#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fh3 n ASP 415 N 0.00 1.38 -0.56 1.67 5.75 -1.26 -4.91 116.55 118.62 2fh3 n ASP 415 Ca 0.00 -1.93 -0.07 0.00 -0.01 0.00 0.00 54.79 52.78 2fh3 n ASP 415 Cb 0.00 -0.16 -0.03 0.00 -1.03 0.00 0.00 41.12 39.90 2fh3 n ASP 415 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2fh3 n GLY 416 N 0.94 0.91 0.14 6.12 0.00 -1.26 -4.85 105.19 107.18 2fh3 n GLY 416 Ca 0.10 -0.44 0.12 0.00 0.00 0.00 0.00 46.02 45.81 2fh3 n GLY 416 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fh3 n THR 417 N -2.67 0.00 -1.78 2.61 -2.24 -1.26 -4.22 114.28 104.72 2fh3 n THR 417 Ca -0.07 -0.07 -0.36 0.00 -2.27 0.00 0.00 64.05 61.28 2fh3 n THR 417 Cb 0.30 0.44 0.06 0.00 -2.10 0.00 0.00 70.33 69.03 2fh3 n THR 417 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2fh3 s GLY 418 N -2.76 2.73 0.01 3.38 0.00 -1.26 -4.90 107.32 104.52 2fh3 s GLY 418 Ca 0.17 1.09 -0.32 0.00 0.00 0.00 0.00 44.72 45.66 2fh3 s GLY 418 CO 0.63 1.50 1.92 -0.18 0.00 0.00 0.00 173.10 176.97 2fh3 n GLN 419 N -1.95 2.63 -4.45 2.90 -0.06 -1.26 -4.64 117.38 110.56 2fh3 n GLN 419 Ca 0.15 0.97 -0.24 0.00 -2.00 0.00 0.00 57.00 55.87 2fh3 n GLN 419 Cb 0.49 -2.88 -0.10 0.00 -4.06 0.00 0.00 30.24 23.69 2fh3 n GLN 419 CO 0.00 0.00 0.00 -1.59 -0.20 0.00 0.00 177.06 175.27 2fh3 s LYS 420 N 4.07 1.63 0.03 3.69 -2.85 -1.26 -2.50 119.74 122.55 2fh3 s LYS 420 Ca 0.89 -1.71 0.04 0.00 -1.00 0.00 0.00 55.97 54.19 2fh3 s LYS 420 Cb -0.53 -1.73 -0.02 0.00 -2.06 0.00 0.00 37.83 33.49 2fh3 s LYS 420 CO 0.44 0.33 -0.13 -0.65 0.10 0.00 0.00 175.35 175.45 2fh3 s GLN 421 N -3.37 0.86 -0.10 1.78 -0.21 0.67 -4.99 119.66 114.30 2fh3 s GLN 421 Ca 0.28 -0.68 0.01 0.00 0.02 0.00 0.00 55.36 54.99 2fh3 s GLN 421 Cb -0.05 -0.84 0.02 0.00 1.00 0.00 0.00 33.01 33.14 2fh3 s GLN 421 CO 0.14 0.21 -0.11 0.42 -2.12 0.00 0.00 175.29 173.83 2fh3 s ILE 422 N -0.79 1.18 0.37 1.08 1.01 -1.26 -0.41 121.20 122.37 2fh3 s ILE 422 Ca 0.01 -0.43 0.08 0.00 0.00 0.00 0.00 60.65 60.30 2fh3 s ILE 422 Cb -0.07 -1.12 -0.03 0.00 0.01 0.00 0.00 42.46 41.25 2fh3 s ILE 422 CO 0.01 0.38 0.32 0.26 0.00 0.00 0.00 174.94 175.91 2fh3 s TRP 423 N 1.22 2.81 -0.02 3.97 0.51 0.48 -1.02 118.94 126.89 2fh3 s TRP 423 Ca -0.04 -0.39 -0.00 0.00 -2.12 0.00 0.00 56.10 53.55 2fh3 s TRP 423 Cb -0.14 -1.94 0.03 0.00 -0.81 0.00 0.00 33.47 30.60 2fh3 s TRP 423 CO -0.03 0.07 0.04 0.50 -0.51 0.00 0.00 176.95 177.01 2fh3 s ARG 424 N -4.04 -0.03 -0.21 4.98 3.00 -0.45 -1.52 118.95 120.69 2fh3 s ARG 424 Ca 0.44 0.18 -0.29 0.00 -1.00 0.00 0.00 55.73 55.06 2fh3 s ARG 424 Cb -0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 34.95 34.66 2fh3 s ARG 424 CO 0.27 -0.15 1.56 0.42 0.00 0.00 0.00 175.30 177.40 2fh3 s ILE 425 N 0.98 3.77 -0.43 4.11 1.09 -0.82 -2.45 121.20 127.45 2fh3 s ILE 425 Ca -0.08 0.87 0.03 0.00 -1.10 0.00 0.00 60.65 60.37 2fh3 s ILE 425 Cb -0.12 -3.76 0.12 0.00 -1.06 0.00 0.00 42.46 37.65 2fh3 s ILE 425 CO -0.03 -0.29 0.19 -1.61 -0.10 0.00 0.00 174.94 173.11 2fh3 s GLU 426 N 4.51 1.51 7.45 2.79 2.02 0.62 -4.73 118.70 132.87 2fh3 s GLU 426 Ca 0.69 -2.10 0.00 0.00 0.02 0.00 0.00 54.97 53.58 2fh3 s GLU 426 Cb -0.24 -2.82 0.00 0.00 0.10 0.00 0.00 34.13 31.16 2fh3 s GLU 426 CO 0.28 -1.08 0.00 0.41 0.02 0.00 0.00 175.26 174.89 2fh3 n GLY 427 N 3.67 2.72 0.08 -1.39 0.00 -1.26 -2.18 105.19 106.83 2fh3 n GLY 427 Ca 0.05 -0.26 0.15 0.00 0.00 0.00 0.00 46.02 45.96 2fh3 n GLY 427 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2fh3 n SER 428 N 5.98 0.31 -4.61 1.61 7.64 -1.26 -4.84 113.62 118.45 2fh3 n SER 428 Ca 0.00 -0.58 -0.30 0.00 1.01 0.00 0.00 58.87 58.99 2fh3 n SER 428 Cb 0.00 -0.11 -0.10 0.00 -1.01 0.00 0.00 64.21 62.99 2fh3 n SER 428 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2fh3 s ASN 429 N -2.39 4.60 -0.16 6.43 0.01 -0.93 -4.92 114.94 117.58 2fh3 s ASN 429 Ca 0.33 -0.27 -0.09 0.00 -0.71 0.00 0.00 52.86 52.12 2fh3 s ASN 429 Cb 0.21 -0.98 -0.05 0.00 0.41 0.00 0.00 41.25 40.84 2fh3 s ASN 429 CO 0.44 0.21 0.13 -1.59 -1.51 0.00 0.00 177.10 174.78 2fh3 s LYS 430 N -2.01 3.84 -0.07 -0.60 -2.85 -1.26 -0.28 119.74 116.50 2fh3 s LYS 430 Ca 0.21 -0.18 0.04 0.00 -1.00 0.00 0.00 55.97 55.04 2fh3 s LYS 430 Cb -0.11 -3.31 0.00 0.00 -2.06 0.00 0.00 37.83 32.35 2fh3 s LYS 430 CO 0.13 0.52 -0.18 0.08 0.10 0.00 0.00 175.35 176.00 2fh3 s VAL 431 N -0.28 1.59 0.28 1.79 1.01 -1.02 -4.91 120.40 118.86 2fh3 s VAL 431 Ca 0.11 -0.77 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 2fh3 s VAL 431 Cb -0.11 -1.39 -0.11 0.00 0.00 0.00 0.00 36.38 34.77 2fh3 s VAL 431 CO 0.01 0.46 1.58 -2.84 0.00 0.00 0.00 175.10 174.30 2fh3 s PRO 432 N 0.30 4.14 0.25 2.72 0.02 -1.26 -1.34 135.00 139.84 2fh3 s PRO 432 Ca -0.12 2.54 -0.29 0.00 0.02 0.00 0.00 61.00 63.15 2fh3 s PRO 432 Cb -0.15 -3.04 -0.09 0.00 0.02 0.00 0.00 34.50 31.24 2fh3 s PRO 432 CO 0.05 -0.61 0.95 0.08 -0.33 0.00 0.00 177.00 177.14 2fh3 s VAL 433 N 0.05 4.06 -0.27 3.83 1.01 -0.19 -4.88 120.40 124.02 2fh3 s VAL 433 Ca 0.63 2.02 -0.38 0.00 0.00 0.00 0.00 61.98 64.25 2fh3 s VAL 433 Cb -0.47 -4.26 -0.14 0.00 0.00 0.00 0.00 36.38 31.51 2fh3 s VAL 433 CO 0.47 0.44 1.90 -0.67 0.00 0.00 0.00 175.10 177.23 2fh3 n ASP 434 N 1.33 2.51 -0.24 3.32 4.64 -1.26 -4.83 116.55 122.02 2fh3 n ASP 434 Ca -0.01 0.88 0.32 0.00 -1.38 0.00 0.00 54.79 54.59 2fh3 n ASP 434 Cb 0.47 -1.21 0.72 0.00 -1.04 0.00 0.00 41.12 40.06 2fh3 n ASP 434 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 2fh3 h PRO 435 N 8.99 0.00 0.00 -0.67 0.11 -1.95 0.90 132.00 139.38 2fh3 h PRO 435 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2fh3 h PRO 435 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2fh3 h PRO 435 CO 0.98 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.77 2fh3 n ALA 436 N -2.64 2.08 -0.54 -0.75 0.00 -1.26 -3.23 120.51 114.16 2fh3 n ALA 436 Ca 0.22 -0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.71 2fh3 n ALA 436 Cb 1.17 -1.42 0.22 0.00 0.00 0.00 0.00 19.45 19.42 2fh3 n ALA 436 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2fh3 n THR 437 N -1.96 1.59 -1.68 0.00 -2.24 0.31 -5.00 114.28 105.30 2fh3 n THR 437 Ca 0.05 -1.35 -0.43 0.00 -2.27 0.00 0.00 64.05 60.04 2fh3 n THR 437 Cb 0.33 0.17 -0.03 0.00 -2.10 0.00 0.00 70.33 68.69 2fh3 n THR 437 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2fh3 n TYR 438 N 0.22 2.55 0.00 4.78 0.53 -1.20 -0.54 117.16 123.51 2fh3 n TYR 438 Ca 0.17 -0.16 0.00 0.00 -1.02 0.00 0.00 57.90 56.89 2fh3 n TYR 438 Cb 0.66 -2.73 0.00 0.00 -1.03 0.00 0.00 39.34 36.24 2fh3 n TYR 438 