s ARG 388 Ca 0.01 -0.99 0.02 0.00 -0.47 0.00 0.00 55.73 54.30 1f9t s ARG 388 Cb -0.07 0.20 0.02 0.00 -0.57 0.00 0.00 34.95 34.53 1f9t s ARG 388 CO 0.00 -0.11 -0.09 0.08 -1.08 0.00 0.00 175.30 174.10 1f9t s VAL 389 N -3.16 0.85 0.13 4.99 1.01 -1.26 -1.43 120.40 121.54 1f9t s VAL 389 Ca -0.00 -0.31 0.10 0.00 0.00 0.00 0.00 61.98 61.77 1f9t s VAL 389 Cb 0.02 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 1f9t s VAL 389 CO -0.07 0.29 -0.22 -0.31 0.00 0.00 0.00 175.10 174.79 1f9t s TYR 390 N 0.79 2.43 0.00 5.22 2.02 -0.35 -1.29 117.35 126.17 1f9t s TYR 390 Ca -0.13 -0.32 0.08 0.00 -0.37 0.00 0.00 57.07 56.33 1f9t s TYR 390 Cb -0.15 -1.29 -0.02 0.00 -0.40 0.00 0.00 41.96 40.10 1f9t s TYR 390 CO 0.02 0.38 -0.24 0.00 -1.57 0.00 0.00 175.55 174.14 1f9t s ARG 392 N -0.90 0.99 -0.30 0.00 3.52 -0.35 -0.02 118.95 121.88 1f9t s ARG 392 Ca 0.11 -0.07 -0.17 0.00 -0.13 0.00 0.00 55.73 55.47 1f9t s ARG 392 Cb -0.10 -1.29 -0.02 0.00 -1.56 0.00 0.00 34.95 31.97 1f9t s ARG 392 CO 0.01 -0.31 0.44 0.42 -0.81 0.00 0.00 175.30 175.05 1f9t s ILE 393 N 1.86 5.10 0.60 4.11 1.01 0.30 -1.77 121.20 132.40 1f9t s ILE 393 Ca 0.05 0.50 -0.12 0.00 0.00 0.00 0.00 60.65 61.07 1f9t s ILE 393 Cb -0.13 -3.82 -0.05 0.00 0.01 0.00 0.00 42.46 38.48 1f9t s ILE 393 CO -0.07 -0.00 1.02 0.00 0.00 0.00 0.00 174.94 175.89 1f9t s ARG 394 N 2.21 3.66 0.55 2.79 1.70 -1.01 -2.79 118.95 126.06 1f9t s ARG 394 Ca 0.17 0.79 -0.21 0.00 -0.47 0.00 0.00 55.73 56.01 1f9t s ARG 394 Cb -0.16 -2.09 -0.05 0.00 -0.57 0.00 0.00 34.95 32.09 1f9t s ARG 394 CO 0.11 -0.52 1.28 -2.14 -1.08 0.00 0.00 175.30 172.96 1f9t s PRO 395 N -4.97 3.16 0.59 3.89 0.02 -1.26 -4.18 135.00 132.24 1f9t s PRO 395 Ca 0.56 2.04 -0.19 0.00 0.02 0.00 0.00 61.00 63.43 1f9t s PRO 395 Cb -0.11 -2.17 -0.04 0.00 0.02 0.00 0.00 34.50 32.20 1f9t s PRO 395 CO 0.50 -1.12 1.20 0.00 -0.33 0.00 0.00 177.00 177.25 1f9t s ALA 396 N -1.42 2.55 -1.09 -1.55 0.00 -1.26 -4.87 121.76 114.13 1f9t s ALA 396 Ca 0.73 1.00 -0.16 0.00 0.00 0.00 0.00 51.96 53.53 1f9t s ALA 396 Cb -0.36 -3.45 0.16 0.00 0.00 0.00 0.00 23.12 19.48 1f9t s ALA 396 CO 0.41 -1.14 1.29 -0.51 0.00 0.00 0.00 175.76 175.81 1f9t s LEU 397 N -4.06 5.14 0.23 0.00 1.43 -1.26 -4.98 118.68 115.18 1f9t s LEU 397 Ca 0.77 -2.64 -0.31 0.00 -1.03 0.00 0.00 54.13 50.92 1f9t s LEU 397 Cb -0.30 -2.39 -0.14 0.00 0.03 0.00 0.00 46.19 43.39 1f9t s LEU 397 CO 0.33 -0.85 1.24 2.29 0.23 0.00 0.00 176.35 179.59 1f9t n LYS 398 N 5.86 1.62 -0.16 1.70 2.85 -1.26 -0.88 118.16 127.89 1f9t n LYS 398 Ca 0.31 0.58 0.00 0.00 -1.05 0.00 0.00 58.31 58.14 1f9t n LYS 398 Cb 0.45 -2.12 0.00 0.00 -0.65 0.00 0.00 35.03 32.71 1f9t n LYS 398 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1f9t n ASN 399 N 1.84 0.00 0.00 -5.58 4.13 -1.26 -4.77 115.26 109.61 1f9t n ASN 399 Ca 0.12 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.38 1f9t n ASN 399 Cb 0.30 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.54 1f9t n ASN 399 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1f9t n LEU 400 N 0.00 0.00 -4.26 3.41 7.94 -0.06 -5.12 117.00 118.91 1f9t n LEU 400 Ca 0.00 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.75 1f9t n LEU 400 Cb 0.00 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 43.85 1f9t n LEU 400 CO 0.00 0.00 -0.21 -1.61 -1.11 0.00 0.00 177.39 174.46 1f9t s GLU 401 N -1.22 1.41 0.18 1.96 2.02 -0.79 -5.03 118.70 117.24 1f9t s GLU 401 Ca 0.00 -1.78 -0.23 0.00 0.02 0.00 0.00 54.97 52.98 1f9t s GLU 401 Cb 0.00 0.12 0.06 0.00 0.10 0.00 0.00 34.13 34.42 1f9t s GLU 401 CO 0.00 -0.44 0.96 0.54 0.02 0.00 0.00 175.26 176.34 1f9t s ASN 402 N -3.27 -0.12 -0.30 -0.19 2.20 -1.26 -4.69 114.94 107.31 1f9t s ASN 402 Ca 0.38 -0.53 0.08 0.00 -0.94 0.00 0.00 52.86 51.85 1f9t s ASN 402 Cb 0.06 0.53 0.46 0.00 -2.00 0.00 0.00 41.25 40.29 1f9t s ASN 402 CO 0.16 -1.00 1.30 -0.24 -2.94 0.00 0.00 177.10 174.38 1f9t n SER 403 N -0.71 3.99 0.07 3.54 2.88 -1.26 -0.87 113.62 121.26 1f9t n SER 403 Ca -0.05 -3.80 0.10 0.00 -1.33 0.00 0.00 58.87 53.78 1f9t n SER 403 Cb 0.60 -0.48 0.56 0.00 -0.75 0.00 0.00 64.21 64.14 1f9t n SER 403 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1f9t h ASP 404 N 1.70 0.21 0.00 -3.46 3.32 -1.96 -3.15 116.42 113.08 1f9t h ASP 404 Ca 0.28 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.32 1f9t h ASP 404 Cb 1.37 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.86 1f9t h ASP 404 CO 0.58 0.14 -0.34 0.35 -1.72 0.00 0.00 179.24 178.26 1f9t n THR 405 N -4.48 2.04 -3.67 0.35 -2.24 -1.26 -5.00 114.28 100.01 1f9t n THR 405 Ca 0.03 -2.85 -0.07 0.00 -2.27 0.00 0.00 64.05 58.90 1f9t n THR 405 Cb 0.22 -0.21 -0.02 0.00 -2.10 0.00 0.00 70.33 68.22 1f9t n THR 405 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1f9t s SER 406 N -3.07 -0.31 -0.06 3.42 1.04 -1.19 -1.95 113.70 111.57 1f9t s SER 406 Ca 0.36 -0.30 -0.03 0.00 0.48 0.00 0.00 55.95 56.46 1f9t s SER 406 Cb 0.34 0.55 0.04 0.00 0.10 0.00 0.00 66.02 67.05 1f9t s SER 406 CO -0.04 -0.98 0.14 -0.22 0.98 0.00 0.00 173.24 173.12 1f9t s LEU 407 N -2.81 0.73 -0.24 2.42 2.96 -0.00 -4.83 118.68 116.90 1f9t s LEU 407 Ca 0.08 0.29 0.02 0.00 -0.22 0.00 0.00 54.13 54.30 1f9t s LEU 407 Cb -0.02 0.34 0.06 0.00 0.50 0.00 0.00 46.19 47.06 1f9t s LEU 407 CO -0.02 -0.15 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.13 1f9t s ILE 408 N 1.18 2.01 -0.18 6.68 1.01 -1.26 -1.07 121.20 129.57 1f9t s ILE 408 Ca -0.09 -1.47 -0.03 0.00 0.00 0.00 0.00 60.65 59.06 1f9t s ILE 408 Cb -0.12 -2.12 -0.02 0.00 0.01 0.00 0.00 42.46 40.21 1f9t s ILE 408 CO -0.06 0.02 -0.06 0.21 0.00 0.00 0.00 174.94 175.05 1f9t s ASN 409 N 1.19 4.46 -0.18 3.58 2.47 0.59 -4.96 114.94 122.10 1f9t s ASN 409 Ca -0.07 -0.27 -0.07 0.00 0.42 0.00 0.00 52.86 52.87 1f9t s ASN 409 Cb -0.19 -1.73 -0.04 0.00 -1.45 0.00 0.00 41.25 37.83 1f9t s ASN 409 CO -0.06 0.09 0.07 -0.69 -3.72 0.00 0.00 177.10 172.79 1f9t s VAL 410 N 0.80 4.85 0.41 -5.21 1.01 -1.26 0.40 120.40 121.40 1f9t s VAL 410 Ca -0.02 -0.01 0.01 0.00 0.00 0.00 0.00 61.98 61.95 1f9t s VAL 410 Cb -0.15 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 33.04 1f9t s VAL 410 CO 0.02 0.47 0.62 0.20 0.00 0.00 0.00 175.10 176.41 1f9t s ASN 411 N 0.23 6.01 0.46 3.32 0.02 0.67 -4.99 114.94 120.67 1f9t s ASN 411 Ca 0.04 0.33 -0.22 0.00 -1.02 0.00 0.00 52.86 52.00 1f9t s ASN 411 Cb -0.12 -1.70 -0.08 0.00 0.02 0.00 0.00 41.25 39.36 1f9t s ASN 411 CO 0.00 -0.54 1.05 -1.61 0.02 0.00 0.00 177.10 176.03 1f9t s GLU 412 N -4.45 3.89 0.26 -0.60 2.02 -1.26 -4.47 118.70 114.09 1f9t s GLU 412 Ca 0.45 1.44 -0.28 0.00 0.02 0.00 0.00 54.97 56.60 1f9t s GLU 412 Cb -0.10 -2.25 -0.15 0.00 0.10 0.00 0.00 34.13 31.73 1f9t s GLU 412 CO 0.37 -0.36 0.90 0.34 0.02 0.00 0.00 175.26 176.52 1f9t n PHE 413 N -0.67 0.85 -3.48 1.61 -0.00 -1.26 -4.62 117.46 109.89 1f9t n PHE 413 Ca 0.08 0.77 -0.42 0.00 -0.00 0.00 0.00 57.45 57.87 1f9t n PHE 413 Cb 0.51 -2.18 -0.07 0.00 -0.00 0.00 0.00 39.48 37.74 1f9t n PHE 413 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1f9t s ASP 414 N -0.65 5.86 0.15 -2.13 2.15 0.37 -4.93 116.67 117.49 1f9t s ASP 414 Ca 0.60 -1.84 0.19 0.00 0.43 0.00 0.00 52.55 51.94 1f9t s ASP 414 Cb -0.76 -2.07 0.82 0.00 -0.30 0.00 0.00 42.92 40.60 1f9t s ASP 414 CO 0.59 -0.74 1.59 0.47 -0.17 0.00 0.00 175.17 176.91 1f9t n ASP 415 N 5.02 0.39 0.05 -0.34 8.00 -1.26 0.21 116.55 128.61 1f9t n ASP 415 Ca -0.10 0.60 -0.01 0.00 0.71 0.00 0.00 54.79 56.00 1f9t n ASP 415 Cb 0.41 -0.68 -0.07 0.00 -0.02 0.00 0.00 41.12 40.76 1f9t n ASP 415 CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 1f9t h ASN 416 N 0.00 0.00 0.00 -2.24 -0.73 -1.93 -3.34 115.58 107.34 1f9t h ASN 416 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1f9t h ASN 416 Cb 0.29 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.88 1f9t h ASN 416 CO 0.00 0.62 -1.62 -1.54 -0.37 0.00 0.00 177.43 174.52 1f9t n SER 417 N -3.00 1.68 0.00 1.15 3.41 -0.89 -5.01 113.62 110.96 1f9t n SER 417 Ca -0.07 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1f9t n SER 417 Cb 0.84 1.63 0.00 0.00 -0.26 0.00 0.00 64.21 66.42 1f9t n SER 417 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f9t n GLY 418 N 1.67 0.76 3.51 5.00 0.00 0.55 -5.03 105.19 111.67 1f9t n GLY 418 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 1f9t n GLY 418 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1f9t s VAL 419 N -2.90 0.58 -0.04 1.61 -7.23 -1.02 -4.90 120.40 106.50 1f9t s VAL 419 Ca 0.00 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.21 1f9t s VAL 419 Cb 0.00 -2.35 -0.00 0.00 0.56 0.00 0.00 36.38 34.59 1f9t s VAL 419 CO 0.00 0.00 -0.17 -1.58 -0.31 0.00 0.00 175.10 173.04 1f9t s GLN 420 N -3.70 1.75 0.27 4.82 0.74 0.16 0.14 119.66 123.84 1f9t s GLN 420 Ca 0.24 -0.60 0.11 0.00 0.05 0.00 0.00 55.36 55.16 1f9t s GLN 420 Cb 0.02 -1.53 -0.05 0.00 1.10 0.00 0.00 33.01 32.56 1f9t s GLN 420 CO 0.15 0.24 -0.11 -1.54 -0.55 0.00 0.00 175.29 173.48 1f9t s SER 421 N 0.05 4.04 0.03 6.67 1.04 -1.26 -0.40 113.70 123.86 1f9t s SER 421 Ca -0.04 -0.85 -0.06 0.00 0.48 0.00 0.00 55.95 55.48 1f9t s SER 421 Cb -0.11 -0.55 -0.01 0.00 0.10 0.00 0.00 66.02 65.44 1f9t s SER 421 CO 0.02 0.02 0.10 0.00 0.98 0.00 0.00 173.24 174.36 1f9t s MET 422 N -3.59 0.54 -0.02 4.02 0.23 -0.33 -0.24 119.30 119.92 1f9t s MET 422 Ca 0.31 -0.64 0.07 0.00 -1.03 0.00 0.00 55.69 54.40 1f9t s MET 422 Cb -0.06 0.22 -0.02 0.00 -1.53 0.00 0.00 34.83 33.45 1f9t s MET 422 CO 0.17 -0.13 -0.22 -1.21 -2.03 0.00 0.00 175.02 171.60 1f9t s GLU 423 N -2.17 1.90 -0.09 3.16 2.02 0.16 -1.42 118.70 122.27 1f9t s GLU 423 Ca -0.09 -0.80 0.03 0.00 0.02 0.00 0.00 54.97 54.13 1f9t s GLU 423 Cb -0.04 -1.79 0.01 0.00 0.10 0.00 0.00 34.13 32.41 1f9t s GLU 423 CO -0.02 0.45 -0.16 0.08 0.02 0.00 0.00 175.26 175.62 1f9t s VAL 424 N -0.44 1.50 -0.01 2.63 1.01 -0.26 -0.30 120.40 124.53 1f9t s VAL 424 Ca 0.06 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.39 1f9t s VAL 424 Cb -0.09 -1.34 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 1f9t s VAL 424 CO -0.00 0.44 -0.10 -0.89 0.00 0.00 0.00 175.10 174.55 1f9t s THR 425 N 0.65 0.79 -0.16 3.92 2.01 -0.23 -1.25 115.64 121.38 1f9t s THR 425 Ca -0.14 -0.42 -0.07 0.00 0.31 0.00 0.00 61.69 61.38 1f9t s THR 425 Cb -0.16 -0.67 -0.04 0.00 0.01 0.00 0.00 72.50 71.64 1f9t s THR 425 CO 0.04 0.23 0.07 -0.54 -0.69 0.00 0.00 174.62 173.72 1f9t s LYS 426 N -0.16 3.74 0.48 4.92 1.02 -1.26 -0.82 119.74 127.65 1f9t s LYS 426 Ca 0.03 -0.31 0.24 0.00 0.02 0.00 0.00 55.97 55.95 1f9t s LYS 426 Cb -0.05 -3.15 1.29 0.00 -0.52 0.00 0.00 37.83 35.40 1f9t s LYS 426 CO -0.00 0.43 1.89 0.97 -0.92 0.00 0.00 175.35 177.72 1f9t h ILE 427 N 4.59 0.64 0.00 2.17 6.09 -1.76 -0.71 117.51 128.53 1f9t h ILE 427 Ca -0.42 -0.06 0.00 0.00 -1.37 0.00 0.00 64.86 63.00 1f9t h ILE 427 Cb 1.18 0.44 0.00 0.00 0.47 0.00 0.00 36.82 38.91 1f9t h ILE 427 CO 0.66 0.03 0.00 0.00 -3.07 0.00 0.00 178.15 175.77 1f9t n GLN 428 N -4.39 0.00 -2.71 2.19 0.00 -1.26 -3.86 117.38 107.34 1f9t n GLN 428 Ca 0.17 0.41 -0.05 0.00 0.00 0.00 0.00 57.00 57.53 1f9t n GLN 428 Cb 0.78 -1.51 0.04 0.00 0.00 0.00 0.00 30.24 29.56 1f9t n GLN 428 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1f9t n ASN 429 N -1.52 -2.33 0.00 2.61 5.15 -0.28 -5.02 115.26 113.87 1f9t n ASN 429 Ca 0.01 -2.36 0.05 0.00 -0.60 0.00 0.00 54.58 51.68 1f9t n ASN 429 Cb 0.06 1.31 0.28 0.00 -0.53 0.00 0.00 39.78 40.90 1f9t n ASN 429 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1f9t n THR 430 N 2.09 0.43 0.25 -0.44 -2.24 -1.15 -1.75 114.28 111.47 1f9t n THR 430 Ca 0.10 0.11 0.12 0.00 -2.27 0.00 0.00 64.05 62.10 1f9t n THR 430 Cb 0.64 -0.94 0.15 0.00 -2.10 0.00 0.00 70.33 68.07 1f9t n THR 430 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1f9t h ALA 431 N 2.55 0.83 -1.96 6.98 0.00 -1.95 -3.42 119.26 122.31 1f9t h ALA 431 Ca 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 54.91 54.19 1f9t h ALA 431 Cb 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 17.79 17.63 1f9t h ALA 431 CO 0.00 0.00 0.02 -1.14 0.00 0.00 0.00 179.25 178.13 1f9t s GLN 432 N -3.24 3.03 -0.26 0.00 0.74 -0.71 -5.02 119.66 114.19 1f9t s GLN 432 Ca 0.05 -1.43 -0.08 0.00 0.05 0.00 0.00 55.36 53.94 1f9t s GLN 432 Cb 0.08 -4.28 -0.04 0.00 1.10 0.00 0.00 33.01 29.87 1f9t s GLN 432 CO 0.70 -1.48 0.11 0.08 -0.55 0.00 0.00 175.29 174.15 1f9t s VAL 433 N 2.37 4.64 -0.30 1.34 1.01 -1.26 -4.50 120.40 123.69 1f9t s VAL 433 Ca 0.09 -0.06 -0.20 0.00 0.00 0.00 0.00 61.98 61.81 1f9t s VAL 433 Cb -0.26 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 32.93 1f9t s VAL 433 CO 0.05 0.31 0.59 -1.00 0.00 0.00 0.00 175.10 175.06 1f9t s HIS 434 N 1.64 3.22 -0.08 5.22 0.09 -0.38 -4.91 115.29 120.09 1f9t s HIS 434 Ca 0.07 0.54 -0.05 0.00 -0.00 0.00 0.00 55.06 55.61 1f9t s HIS 434 Cb -0.15 -2.93 -0.04 0.00 -0.00 0.00 0.00 32.58 29.46 1f9t s HIS 434 CO 0.06 -0.45 0.12 -2.00 -0.00 0.00 0.00 174.74 172.47 1f9t s GLU 435 N 2.53 3.33 0.03 1.40 2.12 -1.26 -1.10 118.70 125.74 1f9t s GLU 435 Ca 0.24 -0.25 0.02 0.00 0.36 0.00 0.00 54.97 55.34 1f9t s GLU 435 Cb -0.15 -3.08 -0.02 0.00 0.26 0.00 0.00 34.13 31.15 1f9t s GLU 435 CO 0.12 0.73 -0.07 -0.06 -0.54 0.00 0.00 175.26 175.44 1f9t s PHE 436 N -1.09 0.62 -0.03 5.30 0.08 -0.51 -4.99 117.98 117.36 1f9t s PHE 436 Ca 0.18 -0.34 0.06 0.00 0.12 0.00 0.00 56.93 56.95 1f9t s PHE 436 Cb -0.12 -0.38 -0.01 0.00 -0.57 0.00 0.00 43.02 41.94 1f9t s PHE 436 CO 0.08 -0.05 -0.21 0.15 -0.10 0.00 0.00 175.22 175.09 1f9t s LYS 437 N -1.03 1.92 0.09 0.44 1.02 -1.26 -1.18 119.74 119.73 1f9t s LYS 437 Ca -0.05 -0.76 -0.01 0.00 0.02 0.00 0.00 55.97 55.17 1f9t s LYS 437 Cb -0.07 -1.75 -0.04 0.00 -0.52 0.00 0.00 37.83 35.45 1f9t s LYS 437 CO 0.00 0.39 0.02 -0.06 -0.92 0.00 0.00 175.35 174.78 1f9t s PHE 438 N -0.30 0.71 0.38 3.18 0.08 0.46 -4.88 117.98 117.61 1f9t s PHE 438 Ca 0.03 -1.16 0.19 0.00 0.12 0.00 0.00 56.93 56.10 1f9t s PHE 438 Cb -0.10 -0.44 1.03 0.00 -0.57 0.00 0.00 43.02 42.93 1f9t s PHE 438 CO 0.01 -0.46 1.94 -0.44 -0.10 0.00 0.00 175.22 176.17 1f9t h ASP 439 N 2.99 0.00 -3.72 1.36 3.32 -1.47 0.47 116.42 119.37 1f9t h ASP 439 Ca -0.35 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.72 1f9t h ASP 439 Cb 1.17 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.49 1f9t h ASP 439 CO 0.62 0.24 0.32 -0.75 -1.72 0.00 0.00 179.24 177.95 1f9t s LYS 440 N -4.22 0.68 -0.12 3.56 2.47 -1.24 -4.52 119.74 116.35 1f9t s LYS 440 Ca -0.03 0.69 0.01 0.00 -1.56 0.00 0.00 55.97 55.08 1f9t s LYS 440 Cb 0.14 0.33 0.02 0.00 -1.46 0.00 0.00 37.83 36.86 1f9t s LYS 440 CO 0.67 -0.11 -0.14 0.42 0.16 0.00 0.00 175.35 176.35 1f9t s ILE 441 N 0.06 1.49 -0.19 5.43 1.01 -1.26 -1.67 121.20 126.07 1f9t s ILE 441 Ca 0.00 -0.62 -0.10 0.00 0.00 0.00 0.00 60.65 59.93 1f9t s ILE 441 Cb -0.04 -1.37 -0.05 0.00 0.01 0.00 0.00 42.46 41.00 1f9t s ILE 441 CO -0.02 0.44 0.15 -0.36 0.00 0.00 0.00 174.94 175.16 1f9t s PHE 442 N 1.15 3.43 0.17 3.97 0.08 0.96 -4.96 117.98 122.78 1f9t s PHE 442 Ca -0.03 0.38 0.03 0.00 0.12 0.00 0.00 56.93 57.43 1f9t s PHE 442 Cb -0.14 -2.17 0.03 0.00 -0.57 0.00 0.00 43.02 40.16 1f9t s PHE 442 CO -0.04 0.32 0.21 -0.40 -0.10 0.00 0.00 175.22 175.20 1f9t n ASP 443 N 3.41 0.79 0.25 1.36 5.68 -1.26 -0.54 116.55 126.24 1f9t n ASP 443 Ca -0.16 -1.47 0.15 0.00 -0.50 0.00 0.00 54.79 52.82 1f9t n ASP 443 Cb 0.52 -0.10 0.83 0.00 -1.14 0.00 0.00 41.12 41.23 1f9t n ASP 443 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1f9t h GLN 444 N 0.00 0.00 -0.00 0.11 4.20 -1.79 -0.29 115.11 117.33 1f9t h GLN 444 Ca -0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1f9t h GLN 444 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1f9t h GLN 444 CO 0.12 0.00 -0.46 1.04 -0.67 0.00 0.00 178.83 178.86 1f9t n GLN 445 N -2.61 0.30 -2.92 1.46 1.13 -1.26 -4.45 117.38 109.03 1f9t n GLN 445 Ca -0.02 -0.19 -0.42 0.00 -1.94 0.00 0.00 57.00 54.44 1f9t n GLN 445 Cb 0.12 -1.50 -0.05 0.00 0.11 0.00 0.00 30.24 28.93 1f9t n GLN 445 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1f9t s ASP 446 N -2.83 6.72 0.72 1.08 1.01 -0.12 -5.04 116.67 118.21 1f9t s ASP 446 Ca 0.15 0.79 -0.06 0.00 0.71 0.00 0.00 52.55 54.15 1f9t s ASP 446 Cb 0.18 -2.42 0.09 0.00 1.01 0.00 0.00 42.92 41.78 1f9t s ASP 446 CO 0.65 -0.59 1.02 0.42 0.21 0.00 0.00 175.17 176.88 1f9t s THR 447 N 2.94 2.27 0.28 -1.27 -4.23 -1.26 -4.86 115.64 109.50 1f9t s THR 447 Ca 0.33 -0.35 -0.03 0.00 -1.18 0.00 0.00 61.69 60.47 1f9t s THR 447 Cb -0.14 -2.92 0.27 0.00 1.34 0.00 0.00 72.50 71.04 1f9t s THR 447 CO 0.11 0.00 1.93 0.78 -0.54 0.00 0.00 174.62 176.90 1f9t h ASN 448 N -0.62 1.03 -0.87 3.99 4.21 -1.96 0.12 115.58 121.46 1f9t h ASN 448 Ca -0.43 -0.01 -0.02 0.00 1.21 0.00 0.00 56.30 57.05 1f9t h ASN 448 Cb 1.30 -0.24 -0.04 0.00 -1.12 0.00 0.00 38.32 38.21 1f9t h ASN 448 CO 0.53 0.71 0.49 0.58 -1.29 0.00 0.00 177.43 178.45 1f9t h VAL 449 N 1.20 1.25 -0.48 2.81 2.07 -1.94 -0.99 116.25 120.16 1f9t h VAL 449 Ca 0.36 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 1f9t h VAL 449 Cb -0.03 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 29.79 1f9t h VAL 449 CO -0.10 0.28 0.19 0.44 0.02 0.00 0.00 177.57 178.40 1f9t h ASP 450 N 1.21 0.67 -0.54 0.57 3.32 -1.55 -2.77 116.42 117.33 1f9t h ASP 450 Ca 0.31 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1f9t h ASP 450 Cb 0.02 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 1f9t h ASP 450 CO -0.05 0.65 0.34 0.58 -1.72 0.00 0.00 179.24 179.04 1f9t h VAL 451 N 0.64 1.15 0.00 -1.35 2.07 -0.46 -2.57 116.25 115.74 1f9t h VAL 451 Ca 0.16 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 1f9t h VAL 451 Cb 0.19 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1f9t h VAL 451 CO -0.01 0.15 -0.14 0.15 0.02 0.00 0.00 177.57 177.74 1f9t h PHE 452 N 0.73 0.00 -0.19 1.57 3.57 -1.02 -1.30 116.94 120.29 1f9t h PHE 452 Ca 0.20 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.75 1f9t h PHE 452 Cb -0.05 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 1f9t h PHE 452 CO -0.03 0.14 0.26 0.87 -2.23 0.00 0.00 178.31 177.32 1f9t h LYS 453 N 0.00 0.00 -0.01 1.11 1.57 -1.18 0.40 116.57 118.46 1f9t h LYS 453 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1f9t h LYS 453 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1f9t h LYS 453 CO 0.02 0.00 -0.69 0.39 -0.57 0.00 0.00 179.45 178.60 1f9t n GLU 454 N -3.59 0.97 -0.07 3.15 -0.58 -0.50 -4.49 120.64 115.52 1f9t n GLU 454 Ca 0.02 -0.44 -0.07 0.00 -0.42 0.00 0.00 57.16 56.26 1f9t n GLU 454 Cb 0.38 -1.41 -0.11 0.00 -0.57 0.00 0.00 31.44 29.73 1f9t n GLU 454 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1f9t n VAL 455 N -0.81 0.93 -0.29 2.62 0.31 0.80 -4.62 118.33 117.26 1f9t n VAL 455 Ca 0.06 -0.56 0.12 0.00 -0.01 0.00 0.00 64.34 63.94 1f9t n VAL 455 Cb 0.36 -0.66 0.28 0.00 -0.91 0.00 0.00 33.84 32.90 1f9t n VAL 455 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1f9t h GLY 456 N 2.60 1.41 2.00 2.92 0.00 -0.62 0.25 103.07 111.63 1f9t h GLY 456 Ca -0.37 -0.13 -0.06 0.00 0.00 0.00 0.00 47.33 46.77 1f9t h GLY 456 CO 0.02 -0.26 -0.30 1.46 0.00 0.00 0.00 176.54 177.45 1f9t h GLN 457 N 0.35 0.00 0.09 4.80 4.20 -1.82 -2.18 115.11 120.55 1f9t h GLN 457 Ca 0.53 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.24 1f9t h GLN 457 Cb 1.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.78 1f9t h GLN 457 CO -0.54 0.30 -0.04 1.25 -0.67 0.00 0.00 178.83 179.13 1f9t h LEU 458 N 0.00 -0.10 -1.33 1.46 5.85 -1.23 -3.30 115.31 116.65 1f9t h LEU 458 Ca -0.00 -0.48 -0.03 0.00 0.84 0.00 0.00 57.88 58.21 1f9t h LEU 458 Cb 0.58 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 1f9t h LEU 458 CO 0.04 0.50 0.14 -0.37 -0.34 0.00 0.00 178.44 178.40 1f9t h VAL 459 N -0.78 1.17 0.00 1.05 -1.51 -1.34 -2.31 116.25 112.53 1f9t h VAL 459 Ca -0.01 -0.56 -0.00 0.00 -1.23 0.00 0.00 66.70 64.89 1f9t h VAL 459 Cb 0.58 0.71 -0.00 0.00 -2.13 0.00 0.00 31.29 30.45 1f9t h VAL 459 CO 0.02 0.21 -0.02 0.06 -1.23 0.00 0.00 177.57 176.61 1f9t h GLN 460 N 0.58 0.00 0.00 5.19 3.07 -1.48 -1.79 115.11 120.68 1f9t h GLN 460 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.88 1f9t h GLN 460 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.73 1f9t h GLN 460 CO -0.01 0.02 0.00 0.66 0.09 0.00 0.00 178.83 179.59 1f9t h SER 461 N 0.00 0.00 0.46 0.06 4.64 -1.49 -1.34 113.55 115.88 1f9t h SER 461 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1f9t h SER 461 Cb 0.