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2fh3 n GLY 439 N 4.28 2.57 3.57 2.72 0.00 -1.26 -5.02 105.19 112.05 2fh3 n GLY 439 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2fh3 n GLY 439 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2fh3 s GLN 440 N -0.34 3.86 0.14 1.61 1.11 0.30 -1.22 119.66 125.12 2fh3 s GLN 440 Ca 0.00 -0.40 0.04 0.00 0.01 0.00 0.00 55.36 55.01 2fh3 s GLN 440 Cb 0.00 -3.20 -0.04 0.00 -1.01 0.00 0.00 33.01 28.76 2fh3 s GLN 440 CO 0.00 0.17 -0.10 -0.06 0.01 0.00 0.00 175.29 175.31 2fh3 s PHE 441 N 0.64 1.23 -0.22 0.91 0.40 1.00 -4.97 117.98 116.97 2fh3 s PHE 441 Ca 0.02 -0.77 -0.10 0.00 -0.60 0.00 0.00 56.93 55.48 2fh3 s PHE 441 Cb -0.13 -0.63 -0.05 0.00 0.51 0.00 0.00 43.02 42.71 2fh3 s PHE 441 CO 0.02 0.06 0.15 0.71 0.70 0.00 0.00 175.22 176.86 2fh3 s TYR 442 N -3.35 3.35 0.58 0.36 2.02 -1.26 -0.35 117.35 118.70 2fh3 s TYR 442 Ca 0.16 0.27 0.28 0.00 -0.37 0.00 0.00 57.07 57.41 2fh3 s TYR 442 Cb 0.03 -2.23 1.68 0.00 -0.40 0.00 0.00 41.96 41.04 2fh3 s TYR 442 CO 0.00 0.16 2.16 0.78 -1.57 0.00 0.00 175.55 177.08 2fh3 h GLY 443 N 7.17 0.00 -2.65 0.71 0.00 -0.29 -1.06 103.07 106.95 2fh3 h GLY 443 Ca -0.39 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 2fh3 h GLY 443 CO 0.70 0.00 0.07 0.61 0.00 0.00 0.00 176.54 177.91 2fh3 n GLY 444 N -1.39 2.58 3.08 4.60 0.00 -0.39 -0.69 105.19 112.98 2fh3 n GLY 444 Ca -0.00 -0.57 -0.11 0.00 0.00 0.00 0.00 46.02 45.33 2fh3 n GLY 444 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2fh3 s ASP 445 N -0.45 0.81 0.13 1.61 1.01 -0.40 -3.65 116.67 115.73 2fh3 s ASP 445 Ca 0.33 -0.70 0.02 0.00 0.71 0.00 0.00 52.55 52.91 2fh3 s ASP 445 Cb 0.26 0.07 -0.04 0.00 1.01 0.00 0.00 42.92 44.22 2fh3 s ASP 445 CO 0.09 -0.32 0.24 -0.44 0.21 0.00 0.00 175.17 174.95 2fh3 s SER 446 N -2.05 6.23 0.04 0.27 0.01 -1.26 -0.29 113.70 116.64 2fh3 s SER 446 Ca -0.04 0.16 -0.05 0.00 1.31 0.00 0.00 55.95 57.33 2fh3 s SER 446 Cb -0.05 -1.86 -0.01 0.00 0.21 0.00 0.00 66.02 64.31 2fh3 s SER 446 CO -0.02 0.09 0.08 -0.31 0.41 0.00 0.00 173.24 173.49 2fh3 s TYR 447 N -1.67 0.24 -0.10 2.43 1.51 -0.15 -1.95 117.35 117.66 2fh3 s TYR 447 Ca 0.34 -0.58 0.03 0.00 -1.01 0.00 0.00 57.07 55.85 2fh3 s TYR 447 Cb -0.11 -0.17 -0.00 0.00 -0.11 0.00 0.00 41.96 41.56 2fh3 s TYR 447 CO 0.28 -0.37 -0.21 0.42 -1.11 0.00 0.00 175.55 174.55 2fh3 s ILE 448 N -2.80 2.31 -0.18 2.71 1.01 -0.57 -1.67 121.20 122.01 2fh3 s ILE 448 Ca -0.03 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 59.68 2fh3 s ILE 448 Cb -0.00 -1.90 0.01 0.00 0.01 0.00 0.00 42.46 40.58 2fh3 s ILE 448 CO -0.06 0.55 -0.18 -0.63 0.00 0.00 0.00 174.94 174.63 2fh3 s ILE 449 N 0.27 2.27 -0.16 2.92 1.01 -0.02 -0.39 121.20 127.11 2fh3 s ILE 449 Ca -0.15 -0.87 -0.15 0.00 0.00 0.00 0.00 60.65 59.48 2fh3 s ILE 449 Cb -0.17 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.29 2fh3 s ILE 449 CO 0.08 0.52 0.36 -0.22 0.00 0.00 0.00 174.94 175.68 2fh3 s LEU 450 N 1.25 4.22 0.03 2.97 2.96 0.45 -0.46 118.68 130.11 2fh3 s LEU 450 Ca 0.04 0.57 0.04 0.00 -0.22 0.00 0.00 54.13 54.55 2fh3 s LEU 450 Cb -0.13 -2.48 -0.02 0.00 0.50 0.00 0.00 46.19 44.06 2fh3 s LEU 450 CO -0.10 0.03 -0.12 -0.47 -1.32 0.00 0.00 176.35 174.37 2fh3 s TYR 451 N 0.74 1.05 -0.25 5.38 5.04 0.38 -0.24 117.35 129.44 2fh3 s TYR 451 Ca 0.19 -0.33 -0.01 0.00 -2.44 0.00 0.00 57.07 54.48 2fh3 s TYR 451 Cb -0.14 -0.63 0.03 0.00 0.35 0.00 0.00 41.96 41.57 2fh3 s TYR 451 CO 0.06 0.01 -0.06 -0.80 -1.34 0.00 0.00 175.55 173.42 2fh3 s ASN 452 N -1.00 4.34 -0.11 4.32 -0.87 -1.04 -0.93 114.94 119.65 2fh3 s ASN 452 Ca 0.00 -0.93 -0.29 0.00 -1.57 0.00 0.00 52.86 50.07 2fh3 s ASN 452 Cb -0.07 -1.66 -0.06 0.00 -0.02 0.00 0.00 41.25 39.45 2fh3 s ASN 452 CO 0.01 -0.14 1.88 -0.31 -2.57 0.00 0.00 177.10 175.97 2fh3 s TYR 453 N 1.31 1.60 -0.68 2.20 1.51 -0.23 -4.17 117.35 118.89 2fh3 s TYR 453 Ca -0.01 0.16 0.00 0.00 -1.01 0.00 0.00 57.07 56.22 2fh3 s TYR 453 Cb -0.17 -4.05 0.00 0.00 -0.11 0.00 0.00 41.96 37.63 2fh3 s TYR 453 CO -0.04 -4.20 0.10 -2.13 -1.11 0.00 0.00 175.55 168.17 2fh3 n ARG 454 N 7.81 0.16 -0.19 -0.62 3.00 -1.26 -4.97 116.66 120.58 2fh3 n ARG 454 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.06 2fh3 n ARG 454 Cb 0.43 -1.19 0.00 0.00 0.00 0.00 0.00 32.46 31.71 2fh3 n ARG 454 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 2fh3 n GLN 459 N 0.58 0.00 0.00 -0.14 1.13 -1.26 -5.08 117.38 112.62 2fh3 n GLN 459 Ca 0.00 0.00 0.10 0.00 -1.94 0.00 0.00 57.00 55.16 2fh3 n GLN 459 Cb 0.05 0.00 0.06 0.00 0.11 0.00 0.00 30.24 30.46 2fh3 n GLN 459 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2fh3 n GLY 460 N 0.13 0.50 3.05 1.08 0.00 -1.26 -4.93 105.19 103.75 2fh3 n GLY 460 Ca 0.00 -0.61 -0.22 0.00 0.00 0.00 0.00 46.02 45.19 2fh3 n GLY 460 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2fh3 s GLN 461 N -1.95 1.20 -0.03 1.61 -0.21 -1.26 -1.07 119.66 117.96 2fh3 s GLN 461 Ca 0.22 -0.41 0.05 0.00 0.02 0.00 0.00 55.36 55.25 2fh3 s GLN 461 Cb 0.17 -1.10 -0.01 0.00 1.00 0.00 0.00 33.01 33.08 2fh3 s GLN 461 CO 0.35 0.17 -0.19 -1.50 -2.12 0.00 0.00 175.29 172.00 2fh3 s ILE 462 N 0.09 1.52 -0.24 1.08 2.07 -0.10 -1.41 121.20 124.22 2fh3 s ILE 462 Ca -0.02 -0.80 -0.09 0.00 -1.41 0.00 0.00 60.65 58.32 2fh3 s ILE 462 Cb -0.09 -1.29 -0.04 0.00 0.13 0.00 0.00 42.46 41.17 2fh3 s ILE 462 CO 0.01 0.43 0.13 -0.63 -1.91 0.00 0.00 174.94 172.97 2fh3 s ILE 463 N -0.23 5.00 -0.15 2.00 1.01 0.69 -0.47 121.20 129.05 2fh3 s ILE 463 Ca 0.02 0.06 -0.09 0.00 0.00 0.00 0.00 60.65 60.64 2fh3 s ILE 463 Cb -0.10 -3.33 -0.04 0.00 0.01 0.00 0.00 42.46 39.00 2fh3 s ILE 463 CO 0.01 0.34 0.15 -0.31 0.00 0.00 0.00 174.94 175.13 2fh3 s TYR 464 N 1.22 3.52 -0.37 3.97 2.02 0.40 -0.76 117.35 127.34 2fh3 s TYR 464 Ca 0.06 0.46 -0.08 0.00 -0.37 0.00 0.00 57.07 57.14 2fh3 s TYR 464 Cb -0.14 -2.06 0.05 0.00 -0.40 0.00 0.00 41.96 39.40 2fh3 s TYR 464 CO 0.05 0.53 0.17 -0.80 -1.57 0.00 0.00 175.55 173.93 2fh3 s ASN 465 N -0.38 5.51 -0.30 2.29 -0.87 0.08 -0.84 114.94 120.43 2fh3 s ASN 465 Ca 0.12 -1.21 -0.10 0.00 -1.57 0.00 0.00 52.86 50.10 2fh3 s ASN 465 Cb -0.12 -1.94 -0.02 0.00 -0.02 0.00 0.00 41.25 39.15 2fh3 s ASN 465 CO 0.02 -0.40 0.17 0.86 -2.57 0.00 0.00 177.10 175.18 2fh3 s TRP 466 N 1.44 3.19 -0.45 2.20 -0.00 -0.67 -0.46 118.94 124.19 2fh3 s TRP 466 Ca 0.01 -0.30 -0.15 0.00 -0.00 0.00 0.00 56.10 55.66 2fh3 s TRP 466 Cb -0.20 -2.38 0.06 0.00 -0.00 0.00 0.00 33.47 30.95 2fh3 s TRP 466 CO 0.04 -0.35 0.35 -1.14 -0.00 0.00 0.00 176.95 175.84 2fh3 s GLN 467 N 1.67 2.94 0.24 5.86 0.74 0.14 -0.98 119.66 130.28 2fh3 s GLN 467 Ca 0.06 -1.26 -0.31 0.00 0.05 0.00 0.00 55.36 53.90 2fh3 s GLN 467 Cb -0.17 -4.05 -0.13 0.00 1.10 0.00 0.00 33.01 29.76 2fh3 s GLN 467 CO 0.08 -0.93 1.38 0.41 -0.55 0.00 0.00 175.29 175.68 2fh3 n GLY 468 N 5.16 0.71 0.47 2.59 0.00 0.60 -1.51 105.19 113.20 2fh3 n GLY 468 Ca -0.12 0.48 0.25 0.00 0.00 0.00 0.00 46.02 46.63 2fh3 n GLY 468 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fh3 h ALA 469 N 4.02 2.57 -0.23 4.61 0.00 -1.79 0.13 119.26 128.57 2fh3 h ALA 469 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2fh3 h ALA 469 Cb 1.28 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2fh3 h ALA 469 CO 0.74 -1.24 0.00 1.04 0.00 0.00 0.00 179.25 179.79 2fh3 n GLN 470 N -3.46 1.96 -1.95 0.00 3.00 0.14 -5.01 117.38 112.05 2fh3 n GLN 470 Ca 0.16 -1.74 -0.42 0.00 -0.01 0.00 0.00 57.00 55.00 2fh3 n GLN 470 Cb 1.11 -1.27 -0.02 0.00 0.00 0.00 0.00 30.24 30.05 2fh3 n GLN 470 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2fh3 s SER 471 N -1.01 6.59 0.80 1.08 0.15 0.44 -4.66 113.70 117.08 2fh3 s SER 471 Ca 0.21 2.71 -0.11 0.00 0.70 0.00 0.00 55.95 59.45 2fh3 s SER 471 Cb 0.12 -2.62 0.07 0.00 -1.71 0.00 0.00 66.02 61.88 2fh3 s SER 471 CO 0.16 -0.77 1.09 0.42 1.20 0.00 0.00 173.24 175.35 2fh3 s THR 472 N 0.25 3.13 0.23 6.45 -4.23 -1.26 -4.86 115.64 115.34 2fh3 s THR 472 Ca 0.62 0.37 -0.07 0.00 -1.18 0.00 0.00 61.69 61.44 2fh3 s THR 472 Cb -0.43 -3.08 0.18 0.00 1.34 0.00 0.00 72.50 70.51 2fh3 s THR 472 CO 0.41 -0.48 1.82 -0.61 -0.54 0.00 0.00 174.62 175.23 2fh3 h GLN 473 N -1.10 1.20 -0.23 3.99 -0.00 -1.99 -2.02 115.11 114.96 2fh3 h GLN 473 Ca -0.47 -0.18 -0.07 0.00 -0.00 0.00 0.00 58.65 57.93 2fh3 h GLN 473 Cb 1.26 -0.21 -0.01 0.00 0.00 0.00 0.00 27.48 28.52 2fh3 h GLN 473 CO 0.58 0.92 -0.18 0.38 0.00 0.00 0.00 178.83 180.53 2fh3 h ASP 474 N 1.18 0.39 -0.34 -0.69 -0.00 -1.98 0.23 116.42 115.21 2fh3 h ASP 474 Ca 0.28 -0.11 -0.07 0.00 -0.00 0.00 0.00 57.03 57.13 2fh3 h ASP 474 Cb 0.13 -0.10 -0.01 0.00 -0.00 0.00 0.00 39.33 39.35 2fh3 h ASP 474 CO -0.03 0.59 -0.07 -0.33 -0.00 0.00 0.00 179.24 179.39 2fh3 h GLU 475 N 0.36 0.64 -0.39 4.15 5.08 -1.82 0.15 114.58 122.77 2fh3 h GLU 475 Ca 0.06 -0.24 0.02 0.00 -1.00 0.00 0.00 59.36 58.20 2fh3 h GLU 475 Cb 0.54 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2fh3 h GLU 475 CO 0.04 0.81 0.22 0.28 -1.00 0.00 0.00 179.01 179.36 2fh3 h VAL 476 N 0.43 1.03 -0.74 3.13 2.07 -0.75 -1.05 116.25 120.37 2fh3 h VAL 476 Ca 0.09 -0.15 0.01 0.00 0.82 0.00 0.00 66.70 67.46 2fh3 h VAL 476 Cb 0.57 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 2fh3 h VAL 476 CO 0.03 0.08 0.49 0.00 0.02 0.00 0.00 177.57 178.19 2fh3 h ALA 477 N 1.18 0.94 -0.05 1.67 0.00 -0.52 -2.32 119.26 120.16 2fh3 h ALA 477 Ca 0.15 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2fh3 h ALA 477 Cb 0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2fh3 h ALA 477 CO -0.08 0.34 -0.22 0.00 0.00 0.00 0.00 179.25 179.29 2fh3 h ALA 478 N 1.28 1.53 -0.24 0.00 0.00 -0.63 -3.09 119.26 118.11 2fh3 h ALA 478 Ca 0.28 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2fh3 h ALA 478 Cb -0.10 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2fh3 h ALA 478 CO -0.07 0.34 -0.05 1.03 0.00 0.00 0.00 179.25 180.51 2fh3 h SER 479 N 0.08 0.45 -0.43 0.00 0.87 -0.63 -0.62 113.55 113.27 2fh3 h SER 479 Ca 0.01 -0.36 0.06 0.00 -1.23 0.00 0.00 61.79 60.27 2fh3 h SER 479 Cb 0.44 -0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.23 2fh3 h SER 479 CO 0.03 0.70 0.14 0.00 -0.53 0.00 0.00 176.83 177.18 2fh3 h ALA 480 N 0.77 0.51 -0.11 6.23 0.00 -1.43 0.43 119.26 125.66 2fh3 h ALA 480 Ca 0.06 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2fh3 h ALA 480 Cb 0.50 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 2fh3 h ALA 480 CO 0.02 -0.25 0.03 0.82 0.00 0.00 0.00 179.25 179.88 2fh3 h ILE 481 N 0.31 1.18 -0.09 0.00 2.04 -1.50 -2.21 117.51 117.23 2fh3 h ILE 481 Ca 0.20 -0.55 -0.09 0.00 1.00 0.00 0.00 64.86 65.41 2fh3 h ILE 481 Cb 0.20 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 2fh3 h ILE 481 CO -0.21 0.16 -0.37 -0.07 0.00 0.00 0.00 178.15 177.66 2fh3 h LEU 482 N -0.01 0.20 -0.27 1.44 3.38 -0.86 -2.22 115.31 116.96 2fh3 h LEU 482 Ca 0.04 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 2fh3 h LEU 482 Cb 0.23 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2fh3 h LEU 482 CO -0.00 0.55 -0.07 0.74 0.09 0.00 0.00 178.44 179.75 2fh3 h THR 483 N 0.16 1.28 -0.67 0.22 2.02 -0.12 -2.45 112.91 113.36 2fh3 h THR 483 Ca 0.02 -1.10 -0.04 0.00 0.77 0.00 0.00 66.41 66.06 2fh3 h THR 483 Cb 0.73 1.44 -0.03 0.00 -1.74 0.00 0.00 68.15 68.56 2fh3 h THR 483 CO 0.06 0.35 0.27 0.00 0.37 0.00 0.00 175.52 176.56 2fh3 h ALA 484 N 0.77 0.88 -0.12 6.16 0.00 -1.27 0.32 119.26 125.99 2fh3 h ALA 484 Ca 0.07 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.84 2fh3 h ALA 484 Cb 0.55 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2fh3 h ALA 484 CO 0.03 0.50 -0.11 0.37 0.00 0.00 0.00 179.25 180.03 2fh3 h GLN 485 N 0.96 -0.12 -0.95 0.00 4.15 -1.42 0.73 115.11 118.46 2fh3 h GLN 485 Ca 0.22 0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.66 2fh3 h GLN 485 Cb 0.21 0.03 -0.05 0.00 0.21 0.00 0.00 27.48 27.88 2fh3 h GLN 485 CO -0.02 -0.08 0.61 1.25 -1.93 0.00 0.00 178.83 178.66 2fh3 h LEU 486 N -0.13 1.10 -1.08 -2.39 5.85 -0.92 -1.35 115.31 116.39 2fh3 h LEU 486 Ca 0.08 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2fh3 h LEU 486 Cb 0.25 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 2fh3 h LEU 486 CO -0.20 0.81 0.58 -0.78 -0.34 0.00 0.00 178.44 178.51 2fh3 h ASP 487 N 1.29 1.05 -0.12 1.25 -0.00 0.16 0.02 116.42 120.07 2fh3 h ASP 487 Ca 0.34 -0.04 -0.02 0.00 -0.00 0.00 0.00 57.03 57.31 2fh3 h ASP 487 Cb -0.12 -0.26 -0.00 0.00 -0.00 0.00 0.00 39.33 38.94 2fh3 h ASP 487 CO -0.07 0.78 -0.02 -0.08 -0.00 0.00 0.00 179.24 179.85 2fh3 h GLU 488 N 1.23 0.22 -0.64 0.28 4.81 -0.40 0.29 114.58 120.38 2fh3 h GLU 488 Ca 0.33 -0.08 0.03 0.00 -0.13 0.00 0.00 59.36 59.51 2fh3 h GLU 488 Cb -0.11 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 2fh3 h GLU 488 CO -0.07 0.51 0.42 1.49 -0.73 0.00 0.00 179.01 180.63 2fh3 h GLU 489 N -0.08 0.75 0.00 1.92 4.81 -1.01 -1.85 114.58 119.12 2fh3 h GLU 489 Ca 0.03 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2fh3 h GLU 489 Cb 0.42 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.63 2fh3 h GLU 489 CO 0.01 0.50 -0.09 1.28 -0.73 0.00 0.00 179.01 179.97 2fh3 n LEU 490 N -4.46 0.77 0.00 1.64 4.32 -0.03 -4.93 117.00 114.31 2fh3 n LEU 490 Ca 0.08 0.52 