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1f9t h SER 461 CO 0.00 0.00 -0.13 0.28 -0.87 0.00 0.00 176.83 176.12 1f9t h SER 462 N 0.00 0.00 1.15 4.97 0.02 -1.46 -1.04 113.55 117.19 1f9t h SER 462 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1f9t h SER 462 Cb 0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1f9t h SER 462 CO 0.00 0.13 0.00 -0.07 -1.14 0.00 0.00 176.83 175.75 1f9t h LEU 463 N 0.00 0.00 -1.50 5.07 3.38 -1.45 -2.02 115.31 118.78 1f9t h LEU 463 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1f9t h LEU 463 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1f9t h LEU 463 CO 0.02 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.02 1f9t n ASP 464 N -2.52 2.30 0.00 -0.43 8.00 -0.42 -4.92 116.55 118.56 1f9t n ASP 464 Ca 0.03 -1.77 0.00 0.00 0.71 0.00 0.00 54.79 53.76 1f9t n ASP 464 Cb 0.34 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 1f9t n ASP 464 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1f9t n GLY 465 N 1.27 0.79 3.82 0.44 0.00 -0.76 -4.91 105.19 105.84 1f9t n GLY 465 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1f9t n GLY 465 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1f9t s TYR 466 N -2.07 3.52 0.24 1.61 1.51 -1.07 -4.46 117.35 116.63 1f9t s TYR 466 Ca 0.00 1.40 -0.07 0.00 -1.01 0.00 0.00 57.07 57.39 1f9t s TYR 466 Cb 0.00 -2.65 -0.06 0.00 -0.11 0.00 0.00 41.96 39.14 1f9t s TYR 466 CO 0.00 0.19 0.52 -0.80 -1.11 0.00 0.00 175.55 174.35 1f9t s ASN 467 N -1.91 6.53 0.00 2.29 0.01 -1.26 -3.89 114.94 116.70 1f9t s ASN 467 Ca 0.50 0.77 0.01 0.00 -0.71 0.00 0.00 52.86 53.43 1f9t s ASN 467 Cb -0.14 -2.17 -0.00 0.00 0.41 0.00 0.00 41.25 39.35 1f9t s ASN 467 CO 0.19 -0.10 -0.03 -0.69 -1.51 0.00 0.00 177.10 174.96 1f9t s VAL 468 N -1.90 0.20 -0.05 1.60 1.01 0.59 -1.09 120.40 120.76 1f9t s VAL 468 Ca 0.45 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.27 1f9t s VAL 468 Cb -0.11 -0.19 0.01 0.00 0.00 0.00 0.00 36.38 36.09 1f9t s VAL 468 CO 0.25 0.01 -0.11 0.00 0.00 0.00 0.00 175.10 175.25 1f9t s ILE 470 N 0.58 0.97 -0.13 0.00 1.01 -0.47 -0.34 121.20 122.81 1f9t s ILE 470 Ca -0.12 -0.37 -0.02 0.00 0.00 0.00 0.00 60.65 60.14 1f9t s ILE 470 Cb -0.14 -1.07 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 1f9t s ILE 470 CO 0.03 0.25 -0.06 -0.36 0.00 0.00 0.00 174.94 174.80 1f9t s PHE 471 N 1.72 2.98 -0.34 3.97 0.08 -0.17 -0.51 117.98 125.70 1f9t s PHE 471 Ca 0.03 -0.27 -0.11 0.00 0.12 0.00 0.00 56.93 56.70 1f9t s PHE 471 Cb -0.14 -1.89 -0.00 0.00 -0.57 0.00 0.00 43.02 40.43 1f9t s PHE 471 CO -0.08 0.03 0.20 0.00 -0.10 0.00 0.00 175.22 175.27 1f9t s ALA 472 N 0.09 3.36 -0.03 5.36 0.00 0.16 0.76 121.76 131.46 1f9t s ALA 472 Ca -0.01 -1.46 0.07 0.00 0.00 0.00 0.00 51.96 50.56 1f9t s ALA 472 Cb -0.14 -2.53 -0.02 0.00 0.00 0.00 0.00 23.12 20.43 1f9t s ALA 472 CO 0.03 -1.03 -0.22 -0.47 0.00 0.00 0.00 175.76 174.07 1f9t s TYR 473 N 1.64 2.45 0.00 0.00 5.04 0.17 -2.25 117.35 124.40 1f9t s TYR 473 Ca 0.05 -0.35 0.00 0.00 -2.44 0.00 0.00 57.07 54.33 1f9t s TYR 473 Cb -0.18 -1.54 0.00 0.00 0.35 0.00 0.00 41.96 40.59 1f9t s TYR 473 CO 0.08 0.03 0.00 0.41 -1.34 0.00 0.00 175.55 174.73 1f9t n GLY 474 N 2.39 2.47 3.78 8.97 0.00 -1.26 0.73 105.19 122.26 1f9t n GLY 474 Ca -0.16 -1.11 -0.32 0.00 0.00 0.00 0.00 46.02 44.43 1f9t n GLY 474 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1f9t s GLN 475 N -2.03 2.65 0.18 1.61 -2.07 -1.26 -2.37 119.66 116.37 1f9t s GLN 475 Ca 0.00 1.27 -0.33 0.00 -1.82 0.00 0.00 55.36 54.48 1f9t s GLN 475 Cb 0.00 -1.94 -0.13 0.00 -1.09 0.00 0.00 33.01 29.85 1f9t s GLN 475 CO 0.00 -1.35 1.67 2.41 -1.32 0.00 0.00 175.29 176.70 1f9t n THR 476 N -2.84 0.02 0.00 3.63 -1.04 -1.26 -1.25 114.28 111.55 1f9t n THR 476 Ca 0.10 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 1f9t n THR 476 Cb 0.53 -1.81 0.00 0.00 -1.82 0.00 0.00 70.33 67.22 1f9t n THR 476 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1f9t n GLY 477 N 3.77 0.15 0.22 3.41 0.00 -1.26 -4.96 105.19 106.51 1f9t n GLY 477 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.30 1f9t n GLY 477 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1f9t h SER 478 N 0.00 0.00 0.00 1.61 4.64 -1.51 -3.47 113.55 114.82 1f9t h SER 478 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1f9t h SER 478 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1f9t h SER 478 CO 0.00 0.11 0.00 0.61 -0.87 0.00 0.00 176.83 176.68 1f9t n GLY 479 N 0.80 1.71 0.22 -0.77 0.00 -1.26 -4.22 105.19 101.67 1f9t n GLY 479 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 1f9t n GLY 479 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1f9t h LYS 480 N 0.19 -0.42 -0.54 1.61 1.57 -1.92 -0.83 116.57 116.24 1f9t h LYS 480 Ca 0.00 0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.71 1f9t h LYS 480 Cb 0.00 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 1f9t h LYS 480 CO 0.00 -0.28 -0.06 1.15 -0.57 0.00 0.00 179.45 179.69 1f9t h THR 481 N -0.44 1.27 -0.60 -0.16 2.02 -1.96 -1.29 112.91 111.75 1f9t h THR 481 Ca -0.02 -1.19 0.03 0.00 0.77 0.00 0.00 66.41 65.99 1f9t h THR 481 Cb 0.37 0.95 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 1f9t h THR 481 CO 0.02 0.42 0.37 0.15 0.37 0.00 0.00 175.52 176.85 1f9t h PHE 482 N 0.86 0.69 -0.60 3.16 3.04 -1.92 0.67 116.94 122.84 1f9t h PHE 482 Ca 0.14 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.10 1f9t h PHE 482 Cb 0.61 -0.22 -0.03 0.00 2.56 0.00 0.00 35.95 38.87 1f9t h PHE 482 CO 0.04 0.40 0.30 1.15 -2.02 0.00 0.00 178.31 178.18 1f9t h THR 483 N 0.73 1.21 0.09 4.41 2.02 -0.90 -1.68 112.91 118.79 1f9t h THR 483 Ca 0.24 -0.57 -0.30 0.00 0.77 0.00 0.00 66.41 66.55 1f9t h THR 483 Cb 0.01 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 1f9t h THR 483 CO -0.10 0.23 -1.52 0.24 0.37 0.00 0.00 175.52 174.75 1f9t h MET 484 N 0.81 0.20 0.00 6.66 2.86 -0.77 0.21 114.93 124.89 1f9t h MET 484 Ca 0.21 -0.34 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 1f9t h MET 484 Cb 0.10 0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.89 1f9t h MET 484 CO -0.03 1.04 0.00 1.28 1.06 0.00 0.00 176.91 180.26 1f9t n LEU 485 N -3.40 1.26 -4.67 1.22 4.77 0.23 -1.05 117.00 115.37 1f9t n LEU 485 Ca -0.15 -1.26 -0.50 0.00 -0.03 0.00 0.00 56.01 54.06 1f9t n LEU 485 Cb 1.03 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 42.07 1f9t n LEU 485 CO 0.49 0.32 1.26 -3.20 -1.33 0.00 0.00 177.39 174.92 1f9t n ASN 486 N -0.27 2.81 -4.60 -1.43 5.15 -0.63 -4.72 115.26 111.56 1f9t n ASN 486 Ca 0.00 1.05 -0.58 0.00 -0.60 0.00 0.00 54.58 54.46 1f9t n ASN 486 Cb 0.26 -1.32 -0.07 0.00 -0.53 0.00 0.00 39.78 38.12 1f9t n ASN 486 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1f9t n PRO 487 N 4.61 0.60 0.00 1.20 -0.02 -1.26 -0.45 135.00 139.68 1f9t n PRO 487 Ca 0.21 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1f9t n PRO 487 Cb 0.24 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1f9t n PRO 487 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1f9t n GLY 488 N 2.67 1.69 0.01 -1.23 0.00 -1.26 -4.58 105.19 102.48 1f9t n GLY 488 Ca 0.22 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1f9t n GLY 488 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1f9t n ASP 489 N 2.26 0.85 -4.52 1.61 5.68 -1.05 -4.33 116.55 117.05 1f9t n ASP 489 Ca 0.00 -0.92 -0.30 0.00 -0.50 0.00 0.00 54.79 53.07 1f9t n ASP 489 Cb 0.00 0.17 0.22 0.00 -1.14 0.00 0.00 41.12 40.37 1f9t n ASP 489 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1f9t n GLY 490 N 0.18 -1.54 0.33 6.12 0.00 0.41 -4.54 105.19 106.14 1f9t n GLY 490 Ca 0.00 -0.99 -0.00 0.00 0.00 0.00 0.00 46.02 45.03 1f9t n GLY 490 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1f9t h ILE 491 N -2.36 1.11 0.25 -0.61 2.04 -0.44 -0.42 117.51 117.07 1f9t h ILE 491 Ca -0.55 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.94 1f9t h ILE 491 Cb 1.31 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 1f9t h ILE 491 CO 0.45 0.19 -0.12 0.40 0.00 0.00 0.00 178.15 179.08 1f9t h ILE 492 N 1.06 0.81 -0.73 -0.67 2.04 -1.35 -0.01 117.51 118.66 1f9t h ILE 492 Ca 0.36 -0.60 0.03 0.00 1.00 0.00 0.00 64.86 65.65 1f9t h ILE 492 Cb 0.07 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 37.25 1f9t h ILE 492 CO -0.14 0.13 0.46 -0.65 0.00 0.00 0.00 178.15 177.95 1f9t h PRO 493 N -0.65 0.88 -0.69 2.37 0.11 -1.72 -1.99 132.00 130.32 1f9t h PRO 493 Ca -0.03 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.00 1f9t h PRO 493 Cb 0.46 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.34 1f9t h PRO 493 CO 0.06 0.58 0.35 0.77 -0.21 0.00 0.00 178.00 179.55 1f9t h SER 494 N 0.91 0.89 -0.16 -2.05 0.02 -1.06 -1.71 113.55 110.38 1f9t h SER 494 Ca 0.29 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1f9t h SER 494 Cb 0.00 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.31 1f9t h SER 494 CO -0.10 0.75 0.10 0.74 -1.14 0.00 0.00 176.83 177.17 1f9t h THR 495 N 0.95 1.08 -0.39 -2.27 2.02 -0.57 0.50 112.91 114.23 1f9t h THR 495 Ca 0.24 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.22 1f9t h THR 495 Cb 0.09 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1f9t h THR 495 CO -0.03 0.07 0.22 0.40 0.37 0.00 0.00 175.52 176.55 1f9t h ILE 496 N 0.18 1.14 -0.46 3.11 2.04 -1.24 0.16 117.51 122.44 1f9t h ILE 496 Ca 0.06 -0.35 0.01 0.00 1.00 0.00 0.00 64.86 65.58 1f9t h ILE 496 Cb 0.03 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1f9t h ILE 496 CO -0.01 0.14 0.30 0.28 0.00 0.00 0.00 178.15 178.86 1f9t h SER 497 N 0.51 0.51 -0.21 1.72 0.02 -1.14 -0.97 113.55 113.99 1f9t h SER 497 Ca 0.14 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1f9t h SER 497 Cb 0.03 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 1f9t h SER 497 CO -0.02 0.37 0.10 -0.74 -1.14 0.00 0.00 176.83 175.39 1f9t h HIS 498 N 0.61 0.31 -0.76 3.45 -0.00 -0.47 -2.15 115.15 116.14 1f9t h HIS 498 Ca 0.17 -0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.53 1f9t h HIS 498 Cb -0.05 -0.09 -0.04 0.00 -0.00 0.00 0.00 27.41 27.22 1f9t h HIS 498 CO -0.05 0.32 0.49 0.82 -0.00 0.00 0.00 177.93 179.52 1f9t h ILE 499 N 0.21 1.20 -0.73 6.26 2.04 -0.50 -1.68 117.51 124.31 1f9t h ILE 499 Ca 0.07 -0.38 0.02 0.00 1.00 0.00 0.00 64.86 65.57 1f9t h ILE 499 Cb 0.13 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.27 1f9t h ILE 499 CO -0.01 0.20 0.47 -0.26 0.00 0.00 0.00 178.15 178.55 1f9t h PHE 500 N 1.03 0.88 -0.71 1.37 -1.00 -0.98 0.11 116.94 117.64 1f9t h PHE 500 Ca 0.28 0.02 -0.04 0.00 2.81 0.00 0.00 57.97 61.03 1f9t h PHE 500 Cb -0.10 -0.29 -0.03 0.00 3.61 0.00 0.00 35.95 39.13 1f9t h PHE 500 CO -0.02 0.53 0.26 -0.91 -1.61 0.00 0.00 178.31 176.56 1f9t h ASN 501 N 0.93 0.98 -0.18 2.17 2.35 -0.87 -1.35 115.58 119.61 1f9t h ASN 501 Ca 0.28 -0.15 -0.16 0.00 -0.55 0.00 0.00 56.30 55.72 1f9t h ASN 501 Cb -0.04 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.07 1f9t h ASN 501 CO -0.09 0.88 -0.47 -0.50 -1.65 0.00 0.00 177.43 175.61 1f9t h TRP 502 N 1.03 0.91 -0.09 1.19 4.06 -0.67 -2.21 115.95 120.18 1f9t h TRP 502 Ca 0.24 -0.30 -0.00 0.00 2.06 0.00 0.00 58.89 60.89 1f9t h TRP 502 Cb 0.22 -0.18 -0.00 0.00 -1.00 0.00 0.00 29.16 28.20 1f9t h TRP 502 CO 0.02 1.07 0.04 0.82 -3.56 0.00 0.00 178.44 176.83 1f9t h ILE 503 N 0.59 1.11 -0.70 1.49 2.04 -0.46 0.17 117.51 121.75 1f9t h ILE 503 Ca 0.03 -0.32 0.01 0.00 1.00 0.00 0.00 64.86 65.58 1f9t h ILE 503 Cb 1.03 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 38.25 1f9t h ILE 503 CO 0.10 0.10 0.46 0.78 0.00 0.00 0.00 178.15 179.59 1f9t h ASN 504 N 0.02 0.81 -0.30 1.72 2.35 -1.23 -2.00 115.58 116.94 1f9t h ASN 504 Ca 0.03 -0.02 -0.11 0.00 -0.55 0.00 0.00 56.30 55.65 1f9t h ASN 504 Cb 0.12 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1f9t h ASN 504 CO -0.00 0.59 -0.24 0.50 -1.65 0.00 0.00 177.43 176.62 1f9t h LYS 505 N 0.95 0.69 0.00 0.81 3.64 -0.93 -3.08 116.57 118.66 1f9t h LYS 505 Ca 0.26 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1f9t h LYS 505 Cb -0.10 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1f9t h LYS 505 CO -0.05 0.96 0.00 -0.07 -2.27 0.00 0.00 179.45 178.01 1f9t h LEU 506 N 0.44 0.00 -1.12 5.20 3.38 -0.17 -2.96 115.31 120.07 1f9t h LEU 506 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1f9t h LEU 506 Cb 0.80 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 1f9t h LEU 506 CO 0.06 0.00 0.55 0.11 0.09 0.00 0.00 178.44 179.25 1f9t h LYS 507 N 0.00 1.14 0.00 1.13 1.57 -1.28 -0.76 116.57 118.37 1f9t h LYS 507 Ca 0.00 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1f9t h LYS 507 Cb 0.35 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1f9t h LYS 507 CO 0.00 0.77 0.00 0.25 -0.57 0.00 0.00 179.45 179.90 1f9t n THR 508 N -4.39 0.00 -0.43 -0.16 -2.24 -1.12 -1.23 114.28 104.72 1f9t n THR 508 Ca 0.10 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.91 1f9t n THR 508 Cb 0.04 -0.54 0.05 0.00 -2.10 0.00 0.00 70.33 67.77 1f9t n THR 508 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1f9t n LYS 509 N -0.75 2.29 -0.75 -0.78 5.02 -0.32 -4.96 118.16 117.91 1f9t n LYS 509 Ca 0.05 -1.85 0.00 0.00 -2.02 0.00 0.00 58.31 54.49 1f9t n LYS 509 Cb 0.02 -1.16 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 1f9t n LYS 509 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1f9t n GLY 510 N -0.81 0.77 3.78 0.72 0.00 -0.36 -4.98 105.19 104.30 1f9t n GLY 510 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1f9t n GLY 510 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1f9t s TRP 511 N -2.85 3.79 -0.20 1.61 0.52 -1.05 -3.59 118.94 117.17 1f9t s TRP 511 Ca 0.00 1.40 0.00 0.00 0.02 0.00 0.00 56.10 57.52 1f9t s TRP 511 Cb 0.00 -2.66 0.05 0.00 -1.15 0.00 0.00 33.47 29.71 1f9t s TRP 511 CO 0.00 0.45 -0.06 0.34 0.02 0.00 0.00 176.95 177.71 1f9t s ASP 512 N -0.69 3.36 -0.04 2.95 2.15 -0.25 -3.86 116.67 120.29 1f9t s ASP 512 Ca 0.33 -0.93 0.01 0.00 0.43 0.00 0.00 52.55 52.39 1f9t s ASP 512 Cb -0.20 -1.06 -0.03 0.00 -0.30 0.00 0.00 42.92 41.33 1f9t s ASP 512 CO 0.21 -0.21 -0.03 -0.31 -0.17 0.00 0.00 175.17 174.67 1f9t s TYR 513 N 1.51 3.03 -0.05 -5.34 2.02 -1.26 -1.27 117.35 115.99 1f9t s TYR 513 Ca -0.02 0.07 0.06 0.00 -0.37 0.00 0.00 57.07 56.81 1f9t s TYR 513 Cb -0.17 -1.70 -0.01 0.00 -0.40 0.00 0.00 41.96 39.68 1f9t s TYR 513 CO -0.07 0.42 -0.24 0.15 -1.57 0.00 0.00 175.55 174.24 1f9t s LYS 514 N -1.18 2.39 -0.10 -0.62 -0.14 0.12 -4.96 119.74 115.24 1f9t s LYS 514 Ca 0.16 -0.86 0.03 0.00 -1.36 0.00 0.00 55.97 53.94 1f9t s LYS 514 Cb -0.11 -2.05 0.00 0.00 -1.68 0.00 0.00 37.83 33.99 1f9t s LYS 514 CO 0.06 0.38 -0.21 0.08 -0.76 0.00 0.00 175.35 174.89 1f9t s VAL 515 N -0.18 1.84 0.06 3.17 1.01 -1.26 -1.15 120.40 123.89 1f9t s VAL 515 Ca -0.02 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.08 1f9t s VAL 515 Cb -0.13 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.61 1f9t s VAL 515 CO 0.03 0.51 -0.06 0.54 0.00 0.00 0.00 175.10 176.12 1f9t s ASN 516 N 0.50 0.76 0.16 3.32 2.20 -1.06 0.11 114.94 120.93 1f9t s ASN 516 Ca -0.16 -0.77 -0.04 0.00 -0.94 0.00 0.00 52.86 50.95 1f9t s ASN 516 Cb -0.17 0.10 -0.03 0.00 -2.00 0.00 0.00 41.25 39.15 1f9t s ASN 516 CO 0.06 -0.38 0.15 0.00 -2.94 0.00 0.00 177.10 173.99 1f9t s GLU 518 N -4.05 0.33 -0.20 0.00 8.01 -0.47 -1.14 118.70 121.18 1f9t s GLU 518 Ca 0.26 -0.61 -0.02 0.00 0.01 0.00 0.00 54.97 54.61 1f9t s GLU 518 Cb 0.06 0.12 0.06 0.00 -4.31 0.00 0.00 34.13 30.06 1f9t s GLU 518 CO 0.04 -0.06 0.02 0.12 0.01 0.00 0.00 175.26 175.39 1f9t s PHE 519 N -1.53 1.32 0.35 1.61 5.36 -1.26 -0.44 117.98 123.40 1f9t s PHE 519 Ca -0.15 -1.05 0.06 0.00 -0.96 0.00 0.00 56.93 54.83 1f9t s PHE 519 Cb -0.09 -1.15 -0.07 0.00 -0.34 0.00 0.00 43.02 41.37 1f9t s PHE 519 CO -0.01 -0.64 0.01 0.96 -1.46 0.00 0.00 175.22 174.08 1f9t s ILE 520 N 1.76 1.63 0.03 3.12 -4.36 -0.49 -1.11 121.20 121.77 1f9t s ILE 520 Ca -0.02 -2.03 0.04 0.00 -0.26 0.00 0.00 60.65 58.38 1f9t s ILE 520 Cb -0.17 -2.82 -0.02 0.00 1.25 0.00 0.00 42.46 40.70 1f9t s ILE 520 CO -0.08 -0.05 -0.11 -0.70 0.24 0.00 0.00 174.94 174.24 1f9t s GLU 521 N -3.78 0.74 -0.25 0.37 2.12 0.14 -0.14 118.70 117.90 1f9t s GLU 521 Ca 0.35 -0.64 -0.01 0.00 0.36 0.00 0.00 54.97 55.03 1f9t s GLU 521 Cb 0.08 -0.68 0.03 0.00 0.26 0.00 0.00 34.13 33.82 1f9t s GLU 521 CO 0.16 0.17 -0.07 0.42 -0.54 0.00 0.00 175.26 175.39 1f9t s ILE 522 N -0.82 2.69 -0.12 -3.70 1.01 0.11 -0.19 121.20 120.18 1f9t s ILE 522 Ca -0.01 -1.18 -0.00 0.00 0.00 0.00 0.00 60.65 59.46 1f9t s ILE 522 Cb -0.07 -2.41 0.02 0.00 0.01 0.00 0.00 42.46 40.01 1f9t s ILE 522 CO 0.01 0.14 -0.09 -0.47 0.00 0.00 0.00 174.94 174.53 1f9t s TYR 523 N 1.27 1.63 -1.43 3.97 5.04 -0.37 -1.47 117.35 125.98 1f9t s TYR 523 Ca -0.02 -0.82 -0.10 0.00 -2.44 0.00 0.00 57.07 53.68 1f9t s TYR 523 Cb -0.17 -1.30 0.04 0.00 0.35 0.00 0.00 41.96 40.88 1f9t s TYR 523 CO -0.05 -0.53 1.06 0.09 -1.34 0.00 0.00 175.55 174.78 1f9t n ASN 524 N 4.81 -5.80 -0.85 4.32 3.02 -1.26 -1.69 115.26 117.81 1f9t n ASN 524 Ca -0.14 -0.60 -0.11 0.00 -0.03 0.00 0.00 54.58 53.70 1f9t n ASN 524 Cb 0.50 -4.59 -0.05 0.00 -0.61 0.00 0.00 39.78 35.03 1f9t n ASN 524 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1f9t n GLU 525 N -4.80 -1.13 -5.02 3.52 -0.58 -1.26 -5.00 120.64 106.37 1f9t n GLU 525 Ca 0.01 0.85 -0.32 0.00 -0.42 0.00 0.00 57.16 57.29 1f9t n GLU 525 Cb 0.55 -4.97 -0.14 0.00 -0.57 0.00 0.00 31.44 26.32 1f9t n GLU 525 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1f9t s ASN 526 N -2.63 3.64 0.06 1.62 0.02 -0.68 -4.87 114.94 112.10 1f9t s ASN 526 Ca 0.00 -0.32 -0.22 0.00 -1.02 0.00 0.00 52.86 51.29 1f9t s ASN 526 Cb 0.00 -0.63 -0.06 0.00 0.02 0.00 0.00 41.25 40.58 1f9t s ASN 526 CO 0.00 0.33 0.67 -0.63 0.02 0.00 0.00 177.10 177.49 1f9t s ILE 527 N -0.71 4.73 -0.03 0.60 1.01 -1.26 -1.24 121.20 124.29 1f9t s ILE 527 Ca 0.11 1.43 0.03 0.00 0.00 0.00 0.00 60.65 62.22 1f9t s ILE 527 Cb -0.10 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.36 1f9t s ILE 527 CO 0.00 0.45 -0.11 -0.69 0.00 0.00 0.00 174.94 174.60 1f9t s VAL 528 N -0.52 0.94 -0.47 2.92 1.01 0.73 -4.86 120.40 120.16 1f9t s VAL 528 Ca 0.34 -0.43 -0.27 0.00 0.00 0.00 0.00 61.98 61.61 1f9t s VAL 528 Cb -0.20 -0.84 0.03 0.00 0.00 0.00 0.00 36.38 35.37 1f9t s VAL 528 CO 0.21 0.29 1.04 -0.62 0.00 0.00 0.00 175.10 176.02 1f9t s ASP 529 N 0.25 6.57 0.00 3.32 2.15 -1.26 -0.68 116.67 127.02 1f9t s ASP 529 Ca -0.05 0.31 0.25 0.00 0.43 0.00 0.00 52.55 53.49 1f9t s ASP 529 Cb -0.10 -2.51 1.09 0.00 -0.30 0.00 0.00 42.92 41.11 1f9t s ASP 529 CO 0.01 -1.16 1.80 0.18 -0.17 0.00 0.00 175.17 175.83 1f9t n LEU 530 N 7.54 0.00 -0.11 -1.34 4.77 -0.27 -4.97 117.00 122.62 1f9t n LEU 530 Ca 0.09 0.46 -0.14 0.00 -0.03 0.00 0.00 56.01 56.40 1f9t n LEU 530 Cb 0.49 -0.46 -0.14 0.00 -2.33 0.00 0.00 43.42 40.97 1f9t n LEU 530 CO 0.68 -0.07 -1.22 0.18 -1.33 0.00 0.00 177.39 175.63 1f9t n LEU 531 N -1.46 1.36 -1.44 2.23 4.77 -1.24 -5.02 117.00 116.20 1f9t n LEU 531 Ca 0.07 -0.05 -0.20 0.00 -0.03 0.00 0.00 56.01 55.80 1f9t n LEU 531 Cb 0.27 -0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 1f9t n LEU 531 CO 0.22 0.69 0.32 1.17 -1.33 0.00 0.00 177.39 178.47 1f9t n LYS 546 N -2.99 0.00 -4.00 3.23 3.00 -1.26 -5.01 118.16 111.13 1f9t n LYS 546 Ca -0.38 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 57.62 1f9t n LYS 546 Cb 1.08 -0.46 -0.15 0.00 0.00 0.00 0.00 35.03 35.50 1f9t n LYS 546 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 1f9t s HIS 547 N 0.75 3.21 -0.04 5.64 3.76 -1.26 -4.28 115.29 123.07 1f9t s HIS 547 Ca 0.31 -2.49 0.02 0.00 -0.15 0.00 0.00 55.06 52.76 1f9t s HIS 547 Cb -0.44 -2.30 -0.03 0.00 1.11 0.00 0.00 32.58 30.92 1f9t s HIS 547 CO 0.24 -0.89 -0.08 -1.21 -0.85 0.00 0.00 174.74 171.94 1f9t s GLU 548 N 1.10 2.65 -0.12 1.40 2.02 -1.26 -4.84 118.70 119.65 1f9t s GLU 548 Ca 0.02 -0.62 -0.28 0.00 0.02 0.00 0.00 54.97 54.10 1f9t s GLU 548 Cb -0.19 -2.53 -0.01 0.00 0.10 0.00 0.00 34.13 31.49 1f9t s GLU 548 CO -0.08 0.64 0.96 0.42 0.02 0.00 0.00 175.26 177.22 1f9t s ILE 549 N -0.86 4.81 -0.33 -1.63 1.01 -1.26 -0.48 121.20 122.46 1f9t s ILE 549 Ca 0.14 1.94 -0.02 0.00 0.00 0.00 0.00 60.65 62.71 1f9t s ILE 549 Cb -0.11 -4.27 0.07 0.00 0.01 0.00 0.00 42.46 38.16 1f9t s ILE 549 CO 0.03 0.01 0.05 -0.13 0.00 0.00 0.00 174.94 174.90 1f9t s ARG 550 N 2.07 2.29 -0.23 2.79 1.81 0.95 -4.99 118.95 123.65 1f9t s ARG 550 Ca 0.46 -1.42 -0.16 0.00 -1.72 0.00 0.00 55.73 52.88 1f9t s ARG 550 Cb -0.18 -3.29 -0.04 0.00 -0.45 0.00 0.00 34.95 31.00 1f9t s ARG 550 CO 0.16 -0.74 0.43 -1.01 -0.68 0.00 0.00 175.30 173.46 1f9t s HIS 551 N 1.22 3.33 -0.61 -0.53 3.76 -1.26 -1.54 115.29 119.66 1f9t s HIS 551 Ca -0.01 0.59 -0.16 0.00 -0.15 0.00 0.00 55.06 55.33 1f9t s HIS 551 Cb -0.20 -2.59 0.15 0.00 1.11 0.00 0.00 32.58 31.05 1f9t s HIS 551 CO -0.02 -0.11 0.58 0.34 -0.85 0.00 0.00 174.74 174.68 1f9t s ASP 552 N 1.27 6.31 0.62 1.40 3.68 0.69 -4.91 116.67 125.73 1f9t s ASP 552 Ca 0.19 -1.94 0.34 0.00 2.13 0.00 0.00 52.55 53.27 1f9t s ASP 552 Cb -0.15 -2.22 1.91 0.00 -1.45 0.00 0.00 42.92 41.01 1f9t s ASP 552 CO 0.09 -0.83 2.20 1.56 0.13 0.00 0.00 175.17 178.31 1f9t h GLN 553 N 8.69 0.00 0.56 4.34 