0.00 0.00 -0.02 0.00 0.00 56.01 56.58 2fh3 n LEU 490 Cb 0.12 -0.30 0.00 0.00 -1.62 0.00 0.00 43.42 41.61 2fh3 n LEU 490 CO 0.35 -0.15 0.00 0.61 -1.22 0.00 0.00 177.39 176.97 2fh3 n GLY 491 N 1.32 0.99 2.59 -0.72 0.00 -0.70 -4.34 105.19 104.33 2fh3 n GLY 491 Ca 0.05 -0.23 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 2fh3 n GLY 491 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fh3 n GLY 492 N -2.03 0.33 0.20 -0.02 0.00 0.94 -4.89 105.19 99.72 2fh3 n GLY 492 Ca 0.00 -0.05 -0.18 0.00 0.00 0.00 0.00 46.02 45.79 2fh3 n GLY 492 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2fh3 h THR 493 N 0.00 1.30 -4.07 2.61 1.35 -1.80 -3.48 112.91 108.82 2fh3 h THR 493 Ca -0.03 -2.19 -0.46 0.00 -0.55 0.00 0.00 66.41 63.17 2fh3 h THR 493 Cb 0.64 2.26 0.02 0.00 -1.73 0.00 0.00 68.15 69.34 2fh3 h THR 493 CO 0.04 0.68 0.38 -2.84 -0.25 0.00 0.00 175.52 173.53 2fh3 s PRO 494 N -3.44 3.90 0.21 4.72 0.02 -1.26 -4.92 135.00 134.23 2fh3 s PRO 494 Ca -0.09 1.32 -0.30 0.00 0.02 0.00 0.00 61.00 61.94 2fh3 s PRO 494 Cb 0.08 -2.12 -0.09 0.00 0.02 0.00 0.00 34.50 32.39 2fh3 s PRO 494 CO 0.91 -0.34 1.27 0.08 -0.33 0.00 0.00 177.00 178.59 2fh3 s VAL 495 N -2.01 3.27 -0.15 3.83 1.01 -0.50 -4.86 120.40 120.99 2fh3 s VAL 495 Ca 0.66 1.08 -0.04 0.00 0.00 0.00 0.00 61.98 63.68 2fh3 s VAL 495 Cb -0.15 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 2fh3 s VAL 495 CO 0.19 0.18 -0.02 -1.10 0.00 0.00 0.00 175.10 174.34 2fh3 s GLN 496 N -0.36 3.65 -0.14 2.72 -0.21 -1.26 -0.22 119.66 123.83 2fh3 s GLN 496 Ca 0.54 -0.48 -0.02 0.00 0.02 0.00 0.00 55.36 55.42 2fh3 s GLN 496 Cb -0.35 -2.94 0.04 0.00 1.00 0.00 0.00 33.01 30.75 2fh3 s GLN 496 CO 0.39 0.30 -0.01 0.45 -2.12 0.00 0.00 175.29 174.30 2fh3 s SER 497 N 0.23 2.44 -0.31 5.90 0.15 0.06 -4.98 113.70 117.18 2fh3 s SER 497 Ca -0.01 -0.52 -0.13 0.00 0.70 0.00 0.00 55.95 55.99 2fh3 s SER 497 Cb -0.14 -0.66 -0.03 0.00 -1.71 0.00 0.00 66.02 63.49 2fh3 s SER 497 CO 0.02 -0.22 0.29 -0.60 1.20 0.00 0.00 173.24 173.93 2fh3 s ARG 498 N 1.82 3.74 0.04 5.44 3.00 -1.26 -0.74 118.95 130.99 2fh3 s ARG 498 Ca 0.02 -0.36 0.03 0.00 -1.00 0.00 0.00 55.73 54.42 2fh3 s ARG 498 Cb -0.15 -3.74 -0.02 0.00 0.00 0.00 0.00 34.95 31.04 2fh3 s ARG 498 CO -0.07 -0.36 -0.10 0.14 0.00 0.00 0.00 175.30 174.90 2fh3 s VAL 499 N 1.88 0.79 0.14 7.11 -7.23 0.39 -4.96 120.40 118.53 2fh3 s VAL 499 Ca 0.10 -1.03 0.05 0.00 -1.81 0.00 0.00 61.98 59.28 2fh3 s VAL 499 Cb -0.16 -0.78 -0.04 0.00 0.56 0.00 0.00 36.38 35.95 2fh3 s VAL 499 CO 0.11 -0.21 0.08 0.68 -0.31 0.00 0.00 175.10 175.45 2fh3 s VAL 500 N -1.11 4.28 0.13 1.32 -7.23 -1.26 -0.69 120.40 115.84 2fh3 s VAL 500 Ca -0.04 -1.08 -0.34 0.00 -1.81 0.00 0.00 61.98 58.70 2fh3 s VAL 500 Cb -0.09 -3.14 -0.17 0.00 0.56 0.00 0.00 36.38 33.55 2fh3 s VAL 500 CO 0.01 -0.04 1.07 1.67 -0.31 0.00 0.00 175.10 177.50 2fh3 n GLN 501 N -0.05 0.76 -0.82 4.82 7.27 -0.57 -1.06 117.38 127.74 2fh3 n GLN 501 Ca -0.09 0.27 0.00 0.00 0.07 0.00 0.00 57.00 57.25 2fh3 n GLN 501 Cb 0.54 -1.72 0.00 0.00 2.41 0.00 0.00 30.24 31.47 2fh3 n GLN 501 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2fh3 n GLY 502 N 1.95 1.12 0.67 1.69 0.00 -1.26 -4.83 105.19 104.53 2fh3 n GLY 502 Ca 0.17 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.26 2fh3 n GLY 502 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fh3 n LYS 503 N -2.00 2.23 -2.35 1.61 4.76 -0.23 -1.34 118.16 120.84 2fh3 n LYS 503 Ca 0.00 -2.83 -0.41 0.00 -2.87 0.00 0.00 58.31 52.20 2fh3 n LYS 503 Cb 0.00 -1.73 -0.03 0.00 -1.84 0.00 0.00 35.03 31.43 2fh3 n LYS 503 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2fh3 s GLU 504 N -2.92 4.52 0.76 1.97 8.01 -1.26 -4.80 118.70 124.98 2fh3 s GLU 504 Ca 0.39 1.93 -0.11 0.00 0.01 0.00 0.00 54.97 57.19 2fh3 s GLU 504 Cb 0.33 -3.18 0.05 0.00 -4.31 0.00 0.00 34.13 27.03 2fh3 s GLU 504 CO 0.05 0.01 1.10 -1.25 0.01 0.00 0.00 175.26 175.18 2fh3 s PRO 505 N -1.12 2.32 0.33 0.39 0.04 -1.26 -4.87 135.00 130.83 2fh3 s PRO 505 Ca 0.48 1.22 0.10 0.00 0.04 0.00 0.00 61.00 62.84 2fh3 s PRO 505 Cb -0.34 -1.90 0.87 0.00 0.04 0.00 0.00 34.50 33.17 2fh3 s PRO 505 CO 0.42 -1.60 1.77 0.00 0.04 0.00 0.00 177.00 177.64 2fh3 h ALA 506 N -0.95 1.85 -0.08 8.56 0.00 -1.99 -2.22 119.26 124.43 2fh3 h ALA 506 Ca -0.44 0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.57 2fh3 h ALA 506 Cb 1.23 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 2fh3 h ALA 506 CO 0.52 -0.24 -0.02 1.25 0.00 0.00 0.00 179.25 180.75 2fh3 h HIS 507 N 0.63 -0.05 -0.94 0.00 -0.00 -1.94 -1.28 115.15 111.57 2fh3 h HIS 507 Ca 0.59 0.01 0.06 0.00 -0.00 0.00 0.00 60.37 61.03 2fh3 h HIS 507 Cb 1.11 0.03 -0.06 0.00 -0.00 0.00 0.00 27.41 28.49 2fh3 h HIS 507 CO -0.00 -0.04 0.61 1.25 -0.00 0.00 0.00 177.93 179.75 2fh3 h LEU 508 N -0.00 0.96 -1.51 0.26 5.85 -1.78 -1.87 115.31 117.22 2fh3 h LEU 508 Ca 0.04 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 2fh3 h LEU 508 Cb 0.06 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 2fh3 h LEU 508 CO -0.08 0.61 -0.01 0.24 -0.34 0.00 0.00 178.44 178.86 2fh3 h MET 509 N 1.09 0.00 -0.00 1.25 2.86 -0.98 -2.58 114.93 116.56 2fh3 h MET 509 Ca 0.40 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.04 2fh3 h MET 509 Cb 0.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.84 2fh3 h MET 509 CO -0.15 0.01 -0.28 -1.13 1.06 0.00 0.00 176.91 176.42 2fh3 n SER 510 N -3.10 0.61 0.00 1.22 3.41 -0.55 -4.14 113.62 111.08 2fh3 n SER 510 Ca 0.00 -0.46 0.03 0.00 -0.26 0.00 0.00 58.87 58.18 2fh3 n SER 510 Cb 0.30 0.06 0.14 0.00 -0.26 0.00 0.00 64.21 64.45 2fh3 n SER 510 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2fh3 n LEU 511 N -1.09 0.00 -0.64 1.04 4.32 -0.97 -3.33 117.00 116.33 2fh3 n LEU 511 Ca 0.10 0.25 0.06 0.00 -0.02 0.00 0.00 56.01 56.40 2fh3 n LEU 511 Cb 0.33 -0.25 0.16 0.00 -1.62 0.00 0.00 43.42 42.04 2fh3 n LEU 511 CO 0.28 -0.21 0.35 0.49 -1.22 0.00 0.00 177.39 177.09 2fh3 n PHE 512 N -1.25 0.00 -2.06 -1.77 3.01 -1.26 -4.91 117.46 109.22 2fh3 n PHE 512 Ca 0.03 -1.20 -0.19 0.00 1.01 0.00 0.00 57.45 57.10 2fh3 n PHE 512 Cb 0.04 -0.21 -0.03 0.00 -0.01 0.00 0.00 39.48 39.27 2fh3 n PHE 512 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2fh3 n GLY 513 N -0.89 0.40 1.58 1.37 0.00 -1.21 -2.15 105.19 104.29 2fh3 n GLY 513 Ca 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2fh3 n GLY 513 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fh3 n GLY 514 N -0.90 2.38 3.77 -0.02 0.00 -1.26 -5.03 105.19 104.13 2fh3 n GLY 514 Ca -0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 