7.50 -1.96 0.55 115.11 134.79 1f9t h GLN 553 Ca -0.21 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 58.91 1f9t h GLN 553 Cb 1.09 0.00 0.01 0.00 0.05 0.00 0.00 27.48 28.62 1f9t h GLN 553 CO 0.99 0.00 -0.27 1.49 -1.50 0.00 0.00 178.83 179.54 1f9t h GLU 554 N 0.00 -0.73 0.00 1.46 4.57 -1.94 -3.30 114.58 114.64 1f9t h GLU 554 Ca 0.03 0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 1f9t h GLU 554 Cb 0.25 0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1f9t h GLU 554 CO -0.00 -0.49 -0.31 0.25 -1.18 0.00 0.00 179.01 177.28 1f9t n THR 555 N -5.23 0.05 -3.49 0.32 -2.24 -1.11 -4.93 114.28 97.66 1f9t n THR 555 Ca -0.09 -0.03 -0.21 0.00 -2.27 0.00 0.00 64.05 61.44 1f9t n THR 555 Cb 0.30 -0.08 0.07 0.00 -2.10 0.00 0.00 70.33 68.52 1f9t n THR 555 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1f9t n LYS 556 N -1.58 -7.19 -4.49 -0.78 3.00 0.19 -5.00 118.16 102.31 1f9t n LYS 556 Ca 0.06 0.75 -0.24 0.00 -0.00 0.00 0.00 58.31 58.88 1f9t n LYS 556 Cb 0.35 -5.57 -0.10 0.00 0.00 0.00 0.00 35.03 29.70 1f9t n LYS 556 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1f9t s THR 557 N -3.29 2.03 0.00 3.15 -4.23 -1.08 -4.86 115.64 107.36 1f9t s THR 557 Ca 0.51 -2.20 0.02 0.00 -1.18 0.00 0.00 61.69 58.84 1f9t s THR 557 Cb -0.22 -2.52 -0.01 0.00 1.34 0.00 0.00 72.50 71.09 1f9t s THR 557 CO 0.66 -0.27 -0.07 -0.89 -0.54 0.00 0.00 174.62 173.51 1f9t s THR 558 N -2.76 0.57 0.20 3.99 2.01 -1.26 -0.22 115.64 118.17 1f9t s THR 558 Ca 0.31 -0.39 0.01 0.00 0.31 0.00 0.00 61.69 61.92 1f9t s THR 558 Cb 0.02 -0.49 -0.05 0.00 0.01 0.00 0.00 72.50 71.99 1f9t s THR 558 CO 0.14 0.10 0.07 0.42 -0.69 0.00 0.00 174.62 174.66 1f9t s THR 559 N -0.30 0.41 -0.11 -0.82 -4.23 -0.59 -4.98 115.64 105.01 1f9t s THR 559 Ca 0.01 -1.98 0.01 0.00 -1.18 0.00 0.00 61.69 58.56 1f9t s THR 559 Cb -0.04 -2.34 0.02 0.00 1.34 0.00 0.00 72.50 71.48 1f9t s THR 559 CO -0.00 -0.23 -0.13 -0.63 -0.54 0.00 0.00 174.62 173.08 1f9t s ILE 560 N -3.86 1.36 0.51 2.99 1.01 -1.26 -0.04 121.20 121.92 1f9t s ILE 560 Ca 0.31 -0.54 -0.22 0.00 0.00 0.00 0.00 60.65 60.19 1f9t s ILE 560 Cb 0.07 -1.28 -0.06 0.00 0.01 0.00 0.00 42.46 41.21 1f9t s ILE 560 CO 0.08 0.42 1.31 0.42 0.00 0.00 0.00 174.94 177.17 1f9t s THR 561 N 1.19 2.37 -1.57 2.92 -4.23 0.37 -3.31 115.64 113.39 1f9t s THR 561 Ca -0.03 0.28 0.00 0.00 -1.18 0.00 0.00 61.69 60.77 1f9t s THR 561 Cb -0.14 -3.15 0.00 0.00 1.34 0.00 0.00 72.50 70.55 1f9t s THR 561 CO -0.04 0.00 0.00 0.59 -0.54 0.00 0.00 174.62 174.63 1f9t n ASN 562 N -0.79 -5.00 -4.56 3.99 3.02 -1.26 -4.03 115.26 106.62 1f9t n ASN 562 Ca 0.09 0.15 -0.34 0.00 -0.03 0.00 0.00 54.58 54.44 1f9t n ASN 562 Cb 0.46 -4.25 -0.11 0.00 -0.61 0.00 0.00 39.78 35.26 1f9t n ASN 562 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1f9t s VAL 563 N -2.79 4.35 0.24 2.41 1.01 -1.21 -4.93 120.40 119.48 1f9t s VAL 563 Ca 0.00 -0.19 -0.31 0.00 0.00 0.00 0.00 61.98 61.48 1f9t s VAL 563 Cb 0.00 -2.94 -0.12 0.00 0.00 0.00 0.00 36.38 33.31 1f9t s VAL 563 CO 0.00 0.47 1.62 0.41 0.00 0.00 0.00 175.10 177.60 1f9t n THR 564 N 3.64 0.52 -4.61 3.92 -1.04 -1.26 -5.01 114.28 110.44 1f9t n THR 564 Ca -0.17 -0.13 -0.23 0.00 -2.04 0.00 0.00 64.05 61.48 1f9t n THR 564 Cb 0.52 -1.88 -0.16 0.00 -1.82 0.00 0.00 70.33 67.00 1f9t n THR 564 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1f9t s SER 565 N 0.77 1.64 0.01 8.00 0.15 -1.26 -4.48 113.70 118.54 1f9t s SER 565 Ca 0.70 -0.26 0.07 0.00 0.70 0.00 0.00 55.95 57.16 1f9t s SER 565 Cb -0.53 -0.37 -0.02 0.00 -1.71 0.00 0.00 66.02 63.39 1f9t s SER 565 CO 0.41 0.13 -0.21 0.00 1.20 0.00 0.00 173.24 174.77 1f9t s LYS 567 N -0.74 4.04 -0.53 0.00 1.02 -1.26 -0.89 119.74 121.37 1f9t s LYS 567 Ca 0.08 1.50 0.02 0.00 0.02 0.00 0.00 55.97 57.59 1f9t s LYS 567 Cb -0.08 -2.42 0.14 0.00 -0.52 0.00 0.00 37.83 34.94 1f9t s LYS 567 CO 0.00 -0.25 0.29 -0.51 -0.92 0.00 0.00 175.35 173.96 1f9t s LEU 568 N -2.88 4.59 0.00 3.17 1.43 0.12 -4.85 118.68 120.26 1f9t s LEU 568 Ca 0.61 -2.91 0.00 0.00 -1.03 0.00 0.00 54.13 50.80 1f9t s LEU 568 Cb -0.21 -1.70 0.00 0.00 0.03 0.00 0.00 46.19 44.31 1f9t s LEU 568 CO 0.26 -0.28 0.38 -0.62 0.23 0.00 0.00 176.35 176.33 1f9t n GLU 569 N 3.30 0.74 -3.92 1.70 1.02 -1.26 -4.46 120.64 117.76 1f9t n GLU 569 Ca 0.06 -0.38 -0.10 0.00 -0.02 0.00 0.00 57.16 56.71 1f9t n GLU 569 Cb 0.34 -0.88 -0.10 0.00 -0.02 0.00 0.00 31.44 30.79 1f9t n GLU 569 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1f9t s SER 570 N -0.22 0.14 0.46 1.62 1.04 -1.26 -5.02 113.70 110.47 1f9t s SER 570 Ca 0.00 -0.42 0.25 0.00 0.48 0.00 0.00 55.95 56.26 1f9t s SER 570 Cb 0.00 0.20 1.03 0.00 0.10 0.00 0.00 66.02 67.36 1f9t s SER 570 CO 0.00 -0.44 1.87 -0.33 0.98 0.00 0.00 173.24 175.33 1f9t h GLU 571 N 3.99 0.00 -0.37 4.02 5.08 -1.99 -2.72 114.58 122.59 1f9t h GLU 571 Ca -0.32 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.93 1f9t h GLU 571 Cb 1.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 1f9t h GLU 571 CO 0.46 0.19 -0.19 0.93 -1.00 0.00 0.00 179.01 179.39 1f9t h GLU 572 N 0.00 0.79 -0.41 2.33 3.07 -1.99 0.13 114.58 118.50 1f9t h GLU 572 Ca -0.00 -0.35 -0.12 0.00 -0.50 0.00 0.00 59.36 58.39 1f9t h GLU 572 Cb 0.67 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.55 1f9t h GLU 572 CO 0.02 0.97 -0.21 1.98 -1.40 0.00 0.00 179.01 180.38 1f9t h MET 573 N 0.58 0.86 -0.41 2.33 4.05 -1.91 -2.48 114.93 117.96 1f9t h MET 573 Ca 0.08 -0.38 0.01 0.00 -0.28 0.00 0.00 59.70 59.13 1f9t h MET 573 Cb 0.75 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.50 1f9t h MET 573 CO 0.06 1.03 0.26 0.28 0.23 0.00 0.00 176.91 178.76 1f9t h VAL 574 N 0.68 1.07 0.15 -5.77 2.07 -1.36 -2.14 116.25 110.95 1f9t h VAL 574 Ca 0.09 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.44 1f9t h VAL 574 Cb 0.77 0.50 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 1f9t h VAL 574 CO 0.06 0.10 -0.49 -0.33 0.02 0.00 0.00 177.57 176.93 1f9t h GLU 575 N 0.53 -0.71 -0.86 1.57 5.08 -0.52 0.19 114.58 119.85 1f9t h GLU 575 Ca 0.16 0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.56 1f9t h GLU 575 Cb -0.03 0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 1f9t h GLU 575 CO -0.05 -0.48 0.50 -0.84 -1.00 0.00 0.00 179.01 177.14 1f9t h ILE 576 N -0.74 1.24 -0.22 3.13 3.07 -1.39 0.62 117.51 123.23 1f9t h ILE 576 Ca 0.00 -0.56 -0.05 0.00 1.55 0.00 0.00 64.86 65.80 1f9t h ILE 576 Cb 0.74 0.05 -0.01 0.00 -0.27 0.00 0.00 36.82 37.34 1f9t h ILE 576 CO -0.26 0.26 -0.07 0.40 -1.05 0.00 0.00 178.15 177.44 1f9t h ILE 577 N 1.19 1.29 0.00 0.16 2.04 -1.07 -0.89 117.51 120.24 1f9t h ILE 577 Ca 0.31 -1.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.05 1f9t h ILE 577 Cb -0.02 1.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1f9t h ILE 577 CO -0.05 0.33 -0.18 -0.07 0.00 0.00 0.00 178.15 178.17 1f9t h LEU 578 N 0.16 0.00 -0.09 1.44 3.38 -0.40 0.19 115.31 119.99 1f9t h LEU 578 Ca 0.05 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.78 1f9t h LEU 578 Cb 0.53 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.30 1f9t h LEU 578 CO 0.02 0.18 -0.88 0.11 0.09 0.00 0.00 178.44 177.97 1f9t h LYS 579 N 0.00 0.76 -0.33 1.13 1.57 -0.66 -1.86 116.57 117.18 1f9t h LYS 579 Ca -0.00 -0.70 -0.14 0.00 -1.87 0.00 0.00 60.65 57.94 1f9t h LYS 579 Cb 0.65 0.17 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 1f9t h LYS 579 CO 0.02 1.29 -0.36 -0.22 -0.57 0.00 0.00 179.45 179.61 1f9t h LYS 580 N 0.48 0.82 -0.16 3.15 1.63 -0.79 -1.96 116.57 119.75 1f9t h LYS 580 Ca -0.08 -0.45 -0.00 0.00 -0.85 0.00 0.00 60.65 59.27 1f9t h LYS 580 Cb 1.52 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 33.17 1f9t h LYS 580 CO 0.18 1.08 0.10 0.00 -3.45 0.00 0.00 179.45 177.36 1f9t h ALA 581 N 0.73 0.20 0.10 5.00 0.00 -0.98 -1.34 119.26 122.98 1f9t h ALA 581 Ca 0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1f9t h ALA 581 Cb 0.95 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1f9t h ALA 581 CO 0.09 -0.30 -0.05 -0.97 0.00 0.00 0.00 179.25 178.02 1f9t h ASN 582 N 0.19 -0.12 -0.83 0.00 -1.24 -1.33 -1.83 115.58 110.43 1f9t h ASN 582 Ca 0.06 -0.06 0.13 0.00 0.71 0.00 0.00 56.30 57.14 1f9t h ASN 582 Cb 0.01 0.03 -0.06 0.00 0.73 0.00 0.00 38.32 39.03 1f9t h ASN 582 CO -0.01 -0.01 0.54 0.50 -1.29 0.00 0.00 177.43 177.16 1f9t h LYS 583 N -0.21 0.61 -0.29 6.67 1.63 -1.24 0.91 116.57 124.65 1f9t h LYS 583 Ca -0.01 -0.04 -0.14 0.00 -0.85 0.00 0.00 60.65 59.61 1f9t h LYS 583 Cb 0.17 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 31.66 1f9t h LYS 583 CO 0.02 0.40 -0.37 -0.07 -3.45 0.00 0.00 179.45 175.99 1f9t h LEU 584 N 0.63 0.83 0.00 5.20 3.38 -0.90 -3.37 115.31 121.07 1f9t h LEU 584 Ca 0.41 -0.50 -0.30 0.00 0.09 0.00 0.00 57.88 57.57 1f9t h LEU 584 Cb 0.68 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 1f9t h LEU 584 CO -0.17 1.16 -2.27 0.54 0.09 0.00 0.00 178.44 177.79 1f9t n ARG 585 N -4.18 0.68 -1.03 1.13 5.12 -0.72 -4.30 116.66 113.36 1f9t n ARG 585 Ca -0.04 -0.02 -0.29 0.00 -1.93 0.00 0.00 57.85 55.57 1f9t n ARG 585 Cb 0.52 -1.54 0.19 0.00 -1.16 0.00 0.00 32.46 30.47 1f9t n ARG 585 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1f9t s SER 586 N -5.37 2.37 -0.51 0.55 0.15 0.31 -4.83 113.70 106.36 1f9t s SER 586 Ca -0.09 1.32 -0.19 0.00 0.70 0.00 0.00 55.95 57.69 1f9t s SER 586 Cb 0.07 -2.01 0.07 0.00 -1.71 0.00 0.00 66.02 62.44 1f9t s SER 586 CO 0.84 -3.31 0.61 -0.89 1.20 0.00 0.00 173.24 171.69 1f9t s THR 587 N -2.85 4.91 0.09 6.45 2.01 -1.26 -4.65 115.64 120.35 1f9t s THR 587 Ca 0.66 -0.62 0.04 0.00 0.31 0.00 0.00 61.69 62.07 1f9t s THR 587 Cb -0.20 -4.30 -0.03 0.00 0.01 0.00 0.00 72.50 67.97 1f9t s THR 587 CO 0.59 -0.82 -0.11 0.00 -0.69 0.00 0.00 174.62 173.59 1f9t s ALA 588 N 2.52 1.14 0.15 7.40 0.00 -1.26 -5.02 121.76 126.68 1f9t s ALA 588 Ca 0.13 -1.16 -0.30 0.00 0.00 0.00 0.00 51.96 50.63 1f9t s ALA 588 Cb -0.20 0.01 -0.05 0.00 0.00 0.00 0.00 23.12 22.87 1f9t s ALA 588 CO 0.11 -0.00 1.56 0.77 0.00 0.00 0.00 175.76 178.19 1f9t h SER 589 N 3.68 -1.75 -0.29 0.00 0.02 -2.00 0.27 113.55 113.47 1f9t h SER 589 Ca -0.38 0.25 -0.16 0.00 -0.84 0.00 0.00 61.79 60.67 1f9t h SER 589 Cb 1.19 0.75 -0.09 0.00 0.14 0.00 0.00 62.40 64.39 1f9t h SER 589 CO 0.51 -0.37 0.20 0.35 -1.14 0.00 0.00 176.83 176.38 1f9t n THR 590 N -5.38 1.78 -4.48 -2.27 -2.24 -1.26 -4.85 114.28 95.59 1f9t n THR 590 Ca -0.01 -0.67 -0.33 0.00 -2.27 0.00 0.00 