2fh3 n GLY 514 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fh3 s LYS 515 N -0.55 4.08 0.79 1.61 2.47 -0.92 -4.99 119.74 122.23 2fh3 s LYS 515 Ca 0.00 2.29 -0.11 0.00 -1.56 0.00 0.00 55.97 56.59 2fh3 s LYS 515 Cb 0.00 -2.88 0.07 0.00 -1.46 0.00 0.00 37.83 33.56 2fh3 s LYS 515 CO 0.00 -0.45 1.09 -1.25 0.16 0.00 0.00 175.35 174.90 2fh3 s PRO 516 N -2.10 2.11 -0.22 4.03 0.04 -1.26 -4.71 135.00 132.88 2fh3 s PRO 516 Ca 0.54 0.85 -0.25 0.00 0.04 0.00 0.00 61.00 62.19 2fh3 s PRO 516 Cb -0.41 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.22 2fh3 s PRO 516 CO 0.54 -1.66 0.84 1.41 0.04 0.00 0.00 177.00 178.17 2fh3 s MET 517 N -5.03 4.22 -0.25 4.56 1.75 -0.74 -4.83 119.30 118.98 2fh3 s MET 517 Ca 0.61 0.98 -0.10 0.00 -1.25 0.00 0.00 55.69 55.93 2fh3 s MET 517 Cb -0.16 -3.62 -0.05 0.00 2.84 0.00 0.00 34.83 33.84 2fh3 s MET 517 CO 0.55 -0.47 0.15 0.42 -0.65 0.00 0.00 175.02 175.02 2fh3 s ILE 518 N 2.65 5.12 -0.30 10.11 1.01 -0.36 -0.40 121.20 139.03 2fh3 s ILE 518 Ca 0.36 0.10 -0.02 0.00 0.00 0.00 0.00 60.65 61.09 2fh3 s ILE 518 Cb -0.16 -3.40 0.05 0.00 0.01 0.00 0.00 42.46 38.96 2fh3 s ILE 518 CO 0.09 0.32 0.01 -0.63 0.00 0.00 0.00 174.94 174.72 2fh3 s ILE 519 N 1.35 3.07 0.37 2.92 1.09 0.18 -0.00 121.20 130.19 2fh3 s ILE 519 Ca 0.07 -1.33 -0.18 0.00 -1.10 0.00 0.00 60.65 58.11 2fh3 s ILE 519 Cb -0.15 -2.75 -0.10 0.00 -1.06 0.00 0.00 42.46 38.40 2fh3 s ILE 519 CO 0.06 -0.09 0.84 -0.31 -0.10 0.00 0.00 174.94 175.34 2fh3 s TYR 520 N 1.27 3.35 0.19 3.97 4.12 0.53 -0.89 117.35 129.89 2fh3 s TYR 520 Ca -0.05 1.41 -0.31 0.00 0.02 0.00 0.00 57.07 58.15 2fh3 s TYR 520 Cb -0.20 -2.69 -0.09 0.00 -1.52 0.00 0.00 41.96 37.46 2fh3 s TYR 520 CO -0.01 0.00 1.42 0.15 0.02 0.00 0.00 175.55 177.14 2fh3 s LYS 521 N -3.05 4.30 1.46 -0.62 1.02 -1.26 0.26 119.74 121.85 2fh3 s LYS 521 Ca 0.58 2.20 0.00 0.00 0.02 0.00 0.00 55.97 58.77 2fh3 s LYS 521 Cb -0.10 -3.17 0.00 0.00 -0.52 0.00 0.00 37.83 34.04 2fh3 s LYS 521 CO 0.15 -0.42 0.00 0.41 -0.92 0.00 0.00 175.35 174.57 2fh3 n GLY 522 N 2.82 0.41 0.00 -3.33 0.00 -1.26 -4.86 105.19 98.97 2fh3 n GLY 522 Ca 0.09 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.69 2fh3 n GLY 522 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fh3 n GLY 523 N 0.00 0.67 3.60 -0.02 0.00 -1.26 -1.27 105.19 106.92 2fh3 n GLY 523 Ca 0.00 -1.84 -0.29 0.00 0.00 0.00 0.00 46.02 43.89 2fh3 n GLY 523 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2fh3 s THR 524 N -2.44 3.48 0.05 2.61 -1.32 -1.26 -0.98 115.64 115.78 2fh3 s THR 524 Ca 0.00 -1.30 0.00 0.00 -1.21 0.00 0.00 61.69 59.18 2fh3 s THR 524 Cb 0.00 -2.66 -0.03 0.00 -1.51 0.00 0.00 72.50 68.30 2fh3 s THR 524 CO 0.00 0.06 -0.04 -0.94 -2.21 0.00 0.00 174.62 171.48 2fh3 s SER 525 N -2.39 0.59 0.16 8.08 1.04 -1.12 -4.89 113.70 115.17 2fh3 s SER 525 Ca 0.23 -0.82 -0.16 0.00 0.48 0.00 0.00 55.95 55.69 2fh3 s SER 525 Cb -0.11 0.13 0.08 0.00 0.10 0.00 0.00 66.02 66.23 2fh3 s SER 525 CO 0.15 -0.45 1.75 -0.09 0.98 0.00 0.00 173.24 175.58 2fh3 h ARG 526 N 3.67 0.27 -0.18 4.02 2.43 -1.97 -0.80 114.38 121.81 2fh3 h ARG 526 Ca -0.34 -0.02 -0.19 0.00 -0.81 0.00 0.00 59.98 58.62 2fh3 h ARG 526 Cb 1.17 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 2fh3 h ARG 526 CO 0.56 0.18 -0.65 0.93 -1.51 0.00 0.00 179.97 179.48 2fh3 h GLU 527 N 0.27 0.69 0.00 0.20 3.07 -2.05 -3.38 114.58 113.38 2fh3 h GLU 527 Ca 0.18 -0.49 0.00 0.00 -0.50 0.00 0.00 59.36 58.55 2fh3 h GLU 527 Cb 0.17 0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 2fh3 h GLU 527 CO -0.19 1.11 -0.43 0.41 -1.40 0.00 0.00 179.01 178.51 2fh3 n GLY 528 N 0.47 0.18 7.00 -3.84 0.00 -1.14 -5.12 105.19 102.75 2fh3 n GLY 528 Ca -0.05 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2fh3 n GLY 528 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fh3 n GLY 529 N 1.22 -1.05 3.70 -0.02 0.00 -0.32 -4.81 105.19 103.92 2fh3 n GLY 529 Ca 0.02 -1.15 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 2fh3 n GLY 529 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2fh3 s GLN 530 N 0.00 4.37 0.89 1.61 2.00 -1.26 -2.79 119.66 124.48 2fh3 s GLN 530 Ca 0.00 1.81 -0.12 0.00 -2.00 0.00 0.00 55.36 55.05 2fh3 s GLN 530 Cb 0.00 -3.44 0.12 0.00 0.80 0.00 0.00 33.01 30.50 2fh3 s GLN 530 CO 0.00 -0.39 1.10 0.95 -0.50 0.00 0.00 175.29 176.45 2fh3 s THR 531 N 1.63 2.56 -0.13 -0.34 -4.23 -0.15 -4.98 115.64 110.00 2fh3 s THR 531 Ca 0.59 0.18 -0.01 0.00 -1.18 0.00 0.00 61.69 61.28 2fh3 s THR 531 Cb -0.29 -2.78 -0.02 0.00 1.34 0.00 0.00 72.50 70.75 2fh3 s THR 531 CO 0.27 -0.24 -0.10 0.00 -0.54 0.00 0.00 174.62 174.01 2fh3 s ALA 532 N -3.05 2.75 0.49 3.99 0.00 -1.26 -4.86 121.76 119.82 2fh3 s ALA 532 Ca 0.63 -0.87 -0.24 0.00 0.00 0.00 0.00 51.96 51.49 2fh3 s ALA 532 Cb -0.17 -1.31 -0.07 0.00 0.00 0.00 0.00 23.12 21.57 2fh3 s ALA 532 CO 0.56 0.26 1.30 -0.35 0.00 0.00 0.00 175.76 177.54 2fh3 n PRO 533 N 3.43 1.82 -1.70 0.00 -0.04 -1.26 -4.97 135.00 132.28 2fh3 n PRO 533 Ca -0.18 0.66 -0.32 0.00 -0.04 0.00 0.00 63.50 63.61 2fh3 n PRO 533 Cb 0.53 -2.48 0.05 0.00 -0.04 0.00 0.00 33.50 31.56 2fh3 n PRO 533 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fh3 s ALA 534 N -1.26 2.51 -0.08 0.55 0.00 -1.26 -4.98 121.76 117.24 2fh3 s ALA 534 Ca 0.66 0.40 0.13 0.00 0.00 0.00 0.00 51.96 53.15 2fh3 s ALA 534 Cb -0.46 -3.27 -0.06 0.00 0.00 0.00 0.00 23.12 19.33 2fh3 s ALA 534 CO 0.54 -1.26 1.21 0.66 0.00 0.00 0.00 175.76 176.91 2fh3 h SER 535 N -0.20 0.00 -3.34 0.00 4.64 -1.93 -3.41 113.55 109.32 2fh3 h SER 535 Ca -0.46 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.21 2fh3 h SER 535 Cb 1.23 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 63.06 2fh3 h SER 535 CO 0.55 0.66 -0.74 -0.89 -0.87 0.00 0.00 176.83 175.54 2fh3 s THR 536 N -2.87 3.26 -0.01 2.95 2.01 -1.26 -3.18 115.64 116.54 2fh3 s THR 536 Ca 0.01 -0.56 0.03 0.00 0.31 0.00 0.00 61.69 61.48 2fh3 s THR 536 Cb 0.08 -2.42 -0.01 0.00 0.01 0.00 0.00 72.50 70.16 2fh3 s THR 536 CO 0.78 0.48 -0.09 -0.13 -0.69 0.00 0.00 174.62 174.97 2fh3 s ARG 537 N 0.83 0.73 -0.04 4.92 0.52 0.02 -4.73 118.95 121.20 2fh3 s ARG 537 Ca -0.03 -0.33 0.06 0.00 -0.52 0.00 0.00 55.73 54.92 2fh3 s ARG 537 Cb -0.15 -0.70 -0.01 0.00 0.52 0.00 0.00 34.95 34.60 2fh3 s ARG 537 CO 0.01 0.19 -0.23 -1.17 0.02 0.00 0.00 175.30 174.12 2fh3 s LEU 538 N -0.23 2.03 -0.04 2.53 2.96 -1.24 -0.92 118.68 123.78 2fh3 s LEU 538 Ca 0.03 -0.45 0.05 0.00 -0.22 0.00 0.00 54.13 53.54 2fh3 s LEU 538 Cb -0.04 -1.25 -0.01 0.00 0.50 0.00 0.00 46.19 45.40 2fh3 s LEU 538 CO -0.00 0.25 -0.19 -0.36 -1.32 