64.05 60.77 1f9t n THR 590 Cb 0.34 -0.95 -0.10 0.00 -2.10 0.00 0.00 70.33 67.51 1f9t n THR 590 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1f9t s ALA 591 N -0.97 3.10 -1.44 6.98 0.00 0.93 -5.03 121.76 125.34 1f9t s ALA 591 Ca 0.17 -0.91 -0.07 0.00 0.00 0.00 0.00 51.96 51.14 1f9t s ALA 591 Cb 0.14 -1.27 0.04 0.00 0.00 0.00 0.00 23.12 22.03 1f9t s ALA 591 CO 0.03 0.60 2.59 -1.13 0.00 0.00 0.00 175.76 177.85 1f9t n SER 592 N 1.91 8.26 -0.14 0.00 3.41 -1.26 -4.65 113.62 121.15 1f9t n SER 592 Ca -0.17 -2.93 -0.00 0.00 -0.26 0.00 0.00 58.87 55.51 1f9t n SER 592 Cb 0.53 -1.44 0.25 0.00 -0.26 0.00 0.00 64.21 63.29 1f9t n SER 592 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1f9t h ASN 593 N 4.77 0.76 0.14 4.04 -1.07 -1.84 0.14 115.58 122.51 1f9t h ASN 593 Ca 0.77 -0.07 0.02 0.00 0.07 0.00 0.00 56.30 57.08 1f9t h ASN 593 Cb 0.30 -0.19 -0.04 0.00 -2.07 0.00 0.00 38.32 36.31 1f9t h ASN 593 CO 1.60 0.64 -0.38 -0.08 0.07 0.00 0.00 177.43 179.27 1f9t h GLU 594 N 0.85 -0.61 0.03 4.14 4.81 -1.98 0.47 114.58 122.29 1f9t h GLU 594 Ca 0.21 0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1f9t h GLU 594 Cb 0.07 0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1f9t h GLU 594 CO -0.03 -0.40 -0.01 1.25 -0.73 0.00 0.00 179.01 179.08 1f9t h HIS 595 N -0.63 -0.04 -0.91 0.92 2.76 -1.84 -2.61 115.15 112.80 1f9t h HIS 595 Ca 0.02 -0.00 0.15 0.00 -2.20 0.00 0.00 60.37 58.34 1f9t h HIS 595 Cb 0.65 0.01 -0.07 0.00 1.55 0.00 0.00 27.41 29.55 1f9t h HIS 595 CO -0.33 -0.01 0.59 0.77 -1.30 0.00 0.00 177.93 177.65 1f9t h SER 596 N -0.06 0.66 0.99 3.26 0.02 -0.34 0.13 113.55 118.21 1f9t h SER 596 Ca -0.00 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1f9t h SER 596 Cb 0.05 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.51 1f9t h SER 596 CO 0.01 0.32 -0.02 0.77 -1.14 0.00 0.00 176.83 176.77 1f9t h SER 597 N 0.69 0.00 -0.48 3.07 4.64 0.32 -3.07 113.55 118.72 1f9t h SER 597 Ca 0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 1f9t h SER 597 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1f9t h SER 597 CO -0.22 0.02 0.00 0.54 -0.87 0.00 0.00 176.83 176.29 1f9t n ARG 598 N -3.12 3.19 -4.11 4.77 5.12 0.42 -0.70 116.66 122.23 1f9t n ARG 598 Ca 0.00 -2.57 -0.08 0.00 -1.93 0.00 0.00 57.85 53.27 1f9t n ARG 598 Cb 0.31 -1.64 -0.10 0.00 -1.16 0.00 0.00 32.46 29.87 1f9t n ARG 598 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1f9t s SER 599 N -1.16 0.56 -0.08 0.55 1.04 -1.05 -4.74 113.70 108.82 1f9t s SER 599 Ca 0.40 -1.02 -0.11 0.00 0.48 0.00 0.00 55.95 55.69 1f9t s SER 599 Cb 0.25 0.20 -0.05 0.00 0.10 0.00 0.00 66.02 66.52 1f9t s SER 599 CO 0.19 -0.60 0.27 -1.00 0.98 0.00 0.00 173.24 173.09 1f9t s HIS 600 N -3.89 3.63 -0.06 5.02 3.76 -0.54 -2.88 115.29 120.32 1f9t s HIS 600 Ca 0.10 0.72 0.05 0.00 -0.15 0.00 0.00 55.06 55.77 1f9t s HIS 600 Cb 0.08 -2.15 -0.02 0.00 1.11 0.00 0.00 32.58 31.60 1f9t s HIS 600 CO -0.08 0.61 -0.19 -1.54 -0.85 0.00 0.00 174.74 172.69 1f9t s SER 601 N -0.79 3.59 -0.13 1.40 1.04 -0.21 0.09 113.70 118.69 1f9t s SER 601 Ca 0.19 -0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.27 1f9t s SER 601 Cb -0.14 -0.87 0.02 0.00 0.10 0.00 0.00 66.02 65.13 1f9t s SER 601 CO 0.08 0.29 -0.12 -0.63 0.98 0.00 0.00 173.24 173.84 1f9t s ILE 602 N -0.39 1.33 -0.34 -1.02 1.09 0.80 -0.85 121.20 121.82 1f9t s ILE 602 Ca 0.04 -0.49 -0.13 0.00 -1.10 0.00 0.00 60.65 58.97 1f9t s ILE 602 Cb -0.12 -1.28 -0.01 0.00 -1.06 0.00 0.00 42.46 39.99 1f9t s ILE 602 CO 0.02 0.42 0.24 0.12 -0.10 0.00 0.00 174.94 175.63 1f9t s PHE 603 N 1.48 3.23 -0.17 3.97 2.19 -0.20 -1.40 117.98 127.08 1f9t s PHE 603 Ca 0.03 -0.28 -0.06 0.00 0.33 0.00 0.00 56.93 56.94 1f9t s PHE 603 Cb -0.13 -2.47 -0.04 0.00 -1.31 0.00 0.00 43.02 39.07 1f9t s PHE 603 CO -0.08 -0.39 0.03 0.42 1.83 0.00 0.00 175.22 177.02 1f9t s ILE 604 N 1.71 4.46 -0.11 3.12 1.01 0.41 -1.01 121.20 130.79 1f9t s ILE 604 Ca 0.06 -0.15 0.01 0.00 0.00 0.00 0.00 60.65 60.57 1f9t s ILE 604 Cb -0.18 -2.99 0.02 0.00 0.01 0.00 0.00 42.46 39.32 1f9t s ILE 604 CO 0.10 0.48 -0.13 -0.63 0.00 0.00 0.00 174.94 174.76 1f9t s ILE 605 N 0.32 1.34 -0.15 2.92 1.01 0.25 -1.37 121.20 125.52 1f9t s ILE 605 Ca 0.01 -0.53 -0.04 0.00 0.00 0.00 0.00 60.65 60.09 1f9t s ILE 605 Cb -0.13 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 41.06 1f9t s ILE 605 CO 0.01 0.41 -0.02 -1.00 0.00 0.00 0.00 174.94 174.34 1f9t s HIS 606 N 1.14 3.06 -0.26 3.97 3.76 -0.17 0.13 115.29 126.92 1f9t s HIS 606 Ca -0.04 -0.19 0.00 0.00 -0.15 0.00 0.00 55.06 54.68 1f9t s HIS 606 Cb -0.14 -1.94 0.04 0.00 1.11 0.00 0.00 32.58 31.65 1f9t s HIS 606 CO -0.03 0.06 -0.08 -0.51 -0.85 0.00 0.00 174.74 173.33 1f9t s LEU 607 N 0.17 3.31 -0.24 0.89 1.43 0.18 -2.55 118.68 121.87 1f9t s LEU 607 Ca -0.01 -1.12 -0.03 0.00 -1.03 0.00 0.00 54.13 51.94 1f9t s LEU 607 Cb -0.13 -1.61 0.01 0.00 0.03 0.00 0.00 46.19 44.48 1f9t s LEU 607 CO 0.02 -0.16 -0.03 -0.55 0.23 0.00 0.00 176.35 175.86 1f9t s SER 608 N 1.22 4.41 0.17 2.29 0.15 -0.30 -1.79 113.70 119.86 1f9t s SER 608 Ca -0.04 -0.66 0.11 0.00 0.70 0.00 0.00 55.95 56.06 1f9t s SER 608 Cb -0.18 -1.72 -0.04 0.00 -1.71 0.00 0.00 66.02 62.36 1f9t s SER 608 CO -0.05 -0.10 -0.23 -0.83 1.20 0.00 0.00 173.24 173.23 1f9t s GLY 609 N 1.41 1.61 -0.09 9.45 0.00 0.13 0.12 107.32 119.95 1f9t s GLY 609 Ca 0.03 -1.56 -0.06 0.00 0.00 0.00 0.00 44.72 43.13 1f9t s GLY 609 CO -0.03 -1.58 0.21 -1.35 0.00 0.00 0.00 173.10 170.35 1f9t s SER 610 N -2.51 -0.22 -0.86 1.64 1.04 -0.40 0.06 113.70 112.46 1f9t s SER 610 Ca 0.18 0.44 -0.02 0.00 0.48 0.00 0.00 55.95 57.02 1f9t s SER 610 Cb -0.08 0.39 0.21 0.00 0.10 0.00 0.00 66.02 66.64 1f9t s SER 610 CO 0.08 -0.11 0.74 0.21 0.98 0.00 0.00 173.24 175.13 1f9t s ASN 611 N 0.64 5.91 0.00 7.02 3.84 0.40 -1.09 114.94 131.67 1f9t s ASN 611 Ca -0.04 -3.58 0.00 0.00 0.21 0.00 0.00 52.86 49.44 1f9t s ASN 611 Cb -0.06 -1.91 0.00 0.00 -0.55 0.00 0.00 41.25 38.73 1f9t s ASN 611 CO -0.04 -0.22 0.20 0.00 -2.79 0.00 0.00 177.10 174.26 1f9t n ALA 612 N 2.52 0.77 0.00 1.71 0.00 -1.24 0.20 120.51 124.47 1f9t n ALA 612 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1f9t n ALA 612 Cb 0.37 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1f9t n ALA 612 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1f9t n THR 614 N 2.15 0.00 -0.27 0.00 5.66 -1.26 -4.93 114.28 115.63 1f9t n THR 614 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1f9t n THR 614 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1f9t n THR 614 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1f9t n GLY 615 N 0.00 2.16 3.70 1.09 0.00 0.52 -5.02 105.19 107.64 1f9t n GLY 615 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1f9t n GLY 615 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f9t s ALA 616 N -3.16 1.76 0.04 4.61 0.00 -1.21 -4.72 121.76 119.07 1f9t s ALA 616 Ca 0.00 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.62 1f9t s ALA 616 Cb 0.00 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 19.65 1f9t s ALA 616 CO 0.00 -2.38 -0.04 -1.01 0.00 0.00 0.00 175.76 172.32 1f9t s HIS 617 N -2.46 0.45 -0.12 0.00 3.76 -1.26 -0.45 115.29 115.20 1f9t s HIS 617 Ca 0.69 -0.66 -0.11 0.00 -0.15 0.00 0.00 55.06 54.83 1f9t s HIS 617 Cb -0.24 -0.30 0.03 0.00 1.11 0.00 0.00 32.58 33.18 1f9t s HIS 617 CO 0.54 -0.20 0.31 0.45 -0.85 0.00 0.00 174.74 174.99 1f9t s SER 618 N -1.89 -0.33 -0.10 1.40 0.15 0.11 -4.95 113.70 108.09 1f9t s SER 618 Ca -0.08 0.63 -0.04 0.00 0.70 0.00 0.00 55.95 57.16 1f9t s SER 618 Cb -0.05 0.63 0.05 0.00 -1.71 0.00 0.00 66.02 64.94 1f9t s SER 618 CO -0.03 -0.11 0.21 -0.47 1.20 0.00 0.00 173.24 174.04 1f9t s TYR 619 N 0.23 -0.30 0.01 3.44 5.04 -1.26 0.18 117.35 124.71 1f9t s TYR 619 Ca -0.01 0.78 -0.00 0.00 -2.44 0.00 0.00 57.07 55.40 1f9t s TYR 619 Cb -0.03 -0.14 -0.01 0.00 0.35 0.00 0.00 41.96 42.14 1f9t s TYR 619 CO -0.00 -0.30 -0.01 0.20 -1.34 0.00 0.00 175.55 174.09 1f9t s GLY 620 N 2.25 0.13 -0.04 8.97 0.00 -0.74 -4.56 107.32 113.33 1f9t s GLY 620 Ca 0.01 -0.31 0.07 0.00 0.00 0.00 0.00 44.72 44.50 1f9t s GLY 620 CO -0.07 -0.35 -0.25 -1.59 0.00 0.00 0.00 173.10 170.84 1f9t s THR 621 N -0.79 2.11 -0.14 0.90 2.01 -1.25 -0.65 115.64 117.83 1f9t s THR 621 Ca -0.09 -1.07 -0.01 0.00 0.31 0.00 0.00 61.69 60.83 1f9t s THR 621 Cb -0.05 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.69 1f9t s THR 621 CO -0.00 0.58 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.63 1f9t s LEU 622 N -0.44 2.83 -0.27 4.42 1.02 0.12 -0.30 118.68 126.06 1f9t s LEU 622 Ca 0.05 -0.29 0.03 0.00 0.02 0.00 0.00 54.13 53.94 1f9t s LEU 622 Cb -0.12 -1.65 0.07 0.00 0.02 0.00 0.00 46.19 44.51 1f9t s LEU 622 CO 0.01 0.16 -0.07 0.20 0.02 0.00 0.00 176.35 176.67 1f9t s ASN 623 N 0.38 4.41 -0.43 2.29 -0.87 0.24 -0.59 114.94 120.37 1f9t s ASN 623 Ca -0.09 -1.52 -0.11 0.00 -1.57 0.00 0.00 52.86 49.57 1f9t s ASN 623 Cb -0.16 -1.49 0.08 0.00 -0.02 0.00 0.00 41.25 39.66 1f9t s ASN 623 CO 0.05 -0.24 0.30 -0.76 -2.57 0.00 0.00 177.10 173.88 1f9t s LEU 624 N 1.12 5.29 -0.18 0.60 1.43 -0.18 -1.37 118.68 125.39 1f9t s LEU 624 Ca -0.04 -1.44 -0.07 0.00 -1.03 0.00 0.00 54.13 51.55 1f9t s LEU 624 Cb -0.20 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.94 1f9t s LEU 624 CO -0.06 -0.57 0.05 -0.69 0.23 0.00 0.00 176.35 175.31 1f9t s VAL 625 N 1.50 4.71 -0.52 -1.59 1.01 0.33 -1.03 120.40 124.81 1f9t s VAL 625 Ca 0.03 -0.06 -0.06 0.00 0.00 0.00 0.00 61.98 61.89 1f9t s VAL 625 Cb -0.23 -3.12 0.13 0.00 0.00 0.00 0.00 36.38 33.16 1f9t s VAL 625 CO 0.04 0.46 0.36 -0.62 0.00 0.00 0.00 175.10 175.34 1f9t s ASP 626 N 0.38 5.56 0.76 3.32 -1.08 -0.03 -0.66 116.67 124.91 1f9t s ASP 626 Ca 0.02 -2.21 -0.11 0.00 -0.52 0.00 0.00 52.55 49.73 1f9t s ASP 626 Cb -0.13 -1.94 0.05 0.00 -1.46 0.00 0.00 42.92 39.44 1f9t s ASP 626 CO 0.00 -0.57 1.09 -0.76 0.52 0.00 0.00 175.17 175.45 1f9t s LEU 627 N 0.89 3.08 0.68 -1.34 1.43 -0.95 -1.05 118.68 121.43 1f9t s LEU 627 Ca 0.10 1.85 -0.16 0.00 -1.03 0.00 0.00 54.13 54.89 1f9t s LEU 627 Cb -0.23 -4.52 0.01 0.00 0.03 0.00 0.00 46.19 41.48 1f9t s LEU 627 CO -0.03 -1.97 1.17 0.00 0.23 0.00 0.00 176.35 175.75 1f9t s ALA 628 N -2.83 2.31 0.36 4.21 0.00 -1.14 -4.81 121.76 119.87 1f9t s ALA 628 Ca 0.62 0.79 -0.28 0.00 0.00 0.00 0.00 51.96 53.09 1f9t s ALA 628 Cb -0.18 -3.42 -0.12 0.00 0.00 0.00 0.00 23.12 19.41 1f9t s ALA 628 CO 0.54 -1.54 1.42 0.41 