0.00 0.00 176.35 174.72 2fh3 s PHE 539 N -0.27 1.81 -0.14 5.38 0.40 -0.32 -0.63 117.98 124.22 2fh3 s PHE 539 Ca 0.01 -0.47 -0.18 0.00 -0.60 0.00 0.00 56.93 55.69 2fh3 s PHE 539 Cb -0.12 -1.20 -0.04 0.00 0.51 0.00 0.00 43.02 42.17 2fh3 s PHE 539 CO 0.02 -0.13 0.46 -1.14 0.70 0.00 0.00 175.22 175.13 2fh3 s GLN 540 N -0.14 4.30 -0.33 0.44 0.74 0.01 -1.78 119.66 122.89 2fh3 s GLN 540 Ca -0.00 0.40 0.02 0.00 0.05 0.00 0.00 55.36 55.82 2fh3 s GLN 540 Cb -0.11 -3.46 0.09 0.00 1.10 0.00 0.00 33.01 30.63 2fh3 s GLN 540 CO 0.01 0.10 0.04 0.08 -0.55 0.00 0.00 175.29 174.98 2fh3 s VAL 541 N 0.81 2.50 -0.04 1.34 1.01 0.11 -0.74 120.40 125.39 2fh3 s VAL 541 Ca 0.24 -2.08 0.07 0.00 0.00 0.00 0.00 61.98 60.21 2fh3 s VAL 541 Cb -0.15 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 2fh3 s VAL 541 CO 0.09 -0.46 -0.25 -0.60 0.00 0.00 0.00 175.10 173.88 2fh3 s ARG 542 N 1.01 2.29 0.05 2.72 3.52 -0.82 -2.73 118.95 124.99 2fh3 s ARG 542 Ca 0.05 -0.89 0.04 0.00 -0.13 0.00 0.00 55.73 54.80 2fh3 s ARG 542 Cb -0.20 -2.06 -0.04 0.00 -1.56 0.00 0.00 34.95 31.10 2fh3 s ARG 542 CO -0.06 0.45 -0.05 0.00 -0.81 0.00 0.00 175.30 174.83 2fh3 s ALA 543 N -0.35 3.11 0.83 6.12 0.00 -1.26 -1.64 121.76 128.56 2fh3 s ALA 543 Ca 0.02 -1.08 -0.03 0.00 0.00 0.00 0.00 51.96 50.87 2fh3 s ALA 543 Cb -0.12 -1.13 0.05 0.00 0.00 0.00 0.00 23.12 21.93 2fh3 s ALA 543 CO 0.01 0.65 0.32 0.27 0.00 0.00 0.00 175.76 177.01 2fh3 n ASN 544 N 1.11 0.13 0.01 0.00 0.23 -0.48 -4.95 115.26 111.31 2fh3 n ASN 544 Ca -0.14 -1.18 -0.03 0.00 -0.53 0.00 0.00 54.58 52.70 2fh3 n ASN 544 Cb 0.52 -0.23 0.21 0.00 -2.08 0.00 0.00 39.78 38.20 2fh3 n ASN 544 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2fh3 h SER 545 N -0.35 0.49 0.71 0.53 0.02 -1.95 -2.76 113.55 110.24 2fh3 h SER 545 Ca -0.10 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 2fh3 h SER 545 Cb 0.31 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.72 2fh3 h SER 545 CO 0.08 0.72 0.00 0.00 -1.14 0.00 0.00 176.83 176.49 2fh3 h ALA 546 N 1.32 1.00 0.00 3.77 0.00 -2.01 -3.46 119.26 119.88 2fh3 h ALA 546 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2fh3 h ALA 546 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2fh3 h ALA 546 CO 0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.71 2fh3 n GLY 547 N -0.11 1.21 3.72 0.00 0.00 -1.04 -5.07 105.19 103.90 2fh3 n GLY 547 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 2fh3 n GLY 547 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fh3 n ALA 548 N -1.61 2.01 -3.13 4.61 0.00 -1.26 -4.73 120.51 116.40 2fh3 n ALA 548 Ca 0.00 0.38 -0.25 0.00 0.00 0.00 0.00 53.44 53.58 2fh3 n ALA 548 Cb 0.00 -2.39 -0.16 0.00 0.00 0.00 0.00 19.45 16.90 2fh3 n ALA 548 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2fh3 s THR 549 N -0.19 1.21 -0.09 0.00 2.01 -1.26 -1.39 115.64 115.94 2fh3 s THR 549 Ca 0.64 -0.57 0.04 0.00 0.31 0.00 0.00 61.69 62.10 2fh3 s THR 549 Cb -0.55 -1.07 0.00 0.00 0.01 0.00 0.00 72.50 70.90 2fh3 s THR 549 CO 0.51 0.36 -0.20 -0.13 -0.69 0.00 0.00 174.62 174.47 2fh3 s ARG 550 N 0.30 2.63 -0.40 4.92 0.52 -0.65 -1.79 118.95 124.47 2fh3 s ARG 550 Ca -0.08 -0.74 -0.07 0.00 -0.52 0.00 0.00 55.73 54.32 2fh3 s ARG 550 Cb -0.13 -2.02 0.08 0.00 0.52 0.00 0.00 34.95 33.40 2fh3 s ARG 550 CO 0.03 0.14 0.22 0.00 0.02 0.00 0.00 175.30 175.70 2fh3 s ALA 551 N 0.42 3.21 -0.20 2.13 0.00 0.46 -1.94 121.76 125.84 2fh3 s ALA 551 Ca -0.17 -2.13 -0.05 0.00 0.00 0.00 0.00 51.96 49.60 2fh3 s ALA 551 Cb -0.17 -2.53 -0.03 0.00 0.00 0.00 0.00 23.12 20.40 2fh3 s ALA 551 CO 0.07 -1.61 0.01 0.08 0.00 0.00 0.00 175.76 174.32 2fh3 s VAL 552 N 1.37 4.04 -0.02 0.00 1.01 0.08 -0.64 120.40 126.23 2fh3 s VAL 552 Ca 0.03 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.43 2fh3 s VAL 552 Cb -0.22 -2.84 -0.04 0.00 0.00 0.00 0.00 36.38 33.28 2fh3 s VAL 552 CO 0.01 0.42 1.24 -0.70 0.00 0.00 0.00 175.10 176.07 2fh3 s GLU 553 N 1.03 4.35 0.38 2.72 2.12 -0.07 -0.81 118.70 128.42 2fh3 s GLU 553 Ca 0.02 1.75 0.05 0.00 0.36 0.00 0.00 54.97 57.15 2fh3 s GLU 553 Cb -0.14 -3.52 -0.07 0.00 0.26 0.00 0.00 34.13 30.65 2fh3 s GLU 553 CO 0.02 -0.44 0.03 0.14 -0.54 0.00 0.00 175.26 174.47 2fh3 s VAL 554 N 2.05 1.56 0.05 3.70 -7.23 0.20 -4.53 120.40 116.20 2fh3 s VAL 554 Ca 0.58 -2.00 -0.33 0.00 -1.81 0.00 0.00 61.98 58.42 2fh3 s VAL 554 Cb -0.27 -2.85 -0.12 0.00 0.56 0.00 0.00 36.38 33.71 2fh3 s VAL 554 CO 0.24 0.00 1.81 0.18 -0.31 0.00 0.00 175.10 177.02 2fh3 n LEU 555 N -0.86 3.64 -3.94 1.32 4.32 -1.26 -3.70 117.00 116.51 2fh3 n LEU 555 Ca -0.05 0.99 -0.40 0.00 -0.02 0.00 0.00 56.01 56.54 2fh3 n LEU 555 Cb 0.67 -1.46 -0.05 0.00 -1.62 0.00 0.00 43.42 40.97 2fh3 n LEU 555 CO 0.45 -0.00 2.03 -0.81 -1.22 0.00 0.00 177.39 177.84 2fh3 n PRO 556 N 5.73 1.83 -4.24 3.23 -0.04 -1.26 -4.78 135.00 135.46 2fh3 n PRO 556 Ca 0.20 -2.20 -0.22 0.00 -0.04 0.00 0.00 63.50 61.24 2fh3 n PRO 556 Cb 0.33 -3.21 -0.12 0.00 -0.04 0.00 0.00 33.50 30.46 2fh3 n PRO 556 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2fh3 s LYS 557 N 5.07 1.00 0.20 0.54 1.02 -1.26 -4.57 119.74 121.74 2fh3 s LYS 557 Ca 0.59 -1.08 -0.11 0.00 0.02 0.00 0.00 55.97 55.38 2fh3 s LYS 557 Cb 0.10 -1.16 0.25 0.00 -0.52 0.00 0.00 37.83 36.50 2fh3 s LYS 557 CO 0.09 0.27 1.71 0.00 -0.92 0.00 0.00 175.35 176.50 2fh3 h ALA 558 N 4.15 0.65 0.00 5.17 0.00 -1.77 -1.89 119.26 125.57 2fh3 h ALA 558 Ca -0.44 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2fh3 h ALA 558 Cb 1.18 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2fh3 h ALA 558 CO 0.40 -0.30 0.00 0.78 0.00 0.00 0.00 179.25 180.13 2fh3 h GLY 559 N 0.25 0.00 2.00 0.00 0.00 -1.87 -2.43 103.07 101.02 2fh3 h GLY 559 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.62 2fh3 h GLY 559 CO -0.37 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.17 2fh3 h ALA 560 N 2.05 1.00 -2.39 3.60 0.00 -1.64 -3.34 119.26 118.54 2fh3 h ALA 560 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.41 2fh3 h ALA 560 Cb 0.12 0.00 0.08 0.00 0.00 0.00 0.00 17.79 17.99 2fh3 h ALA 560 CO 0.00 0.00 0.38 -0.51 0.00 0.00 0.00 179.25 179.12 2fh3 s LEU 561 N -4.62 3.44 -0.05 0.00 1.43 -0.92 -4.92 118.68 113.04 2fh3 s LEU 561 Ca 0.06 1.87 -0.12 0.00 -1.03 0.00 0.00 54.13 54.92 2fh3 s LEU 561 Cb 0.10 -4.54 0.02 0.00 0.03 0.00 0.00 46.19 41.81 2fh3 s LEU 561 CO 0.47 -1.35 0.28 0.54 0.23 0.00 0.00 176.35 176.52 2fh3 s ASN 562 N -2.76 -0.20 0.35 2.29 2.20 -1.26 -1.67 114.94 113.89 2fh3 s ASN 562 Ca 0.65 0.24 0.27 0.00 -0.94 0.00 0.00 52.86 53.07 2fh3 s ASN 562 Cb -0.18 0.41 0.97 0.00 -2.00 0.00 