0.00 0.00 0.00 175.76 176.59 1f9t n GLY 629 N 0.12 0.99 0.26 0.00 0.00 0.13 -4.75 105.19 101.95 1f9t n GLY 629 Ca 0.12 0.32 0.13 0.00 0.00 0.00 0.00 46.02 46.59 1f9t n GLY 629 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1f9t n SER 630 N 0.60 1.03 -4.67 1.61 3.41 -1.00 -4.87 113.62 109.74 1f9t n SER 630 Ca 0.03 -0.94 -0.32 0.00 -0.26 0.00 0.00 58.87 57.38 1f9t n SER 630 Cb 0.38 0.10 0.15 0.00 -0.26 0.00 0.00 64.21 64.58 1f9t n SER 630 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1f9t n GLU 631 N -0.57 -0.24 -3.22 4.33 0.00 -1.26 -4.93 120.64 114.75 1f9t n GLU 631 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 57.16 56.91 1f9t n GLU 631 Cb 0.34 -2.38 -0.06 0.00 0.00 0.00 0.00 31.44 29.35 1f9t n GLU 631 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 1f9t s ARG 632 N -4.41 4.27 0.64 3.44 6.06 -1.26 -5.06 118.95 122.63 1f9t s ARG 632 Ca 0.69 0.52 0.34 0.00 -2.50 0.00 0.00 55.73 54.77 1f9t s ARG 632 Cb -0.25 -3.51 1.86 0.00 0.06 0.00 0.00 34.95 33.11 1f9t s ARG 632 CO 0.56 -0.04 2.10 0.00 -2.50 0.00 0.00 175.30 175.41 1f9t h ARG 644 N 7.14 0.00 -0.46 5.12 3.08 -2.05 -3.54 114.38 123.66 1f9t h ARG 644 Ca -0.36 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.58 1f9t h ARG 644 Cb 1.16 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.20 1f9t h ARG 644 CO 0.75 0.00 -0.13 1.49 -1.07 0.00 0.00 179.97 181.02 1f9t h GLU 645 N 0.00 0.90 -0.44 0.04 4.81 -2.02 -0.16 114.58 117.71 1f9t h GLU 645 Ca 0.03 -0.35 -0.08 0.00 -0.13 0.00 0.00 59.36 58.84 1f9t h GLU 645 Cb 0.46 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1f9t h GLU 645 CO -0.00 1.00 -0.04 1.15 -0.73 0.00 0.00 179.01 180.38 1f9t h THR 646 N 0.74 1.24 0.00 0.32 2.02 -1.99 -1.31 112.91 113.93 1f9t h THR 646 Ca 0.11 -1.04 -0.09 0.00 0.77 0.00 0.00 66.41 66.16 1f9t h THR 646 Cb 0.68 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 1f9t h THR 646 CO 0.05 0.36 -0.44 -0.61 0.37 0.00 0.00 175.52 175.24 1f9t h GLN 647 N 0.69 0.00 -0.24 6.66 5.75 -1.92 -1.14 115.11 124.91 1f9t h GLN 647 Ca 0.13 0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 58.56 1f9t h GLN 647 Cb 0.49 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.03 1f9t h GLN 647 CO 0.03 0.44 -0.14 -0.91 -2.65 0.00 0.00 178.83 175.60 1f9t h ASN 648 N 0.00 0.54 -0.19 -0.69 2.35 -0.40 -1.14 115.58 116.05 1f9t h ASN 648 Ca -0.00 -0.43 -0.02 0.00 -0.55 0.00 0.00 56.30 55.30 1f9t h ASN 648 Cb 1.05 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.26 1f9t h ASN 648 CO 0.06 0.85 0.03 0.40 -1.65 0.00 0.00 177.43 177.12 1f9t h ILE 649 N 0.23 1.22 -0.08 2.81 2.04 -1.10 -0.82 117.51 121.81 1f9t h ILE 649 Ca 0.05 -0.72 0.02 0.00 1.00 0.00 0.00 64.86 65.21 1f9t h ILE 649 Cb 0.66 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 1f9t h ILE 649 CO 0.04 0.22 -0.04 0.78 0.00 0.00 0.00 178.15 179.15 1f9t h ASN 650 N 0.10 -0.13 -0.21 1.72 2.35 -1.18 -0.92 115.58 117.31 1f9t h ASN 650 Ca 0.06 0.03 -0.09 0.00 -0.55 0.00 0.00 56.30 55.75 1f9t h ASN 650 Cb 0.31 0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 1f9t h ASN 650 CO 0.00 -0.05 -0.16 0.11 -1.65 0.00 0.00 177.43 175.69 1f9t h LYS 651 N -0.03 0.63 -0.17 0.81 1.57 -1.18 -0.80 116.57 117.40 1f9t h LYS 651 Ca 0.05 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 1f9t h LYS 651 Cb 0.10 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1f9t h LYS 651 CO -0.10 0.76 0.03 1.03 -0.57 0.00 0.00 179.45 180.60 1f9t h SER 652 N 0.57 0.27 -0.57 0.86 0.87 -0.80 0.92 113.55 115.67 1f9t h SER 652 Ca 0.09 -0.25 -0.11 0.00 -1.23 0.00 0.00 61.79 60.30 1f9t h SER 652 Cb 0.59 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.46 1f9t h SER 652 CO 0.04 0.45 -0.06 -0.07 -0.53 0.00 0.00 176.83 176.66 1f9t h LEU 653 N 0.07 1.05 -0.72 2.23 3.38 -1.10 -1.45 115.31 118.77 1f9t h LEU 653 Ca 0.05 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 1f9t h LEU 653 Cb 0.29 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1f9t h LEU 653 CO 0.00 1.13 0.31 -1.28 0.09 0.00 0.00 178.44 178.69 1f9t h SER 654 N 0.95 0.98 -0.45 -0.43 0.87 -1.03 -1.08 113.55 113.35 1f9t h SER 654 Ca 0.16 -0.16 -0.04 0.00 -1.23 0.00 0.00 61.79 60.52 1f9t h SER 654 Cb 0.62 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 1f9t h SER 654 CO 0.04 0.87 0.14 0.00 -0.53 0.00 0.00 176.83 177.35 1f9t h LEU 656 N 0.60 0.77 -0.67 0.00 5.85 -0.92 -0.06 115.31 120.87 1f9t h LEU 656 Ca 0.15 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 1f9t h LEU 656 Cb 0.26 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1f9t h LEU 656 CO -0.01 0.54 0.27 1.23 -0.34 0.00 0.00 178.44 180.13 1f9t h GLY 657 N 0.91 1.07 0.99 3.75 0.00 -0.87 -0.81 103.07 108.12 1f9t h GLY 657 Ca 0.28 -0.58 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 1f9t h GLY 657 CO -0.09 0.55 0.33 -0.55 0.00 0.00 0.00 176.54 176.77 1f9t h ASP 658 N 0.94 0.71 -0.00 0.19 3.32 -0.47 -1.61 116.42 119.52 1f9t h ASP 658 Ca 0.22 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.19 1f9t h ASP 658 Cb 0.20 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 1f9t h ASP 658 CO -0.02 0.59 -0.00 0.58 -1.72 0.00 0.00 179.24 178.67 1f9t h VAL 659 N 0.78 1.27 -0.42 -1.35 2.07 -0.76 -0.66 116.25 117.18 1f9t h VAL 659 Ca 0.21 -0.79 0.03 0.00 0.82 0.00 0.00 66.70 66.97 1f9t h VAL 659 Cb 0.02 1.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 1f9t h VAL 659 CO -0.03 0.20 0.23 0.40 0.02 0.00 0.00 177.57 178.39 1f9t h ILE 660 N -0.33 1.00 -0.40 4.57 1.08 -1.11 0.41 117.51 122.73 1f9t h ILE 660 Ca 0.00 -0.16 -0.01 0.00 -0.39 0.00 0.00 64.86 64.30 1f9t h ILE 660 Cb 0.33 0.50 -0.02 0.00 -3.07 0.00 0.00 36.82 34.57 1f9t h ILE 660 CO 0.00 0.08 0.20 -0.74 -0.69 0.00 0.00 178.15 177.01 1f9t h HIS 661 N 0.46 0.57 -0.91 1.37 2.76 -1.30 -2.18 115.15 115.92 1f9t h HIS 661 Ca 0.18 -0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.34 1f9t h HIS 661 Cb 0.05 -0.18 -0.05 0.00 1.55 0.00 0.00 27.41 28.79 1f9t h HIS 661 CO -0.09 0.46 0.60 0.00 -1.30 0.00 0.00 177.93 177.60 1f9t h ALA 662 N 1.06 1.17 0.00 5.26 0.00 -0.67 -1.28 119.26 124.79 1f9t h ALA 662 Ca 0.14 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1f9t h ALA 662 Cb 0.09 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 1f9t h ALA 662 CO -0.02 0.53 -0.01 -0.07 0.00 0.00 0.00 179.25 179.68 1f9t h LEU 663 N 1.21 0.00 0.00 0.00 3.38 -0.52 -2.61 115.31 116.77 1f9t h LEU 663 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1f9t h LEU 663 Cb -0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1f9t h LEU 663 CO -0.09 0.01 -0.54 0.61 0.09 0.00 0.00 178.44 178.52 1f9t n GLY 664 N -0.31 -1.25 0.00 0.83 0.00 -0.50 -4.98 105.19 98.97 1f9t n GLY 664 Ca -0.01 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1f9t n GLY 664 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1f9t n GLN 665 N -1.55 0.00 -1.47 1.61 1.13 -0.99 -5.10 117.38 111.01 1f9t n GLN 665 Ca 0.05 0.00 -0.44 0.00 -1.94 0.00 0.00 57.00 54.67 1f9t n GLN 665 Cb 0.34 -0.20 -0.09 0.00 0.11 0.00 0.00 30.24 30.40 1f9t n GLN 665 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1f9t n HIS 672 N 0.00 1.16 -2.52 1.08 8.25 -1.26 -5.08 115.22 116.85 1f9t n HIS 672 Ca 0.00 0.32 -0.42 0.00 -0.26 0.00 0.00 57.72 57.35 1f9t n HIS 672 Cb 0.00 -2.48 -0.03 0.00 1.12 0.00 0.00 29.99 28.60 1f9t n HIS 672 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1f9t s ILE 673 N 9.04 4.38 -0.37 1.59 -1.09 -1.26 -4.94 121.20 128.56 1f9t s ILE 673 Ca 1.17 1.69 -0.06 0.00 -2.23 0.00 0.00 60.65 61.22 1f9t s ILE 673 Cb -0.88 -4.09 -0.17 0.00 -1.58 0.00 0.00 42.46 35.74 1f9t s ILE 673 CO 0.45 0.04 2.87 -0.81 -1.23 0.00 0.00 174.94 176.25 1f9t n PRO 674 N 4.82 1.97 -0.27 2.79 -0.04 -1.26 -4.66 135.00 138.35 1f9t n PRO 674 Ca 0.10 -1.09 0.00 0.00 -0.04 0.00 0.00 63.50 62.47 1f9t n PRO 674 Cb 0.47 -2.11 0.13 0.00 -0.04 0.00 0.00 33.50 31.95 1f9t n PRO 674 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1f9t h PHE 675 N 4.18 0.82 0.00 0.54 0.04 -1.92 -2.52 116.94 118.08 1f9t h PHE 675 Ca 0.31 0.03 0.00 0.00 2.80 0.00 0.00 57.97 61.10 1f9t h PHE 675 Cb 0.93 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.82 1f9t h PHE 675 CO 1.71 0.39 0.00 0.54 -0.60 0.00 0.00 178.31 180.35 1f9t n ARG 676 N -4.72 0.46 -0.00 1.51 1.74 -1.26 -1.72 116.66 112.66 1f9t n ARG 676 Ca 0.11 0.05 0.15 0.00 -0.77 0.00 0.00 57.85 57.39 1f9t n ARG 676 Cb 0.20 -1.50 0.85 0.00 -1.02 0.00 0.00 32.46 30.99 1f9t n ARG 676 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1f9t n ASN 677 N -1.15 0.24 -3.61 0.55 5.03 -0.95 -4.81 115.26 110.56 1f9t n ASN 677 Ca 0.12 -1.11 -0.16 0.00 0.87 0.00 0.00 54.58 54.30 1f9t n ASN 677 Cb 0.12 -0.00 -0.07 0.00 -1.02 0.00 0.00 39.78 38.81 1f9t n ASN 677 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1f9t s SER 678 N -1.96 -0.49 0.21 6.41 1.04 -1.24 -4.94 113.70 112.73 1f9t s SER 678 Ca 0.45 0.49 -0.10 0.00 0.48 0.00 0.00 55.95 57.27 1f9t s SER 678 Cb 0.21 0.46 0.16 0.00 0.10 0.00 0.00 66.02 66.95 1f9t s SER 678 CO 0.35 -0.55 1.86 0.50 0.98 0.00 0.00 173.24 176.39 1f9t h LYS 679 N 3.34 1.02 0.05 4.02 1.63 -1.87 -1.99 116.57 122.77 1f9t h LYS 679 Ca -0.28 -0.08 -0.00 0.00 -0.85 0.00 0.00 60.65 59.43 1f9t h LYS 679 Cb 1.15 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 32.57 1f9t h LYS 679 CO 0.39 0.71 -0.02 1.25 -3.45 0.00 0.00 179.45 178.33 1f9t h LEU 680 N 1.04 -0.05 -0.93 5.20 5.85 -1.96 -0.52 115.31 123.94 1f9t h LEU 680 Ca 0.27 -0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 1f9t h LEU 680 Cb -0.06 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1f9t h LEU 680 CO -0.05 0.03 -0.48 0.71 -0.34 0.00 0.00 178.44 178.31 1f9t h THR 681 N -0.14 1.34 -0.27 1.05 1.35 -1.76 -2.12 112.91 112.36 1f9t h THR 681 Ca -0.01 -1.68 -0.09 0.00 -0.55 0.00 0.00 66.41 64.09 1f9t h THR 681 Cb 0.12 1.84 -0.01 0.00 -1.73 0.00 0.00 68.15 68.37 1f9t h THR 681 CO 0.01 0.49 -0.17 0.22 -0.25 0.00 0.00 175.52 175.82 1f9t h TYR 682 N 0.11 0.70 -0.45 4.73 3.20 -0.54 -1.40 116.97 123.31 1f9t h TYR 682 Ca 0.00 -0.18 0.02 0.00 3.14 0.00 0.00 58.73 61.71 1f9t h TYR 682 Cb 0.89 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.97 1f9t h TYR 682 CO 0.01 0.86 0.26 1.25 -1.64 0.00 0.00 178.16 178.91 1f9t h LEU 683 N 0.33 0.42 -1.71 2.82 6.46 -0.92 -3.10 115.31 119.61 1f9t h LEU 683 Ca 0.06 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.82 1f9t h LEU 683 Cb 0.70 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 40.55 1f9t h LEU 683 CO 0.05 0.30 0.00 0.18 -0.62 0.00 0.00 178.44 178.35 1f9t n LEU 684 N -4.84 2.50 -0.27 2.25 4.77 -0.81 -4.61 117.00 115.99 1f9t n LEU 684 Ca 0.02 -1.21 0.08 0.00 -0.03 0.00 0.00 56.01 54.88 1f9t n LEU 684 Cb 0.07 -0.28 0.22 0.00 -2.33 0.00 0.00 43.42 41.10 1f9t n LEU 684 CO 0.32 0.60 0.93 0.06 -1.33 0.00 0.00 177.39 177.97 1f9t h GLN 685 N 2.87 0.23 0.00 3.23 3.07 -1.17 0.19 115.11 123.53 1f9t h GLN 685 Ca 0.00 -0.01 -0.05 0.00 0.09 0.00 0.00 58.65 58.68 1f9t h GLN 685 Cb 0.65 -0.05 -0.01 0.00 0.08 0.00 0.00 27.48 28.15 1f9t h GLN 685 CO 0.00 0.15 -0.22 1.88 0.09 0.00 0.00 178.83 180.73 1f9t h TYR 686 N 0.23 0.00 -0.02 0.06 0.05 -1.86 -1.81 116.97 113.63 1f9t h TYR 686 Ca 0.47 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.25 1f9t h TYR 686 Cb 0.86 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.60 1f9t h TYR 686 CO -0.28 0.22 -0.00 0.43 -1.05 0.00 0.00 178.16 177.48 1f9t n SER 687 N -3.63 1.54 -0.00 3.88 7.64 0.58 -3.83 113.62 119.80 1f9t n SER 687 Ca -0.01 -1.51 0.05 0.00 1.01 0.00 0.00 58.87 58.41 1f9t n SER 687 Cb 0.35 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.48 1f9t n SER 687 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1f9t n LEU 688 N 0.20 0.05 0.00 -3.43 4.77 -0.61 -4.43 117.00 113.54 1f9t n LEU 688 Ca 0.19 -0.05 -0.19 0.00 -0.03 0.00 0.00 56.01 55.93 1f9t n LEU 688 Cb 0.36 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.48 1f9t n LEU 688 CO 0.17 0.01 0.16 0.35 -1.33 0.00 0.00 177.39 176.75 1f9t n THR 689 N -1.79 0.00 -3.52 -5.08 -2.24 -0.75 -4.77 114.28 96.13 1f9t n THR 689 Ca -0.01 -1.70 0.00 0.00 -2.27 0.00 0.00 64.05 60.07 1f9t n THR 689 Cb 0.25 -0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 1f9t n THR 689 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f9t n GLY 690 N -0.58 2.12 1.89 3.38 0.00 -1.26 -2.25 105.19 108.50 1f9t n GLY 690 Ca 0.05 -0.51 0.04 0.00 0.00 0.00 0.00 46.02 45.60 1f9t n GLY 690 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1f9t n ASP 691 N 2.97 5.45 -4.72 1.61 3.85 -1.26 -3.49 116.55 120.96 1f9t n ASP 691 Ca 0.00 -2.97 -0.35 0.00 -0.71 0.00 0.00 54.79 50.76 1f9t n ASP 691 Cb 0.00 -0.70 0.09 0.00 -1.35 0.00 0.00 41.12 39.16 1f9t n ASP 691 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.20 175.75 1f9t s SER 692 N -0.80 4.20 -0.14 -1.12 0.01 -0.95 -3.43 113.70 111.47 1f9t s SER 692 Ca 0.53 2.43 -0.01 0.00 1.31 0.00 0.00 55.95 60.21 1f9t s SER 692 Cb 0.41 -2.60 -0.01 0.00 0.21 0.00 0.00 66.02 64.03 1f9t s SER 692 CO 0.15 -2.26 -0.12 -0.54 0.41 0.00 0.00 173.24 170.88 1f9t s LYS 693 N -3.81 3.40 -0.05 12.44 1.02 -0.25 -3.35 119.74 129.14 1f9t s LYS 693 Ca 0.76 -0.67 0.06 0.00 0.02 0.00 0.00 55.97 56.14 1f9t s LYS 693 Cb -0.31 -2.67 -0.02 0.00 -0.52 0.00 0.00 37.83 34.31 1f9t s LYS 693 CO 0.45 0.18 -0.22 0.99 -0.92 0.00 0.00 175.35 175.83 1f9t s THR 694 N 0.44 2.37 -0.11 2.17 2.01 -0.62 -1.19 115.64 120.71 1f9t s THR 694 Ca -0.09 -0.97 0.01 0.00 0.31 0.00 0.00 61.69 60.95 1f9t s THR 694 Cb -0.16 -1.88 0.02 0.00 0.01 0.00 0.00 72.50 70.50 1f9t s THR 694 CO 0.05 0.58 -0.12 -0.22 -0.69 0.00 0.00 174.62 174.21 1f9t s LEU 695 N -0.43 1.56 -0.25 4.42 2.96 0.53 -1.73 118.68 125.75 1f9t s LEU 695 Ca 0.04 -0.38 -0.07 0.00 -0.22 0.00 0.00 54.13 53.50 1f9t s LEU 695 Cb -0.12 -0.99 -0.02 0.00 0.50 0.00 0.00 46.19 45.56 1f9t s LEU 695 CO 0.01 -0.03 0.05 -0.32 -1.32 0.00 0.00 176.35 174.75 1f9t s MET 696 N 1.21 3.58 -0.35 1.98 -2.45 -0.51 -1.00 119.30 121.76 1f9t s MET 696 Ca -0.03 -0.52 -0.12 0.00 -1.25 0.00 0.00 55.69 53.78 1f9t s MET 696 Cb -0.14 -3.27 0.00 0.00 1.25 0.00 0.00 34.83 32.67 1f9t s MET 696 CO -0.04 -0.20 0.21 -0.06 1.05 0.00 0.00 175.02 175.98 1f9t s PHE 697 N 1.59 3.22 -0.43 4.11 0.08 0.23 -1.21 117.98 125.56 1f9t s PHE 697 Ca 0.06 -0.56 -0.14 0.00 0.12 0.00 0.00 56.93 56.41 1f9t s PHE 697 Cb -0.15 -2.44 0.05 0.00 -0.57 0.00 0.00 43.02 39.91 1f9t s PHE 697 CO 0.02 -0.49 0.33 0.08 -0.10 0.00 0.00 175.22 175.06 1f9t s VAL 698 N 1.64 5.08 -0.00 -0.44 1.01 -0.20 0.43 120.40 127.91 1f9t s VAL 698 Ca 0.04 -0.93 -0.22 0.00 0.00 0.00 0.00 61.98 60.88 1f9t s VAL 698 Cb -0.18 -3.95 -0.05 0.00 0.00 0.00 0.00 36.38 32.20 1f9t s VAL 698 CO 0.08 -0.44 0.64 0.20 0.00 0.00 0.00 175.10 175.58 1f9t s ASN 699 N 2.12 7.02 0.03 3.32 -0.87 0.22 -1.21 114.94 125.58 1f9t s ASN 699 Ca 0.04 1.22 -0.00 0.00 -1.57 0.00 0.00 52.86 52.55 1f9t s ASN 699 Cb -0.22 -2.39 -0.03 0.00 -0.02 0.00 0.00 41.25 38.59 1f9t s ASN 699 CO 0.07 0.06 -0.03 0.27 -2.57 0.00 0.00 177.10 174.90 1f9t s ILE 700 N -0.04 0.19 0.26 0.60 -4.36 -0.73 -4.34 121.20 112.79 1f9t s ILE 700 Ca 0.33 -1.26 -0.10 0.00 -0.26 0.00 0.00 60.65 59.36 1f9t s ILE 700 Cb -0.19 -0.76 -0.07 0.00 1.25 0.00 0.00 42.46 42.69 1f9t s ILE 700 CO 0.18 -0.68 0.59 -0.55 0.24 0.00 0.00 174.94 174.72 1f9t s SER 701 N -2.02 6.62 0.07 4.36 0.15 -1.26 -2.40 113.70 119.21 1f9t s SER 701 Ca -0.07 0.96 0.26 0.00 0.70 0.00 0.00 55.95 57.80 1f9t s SER 701 Cb -0.03 -2.24 0.62 0.00 -1.71 0.00 0.00 66.02 62.66 1f9t s SER 701 CO -0.04 -0.13 1.52 -0.81 1.20 0.00 0.00 173.24 174.98 1f9t n PRO 702 N -0.33 0.13 -2.32 5.44 -0.04 -1.26 -4.91 135.00 131.71 1f9t n PRO 702 Ca 0.01 0.06 -0.39 0.00 -0.04 0.00 0.00 63.50 63.14 1f9t n PRO 702 Cb 0.53 -1.60 -0.03 0.00 -0.04 0.00 0.00 33.50 32.36 1f9t n PRO 702 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1f9t s SER 703 N -3.61 6.73 0.41 3.54 0.15 -1.26 -4.75 113.70 114.91 1f9t s SER 703 Ca 0.10 2.36 0.09 0.00 0.70 0.00 0.00 55.95 59.19 1f9t s SER 703 Cb 0.16 -2.62 0.87 0.00 -1.71 0.00 0.00 66.02 62.72 1f9t s SER 703 CO 0.66 -0.53 2.01 0.28 1.20 0.00 0.00 173.24 176.86 1f9t h SER 704 N 2.97 0.33 0.39 5.45 0.02 -1.34 -2.13 113.55 119.24 1f9t h SER 704 Ca -0.48 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.42 1f9t h SER 704 Cb 1.23 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.68 1f9t h SER 704 CO 0.64 0.32 -0.06 0.77 -1.14 0.00 0.00 176.83 177.36 1f9t h SER 705 N 0.37 0.00 -0.43 3.07 4.64 -1.94 -2.42 113.55 116.85 1f9t h SER 705 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1f9t h SER 705 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1f9t h SER 705 CO -0.01 0.06 0.00 1.41 -0.87 0.00 0.00 176.83 177.42 1f9t n HIS 706 N -3.40 0.56 -0.27 4.77 -0.00 -0.81 -4.73 115.22 111.34 1f9t n HIS 706 Ca -0.02 -0.41 0.16 0.00 -0.00 0.00 0.00 57.72 57.45 1f9t n HIS 706 Cb 0.20 -0.01 0.44 0.00 -0.00 0.00 0.00 29.99 30.61 1f9t n HIS 706 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.34 177.31 1f9t h ILE 707 N 3.02 0.73 -0.27 1.59 6.09 -1.30 -0.51 117.51 126.85 1f9t h ILE 707 Ca 0.00 -0.19 -0.15 0.00 -1.37 0.00 0.00 64.86 63.15 1f9t h ILE 707 Cb 0.81 0.12 -0.00 0.00 0.47 0.00 0.00 36.82 38.22 1f9t h ILE 707 CO 0.00 0.10 -0.41 0.78 -3.07 0.00 0.00 178.15 175.56 1f9t h ASN 708 N 0.56 0.83 0.20 2.19 2.35 -1.85 -1.31 115.58 118.55 1f9t h ASN 708 Ca 0.48 -0.51 -0.13 0.00 -0.55 0.00 0.00 56.30 55.60 1f9t h ASN 708 Cb 0.98 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.10 1f9t h ASN 708 CO -0.22 1.18 -0.47 -0.33 -1.65 0.00 0.00 177.43 175.94 1f9t h GLU 709 N 0.50 0.32 -0.51 0.81 4.39 -1.77 -2.00 114.58 116.32 1f9t h GLU 709 Ca 0.03 -0.18 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 1f9t h GLU 709 Cb 1.00 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.64 1f9t h GLU 709 CO 0.09 0.73 0.25 1.15 -1.16 0.00 0.00 179.01 180.07 1f9t h THR 710 N 0.26 1.19 -0.34 1.13 2.02 -0.96 0.24 112.91 116.46 1f9t h THR 710 Ca 0.02 -0.54 -0.07 0.00 0.77 0.00 0.00 66.41 66.59 1f9t h THR 710 Cb 0.92 0.61 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 1f9t h THR 710 CO 0.08 0.22 -0.08 -0.07 0.37 0.00 0.00 175.52 176.03 1f9t h LEU 711 N 0.68 0.54 0.04 2.58 3.38 -1.00 -0.14 115.31 121.39 1f9t h LEU 711 Ca 0.18 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1f9t h LEU 711 Cb 0.11 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1f9t h LEU 711 CO -0.02 0.67 -0.02 0.78 0.09 0.00 0.00 178.44 179.94 1f9t h ASN 712 N 0.52 -0.05 -0.66 -0.43 2.35 -0.69 -1.45 115.58 115.18 1f9t h ASN 712 Ca 0.10 -0.16 0.04 0.00 -0.55 0.00 0.00 56.30 55.72 1f9t h ASN 712 Cb 0.46 0.01 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 1f9t h ASN 712 CO 0.02 0.14 0.40 0.28 -1.65 0.00 0.00 177.43 176.62 1f9t h SER 713 N -0.23 0.64 0.05 5.81 0.02 -0.64 -1.77 113.55 117.42 1f9t h SER 713 Ca -0.01 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 1f9t h SER 713 Cb 0.21 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1f9t h SER 713 CO 0.01 0.44 -0.23 -0.07 -1.14 0.00 0.00 176.83 175.83 1f9t h LEU 714 N 0.77 0.32 -0.56 5.07 3.38 -0.90 -1.94 115.31 121.44 1f9t h LEU 714 Ca 0.27 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 58.00 1f9t h LEU 714 Cb 0.06 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1f9t h LEU 714 CO -0.12 0.56 -0.40 0.03 0.09 0.00 0.00 178.44 178.60 1f9t h ARG 715 N 0.29 0.71 -0.67 1.13 3.08 -0.70 -2.20 114.38 116.02 1f9t h ARG 715 Ca 0.05 -0.37 -0.08 0.00 0.07 0.00 0.00 59.98 59.65 1f9t h ARG 715 Cb 0.58 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 1f9t h ARG 715 CO 0.04 0.98 0.12 0.35 -1.07 0.00 0.00 179.97 180.39 1f9t h PHE 716 N 0.58 1.17 -0.57 3.04 3.04 -1.00 -2.91 116.94 120.30 1f9t h PHE 716 Ca 0.05 -0.16 -0.07 0.00 3.98 0.00 0.00 57.97 61.77 1f9t h PHE 716 Cb 0.94 -0.32 -0.02 0.00 2.56 0.00 0.00 35.95 39.10 1f9t h PHE 716 CO 0.05 0.98 0.09 0.00 -2.02 0.00 0.00 178.31 177.40 1f9t h ALA 717 N 1.05 1.08 0.66 2.41 0.00 -1.21 -2.72 119.26 120.54 1f9t h ALA 717 Ca 0.20 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1f9t h ALA 717 Cb 0.43 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1f9t h ALA 717 CO 0.01 0.60 -0.37 0.77 0.00 0.00 0.00 179.25 180.25 1f9t h SER 718 N 0.86 -0.92 -0.87 0.00 0.02 -1.20 -2.77 113.55 108.68 1f9t h SER 718 Ca 0.18 0.04 0.17 0.00 -0.84 0.00 0.00 61.79 61.34 1f9t h SER 718 Cb 0.39 0.26 -0.07 0.00 0.14 0.00 0.00 62.40 63.12 1f9t h SER 718 CO 0.01 -0.59 0.57 0.07 -1.14 0.00 0.00 176.83 175.75 1f9t h LYS 719 N -0.95 0.52 0.00 3.45 2.10 -1.59 -3.52 116.57 116.58 1f9t h LYS 719 Ca -0.09 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.53 1f9t h LYS 719 Cb 0.75 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 1f9t h LYS 719 CO 0.11 0.34 0.00 0.28 -2.00 0.00 0.00 179.45 178.18