0.00 41.25 40.45 2fh3 s ASN 562 CO 0.40 -0.30 1.79 0.28 -2.94 0.00 0.00 177.10 176.32 2fh3 h SER 563 N 4.64 0.00 1.62 3.54 0.02 -1.72 -3.02 113.55 118.63 2fh3 h SER 563 Ca -0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 2fh3 h SER 563 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 2fh3 h SER 563 CO 0.37 0.00 0.00 -1.13 -1.14 0.00 0.00 176.83 174.93 2fh3 h ASN 564 N 0.00 0.00 -5.02 3.07 -0.73 -1.75 0.11 115.58 111.26 2fh3 h ASN 564 Ca 0.00 0.00 -0.65 0.00 1.87 0.00 0.00 56.30 57.52 2fh3 h ASN 564 Cb 0.57 0.00 -0.13 0.00 0.27 0.00 0.00 38.32 39.03 2fh3 h ASN 564 CO 0.00 0.00 -0.48 0.47 -0.37 0.00 0.00 177.43 177.05 2fh3 n ASP 565 N -3.05 3.22 -4.66 1.15 8.00 -1.14 -2.21 116.55 117.86 2fh3 n ASP 565 Ca 0.03 -3.23 -0.33 0.00 0.71 0.00 0.00 54.79 51.97 2fh3 n ASP 565 Cb 0.44 0.42 -0.09 0.00 -0.02 0.00 0.00 41.12 41.87 2fh3 n ASP 565 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2fh3 s ALA 566 N -2.90 3.21 0.08 2.24 0.00 -1.11 -1.14 121.76 122.15 2fh3 s ALA 566 Ca 0.02 -0.94 0.08 0.00 0.00 0.00 0.00 51.96 51.12 2fh3 s ALA 566 Cb 0.00 -1.31 -0.03 0.00 0.00 0.00 0.00 23.12 21.78 2fh3 s ALA 566 CO 0.01 0.63 -0.21 -0.06 0.00 0.00 0.00 175.76 176.13 2fh3 s PHE 567 N -1.02 1.80 -0.18 0.00 0.08 0.29 0.10 117.98 119.05 2fh3 s PHE 567 Ca 0.18 -0.40 -0.02 0.00 0.12 0.00 0.00 56.93 56.80 2fh3 s PHE 567 Cb -0.11 -1.02 -0.01 0.00 -0.57 0.00 0.00 43.02 41.31 2fh3 s PHE 567 CO 0.08 0.17 -0.08 0.08 -0.10 0.00 0.00 175.22 175.37 2fh3 s VAL 568 N -1.03 3.20 -0.27 -0.44 1.01 -0.74 -1.18 120.40 120.95 2fh3 s VAL 568 Ca 0.07 -0.57 -0.05 0.00 0.00 0.00 0.00 61.98 61.42 2fh3 s VAL 568 Cb -0.10 -2.41 0.01 0.00 0.00 0.00 0.00 36.38 33.88 2fh3 s VAL 568 CO 0.03 0.47 0.03 -0.22 0.00 0.00 0.00 175.10 175.41 2fh3 s LEU 569 N 1.03 3.52 -0.17 3.92 0.20 -0.13 -1.17 118.68 125.87 2fh3 s LEU 569 Ca -0.00 -0.65 -0.01 0.00 0.69 0.00 0.00 54.13 54.16 2fh3 s LEU 569 Cb -0.15 -1.81 -0.00 0.00 -0.43 0.00 0.00 46.19 43.80 2fh3 s LEU 569 CO -0.01 -0.14 -0.13 -0.75 -0.29 0.00 0.00 176.35 175.04 2fh3 s LYS 570 N 1.47 3.28 0.46 1.98 2.36 -0.10 0.48 119.74 129.67 2fh3 s LYS 570 Ca 0.03 -0.71 0.06 0.00 -2.55 0.00 0.00 55.97 52.80 2fh3 s LYS 570 Cb -0.16 -2.71 -0.02 0.00 -1.05 0.00 0.00 37.83 33.89 2fh3 s LYS 570 CO 0.00 -0.01 0.23 0.95 1.55 0.00 0.00 175.35 178.08 2fh3 s THR 571 N 0.90 1.99 0.36 3.43 -4.23 0.22 -0.80 115.64 117.51 2fh3 s THR 571 Ca -0.03 -1.65 0.32 0.00 -1.18 0.00 0.00 61.69 59.15 2fh3 s THR 571 Cb -0.15 -2.65 0.35 0.00 1.34 0.00 0.00 72.50 71.39 2fh3 s THR 571 CO -0.01 0.00 2.09 -0.65 -0.54 0.00 0.00 174.62 175.51 2fh3 h PRO 572 N 1.19 0.00 0.00 3.99 0.11 -1.97 -3.28 132.00 132.04 2fh3 h PRO 572 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2fh3 h PRO 572 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2fh3 h PRO 572 CO 0.66 0.07 -0.99 -1.13 -0.21 0.00 0.00 178.00 176.41 2fh3 n SER 573 N -3.36 1.77 -3.85 -2.05 3.41 -1.26 -5.08 113.62 103.19 2fh3 n SER 573 Ca -0.01 -0.32 -0.10 0.00 -0.26 0.00 0.00 58.87 58.18 2fh3 n SER 573 Cb 0.24 1.24 -0.05 0.00 -0.26 0.00 0.00 64.21 65.38 2fh3 n SER 573 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fh3 s ALA 574 N -2.30 0.06 -0.14 7.33 0.00 -1.24 -5.17 121.76 120.29 2fh3 s ALA 574 Ca -0.00 -1.07 -0.09 0.00 0.00 0.00 0.00 51.96 50.80 2fh3 s ALA 574 Cb 0.06 1.10 0.05 0.00 0.00 0.00 0.00 23.12 24.34 2fh3 s ALA 574 CO 0.39 -0.82 0.35 0.00 0.00 0.00 0.00 175.76 175.67 2fh3 s ALA 575 N -3.80 -0.87 -0.03 0.00 0.00 -1.26 -0.61 121.76 115.19 2fh3 s ALA 575 Ca 0.25 1.27 0.07 0.00 0.00 0.00 0.00 51.96 53.55 2fh3 s ALA 575 Cb -0.00 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 22.33 2fh3 s ALA 575 CO 0.11 -0.23 -0.24 0.71 0.00 0.00 0.00 175.76 176.12 2fh3 s TYR 576 N 1.13 2.17 -0.34 0.00 2.02 0.18 0.12 117.35 122.62 2fh3 s TYR 576 Ca -0.08 -0.48 -0.06 0.00 -0.37 0.00 0.00 57.07 56.09 2fh3 s TYR 576 Cb -0.08 -1.41 0.05 0.00 -0.40 0.00 0.00 41.96 40.12 2fh3 s TYR 576 CO -0.09 -0.08 0.11 -1.17 -1.57 0.00 0.00 175.55 172.74 2fh3 s LEU 577 N -0.44 4.35 -0.30 -1.29 0.20 -0.22 -0.96 118.68 120.03 2fh3 s LEU 577 Ca 0.06 -1.21 -0.09 0.00 0.69 0.00 0.00 54.13 53.58 2fh3 s LEU 577 Cb -0.10 -1.86 -0.02 0.00 -0.43 0.00 0.00 46.19 43.78 2fh3 s LEU 577 CO 0.00 -0.34 0.14 0.86 -0.29 0.00 0.00 176.35 176.72 2fh3 s TRP 578 N 1.38 3.16 -0.48 5.38 -0.00 -0.33 0.55 118.94 128.61 2fh3 s TRP 578 Ca -0.01 -0.47 -0.13 0.00 -0.00 0.00 0.00 56.10 55.48 2fh3 s TRP 578 Cb -0.20 -2.33 0.10 0.00 -0.00 0.00 0.00 33.47 31.04 2fh3 s TRP 578 CO 0.02 -0.41 0.39 0.08 -0.00 0.00 0.00 176.95 177.03 2fh3 s VAL 579 N 1.63 4.81 0.83 5.86 1.01 0.20 -0.54 120.40 134.19 2fh3 s VAL 579 Ca 0.05 -1.42 -0.13 0.00 0.00 0.00 0.00 61.98 60.48 2fh3 s VAL 579 Cb -0.17 -4.01 0.07 0.00 0.00 0.00 0.00 36.38 32.28 2fh3 s VAL 579 CO 0.06 -0.69 1.02 0.61 0.00 0.00 0.00 175.10 176.10 2fh3 n GLY 580 N 5.10 -0.49 0.27 4.51 0.00 -0.29 -2.28 105.19 112.01 2fh3 n GLY 580 Ca -0.11 -0.54 0.14 0.00 0.00 0.00 0.00 46.02 45.51 2fh3 n GLY 580 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2fh3 h THR 581 N -1.05 0.46 -0.00 2.61 2.02 -1.66 -2.41 112.91 112.88 2fh3 h THR 581 Ca -0.45 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.24 2fh3 h THR 581 Cb 1.30 1.33 0.00 0.00 -1.74 0.00 0.00 68.15 69.04 2fh3 h THR 581 CO 0.43 0.09 -0.87 0.61 0.37 0.00 0.00 175.52 176.16 2fh3 n GLY 582 N -0.65 -0.87 3.67 2.16 0.00 0.33 -4.57 105.19 105.25 2fh3 n GLY 582 Ca -0.02 -0.58 -0.44 0.00 0.00 0.00 0.00 46.02 44.98 2fh3 n GLY 582 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fh3 n ALA 583 N -1.28 1.08 -2.07 4.61 0.00 -0.91 -4.62 120.51 117.33 2fh3 n ALA 583 Ca 0.05 0.40 -0.24 0.00 0.00 0.00 0.00 53.44 53.65 2fh3 n ALA 583 Cb 0.35 -2.26 0.04 0.00 0.00 0.00 0.00 19.45 17.58 2fh3 n ALA 583 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2fh3 s SER 584 N 0.11 5.37 0.23 0.00 1.04 -1.26 -4.95 113.70 114.23 2fh3 s SER 584 Ca 0.65 0.35 -0.06 0.00 0.48 0.00 0.00 55.95 57.37 2fh3 s SER 584 Cb -0.63 -1.28 0.21 0.00 0.10 0.00 0.00 66.02 64.41 2fh3 s SER 584 CO 0.53 -1.14 1.77 -0.33 0.98 0.00 0.00 173.24 175.05 2fh3 h GLU 585 N -0.08 1.08 -0.80 4.02 4.39 -1.99 -1.87 114.58 119.33 2fh3 h GLU 585 Ca -0.44 -0.23 0.05 0.00 0.34 0.00 0.00 59.36 59.07 2fh3 h GLU 585 Cb 1.28 -0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 29.73 2fh3 h GLU 585 CO 0.57 0.93 0.53 0.00 -1.16 0.00 0.00 179.01 179.88 2fh3 h ALA 586 N 1.18 1.55 -0.47 3.43 0.00 -1.95 0.14 119.26 123.14 2fh3 h ALA 586 Ca 0.23 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 2fh3 h ALA 586 Cb 0.31 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2fh3 h ALA 586 CO -0.01 0.35 -0.16 0.93 0.00 0.00 0.00 179.25 180.37 2fh3 h GLU 587 N 0.95 0.94 -0.42 0.00 5.08 -1.69 0.58 114.58 120.01 2fh3 h GLU 587 Ca 0.33 -0.38 -0.14 0.00 -1.00 0.00 0.00 59.36 58.17 2fh3 h GLU 587 Cb 0.11 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2fh3 h GLU 587 CO -0.10 1.04 -0.28 0.87 -1.00 0.00 0.00 179.01 179.54 2fh3 h LYS 588 N 0.78 0.91 -0.58 2.33 1.57 -0.85 -1.55 116.57 119.18 2fh3 h LYS 588 Ca 0.11 -0.41 -0.09 0.00 -1.87 0.00 0.00 60.65 58.39 2fh3 h LYS 588 Cb 0.72 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 2fh3 h LYS 588 CO 0.06 1.07 0.01 1.15 -0.57 0.00 0.00 179.45 181.16 2fh3 h THR 589 N 0.77 1.26 -0.13 -0.16 2.02 -0.61 -0.44 112.91 115.63 2fh3 h THR 589 Ca 0.09 -1.13 -0.10 0.00 0.77 0.00 0.00 66.41 66.04 2fh3 h THR 589 Cb 0.84 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 2fh3 h THR 589 CO 0.07 0.41 -0.38 1.23 0.37 0.00 0.00 175.52 177.22 2fh3 h GLY 590 N 0.92 0.30 0.97 2.16 0.00 -0.79 -1.42 103.07 105.21 2fh3 h GLY 590 Ca 0.17 -0.28 -0.12 0.00 0.00 0.00 0.00 47.33 47.10 2fh3 h GLY 590 CO 0.03 0.25 -0.30 0.00 0.00 0.00 0.00 176.54 176.52 2fh3 h ALA 591 N 1.37 0.41 -0.78 3.60 0.00 -0.96 -2.08 119.26 120.81 2fh3 h ALA 591 Ca 0.02 -0.41 0.12 0.00 0.00 0.00 0.00 54.91 54.65 2fh3 h ALA 591 Cb 0.78 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.40 2fh3 h ALA 591 CO 0.06 0.43 0.39 1.96 0.00 0.00 0.00 179.25 182.09 2fh3 h GLN 592 N 0.42 0.60 -0.57 0.00 1.08 -0.73 -2.28 115.11 113.63 2fh3 h GLN 592 Ca 0.04 -0.04 -0.10 0.00 -1.45 0.00 0.00 58.65 57.11 2fh3 h GLN 592 Cb 0.87 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 28.14 2fh3 h GLN 592 CO 0.07 0.40 -0.02 0.93 -0.95 0.00 0.00 178.83 179.26 2fh3 h GLU 593 N 0.62 1.01 -0.48 1.46 4.39 -1.06 -2.67 114.58 117.85 2fh3 h GLU 593 Ca 0.40 -0.32 0.01 0.00 0.34 0.00 0.00 59.36 59.79 2fh3 h GLU 593 Cb 0.50 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.03 2fh3 h GLU 593 CO -0.32 1.00 0.31 1.25 -1.16 0.00 0.00 179.01 180.09 2fh3 h LEU 594 N 0.92 0.53 -0.99 1.33 6.46 -0.83 -1.92 115.31 120.81 2fh3 h LEU 594 Ca 0.16 -0.01 0.02 0.00 -0.12 0.00 0.00 57.88 57.94 2fh3 h LEU 594 Cb 0.56 -0.13 -0.05 0.00 -0.73 0.00 0.00 40.66 40.31 2fh3 h LEU 594 CO 0.03 0.38 0.65 -0.07 -0.62 0.00 0.00 178.44 178.81 2fh3 h LEU 595 N 0.63 1.11 0.38 2.25 3.38 -1.24 0.41 115.31 122.22 2fh3 h LEU 595 Ca 0.18 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 2fh3 h LEU 595 Cb -0.05 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2fh3 h LEU 595 CO -0.05 0.78 -0.25 -0.09 0.09 0.00 0.00 178.44 178.92 2fh3 h ARG 596 N 1.29 -0.58 -0.92 1.13 2.43 -1.13 0.19 114.38 116.80 2fh3 h ARG 596 Ca 0.38 0.04 0.15 0.00 -0.81 0.00 0.00 59.98 59.74 2fh3 h ARG 596 Cb -0.07 0.13 -0.10 0.00 -0.42 0.00 0.00 29.97 29.52 2fh3 h ARG 596 CO -0.10 -0.39 0.52 0.28 -1.51 0.00 0.00 179.97 178.77 2fh3 h VAL 597 N -0.61 0.76 0.00 0.20 2.07 -0.69 0.13 116.25 118.11 2fh3 h VAL 597 Ca -0.04 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2fh3 h VAL 597 Cb 0.50 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2fh3 h VAL 597 CO 0.03 0.13 0.00 0.18 0.02 0.00 0.00 177.57 177.94 2fh3 n LEU 598 N -4.79 0.00 -3.76 2.57 4.32 0.14 -4.94 117.00 110.54 2fh3 n LEU 598 Ca 0.19 0.24 -0.24 0.00 -0.02 0.00 0.00 56.01 56.18 2fh3 n LEU 598 Cb 0.45 -0.24 0.03 0.00 -1.62 0.00 0.00 43.42 42.05 2fh3 n LEU 598 CO 0.22 -0.05 0.01 0.54 -1.22 0.00 0.00 177.39 176.90 2fh3 n ARG 599 N -1.24 -5.31 -4.20 3.23 1.74 0.51 -5.01 116.66 106.39 2fh3 n ARG 599 Ca 0.13 0.63 -0.17 0.00 -0.77 0.00 0.00 57.85 57.66 2fh3 n ARG 599 Cb 0.18 -5.33 -0.12 0.00 -1.02 0.00 0.00 32.46 26.16 2fh3 n ARG 599 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2fh3 s ALA 600 N -3.53 0.97 -0.24 7.54 0.00 -0.22 -5.03 121.76 121.26 2fh3 s ALA 600 Ca 0.24 -0.83 -0.08 0.00 0.00 0.00 0.00 51.96 51.29 2fh3 s ALA 600 Cb -0.12 -0.09 -0.03 0.00 0.00 0.00 0.00 23.12 22.88 2fh3 s ALA 600 CO 0.81 0.13 0.08 -0.65 0.00 0.00 0.00 175.76 176.14 2fh3 s GLN 601 N -1.39 3.75 0.40 0.00 -1.52 -1.26 -4.36 119.66 115.27 2fh3 s GLN 601 Ca -0.03 -0.43 -0.23 0.00 -1.95 0.00 0.00 55.36 52.72 2fh3 s GLN 601 Cb -0.09 -3.34 -0.10 0.00 -0.22 0.00 0.00 33.01 29.26 2fh3 s GLN 601 CO 0.01 -0.09 0.99 -1.25 -0.25 0.00 0.00 175.29 174.70 2fh3 s PRO 602 N 1.38 4.27 -0.18 2.91 0.04 -1.26 -4.58 135.00 137.58 2fh3 s PRO 602 Ca 0.05 1.32 -0.25 0.00 0.04 0.00 0.00 61.00 62.16 2fh3 s PRO 602 Cb -0.15 -2.46 -0.01 0.00 0.04 0.00 0.00 34.50 31.92 2fh3 s PRO 602 CO 0.04 -0.01 0.83 0.08 0.04 0.00 0.00 177.00 177.98 2fh3 s VAL 603 N -1.85 4.88 0.08 -0.36 1.01 0.12 -4.88 120.40 119.39 2fh3 s VAL 603 Ca 0.58 1.63 -0.28 0.00 0.00 0.00 0.00 61.98 63.90 2fh3 s VAL 603 Cb -0.16 -4.13 -0.05 0.00 0.00 0.00 0.00 36.38 32.03 2fh3 s VAL 603 CO 0.21 0.02 0.90 -1.10 0.00 0.00 0.00 175.10 175.13 2fh3 s GLN 604 N 2.21 4.62 -0.06 2.72 -0.21 -1.26 -1.06 119.66 126.62 2fh3 s GLN 604 Ca 0.38 1.33 0.01 0.00 0.02 0.00 0.00 55.36 57.10 2fh3 s GLN 604 Cb -0.16 -3.38 0.02 0.00 1.00 0.00 0.00 33.01 30.48 2fh3 s GLN 604 CO 0.12 0.20 -0.06 0.08 -2.12 0.00 0.00 175.29 173.51 2fh3 s VAL 605 N 0.12 0.68 -0.12 1.09 1.01 0.19 -4.91 120.40 118.46 2fh3 s VAL 605 Ca 0.45 -0.17 -0.16 0.00 0.00 0.00 0.00 61.98 62.10 2fh3 s VAL 605 Cb -0.22 -0.70 -0.05 0.00 0.00 0.00 0.00 36.38 35.42 2fh3 s VAL 605 CO 0.27 0.27 0.40 0.00 0.00 0.00 0.00 175.10 176.04 2fh3 s ALA 606 N 1.08 3.55 0.15 5.51 0.00 -1.26 -0.63 121.76 130.16 2fh3 s ALA 606 Ca -0.08 -0.30 -0.33 0.00 0.00 0.00 0.00 51.96 51.25 2fh3 s ALA 606 Cb -0.14 -2.52 -0.16 0.00 0.00 0.00 0.00 23.12 20.30 2fh3 s ALA 606 CO -0.01 0.09 1.16 -1.91 0.00 0.00 0.00 175.76 175.09 2fh3 n GLU 607 N 3.42 1.07 0.00 0.00 2.13 -0.97 -1.86 120.64 124.43 2fh3 n GLU 607 Ca -0.10 0.38 0.00 0.00 0.66 0.00 0.00 57.16 58.10 2fh3 n GLU 607 Cb 0.52 -1.88 0.00 0.00 0.27 0.00 0.00 31.44 30.35 2fh3 n GLU 607 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2fh3 n GLY 608 N 2.05 2.57 2.59 8.31 0.00 -1.26 -4.88 105.19 114.58 2fh3 n GLY 608 Ca 0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 2fh3 n GLY 608 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2fh3 n SER 609 N 0.00 2.57 -4.76 1.61 3.41 -0.78 -5.09 113.62 110.58 2fh3 n SER 609 Ca 0.00 -2.95 -0.40 0.00 -0.26 0.00 0.00 58.87 55.26 2fh3 n SER 609 Cb 0.00 -0.49 -0.06 0.00 -0.26 0.00 0.00 64.21 63.40 2fh3 n SER 609 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2fh3 s GLU 610 N -3.36 4.77 0.91 4.33 1.03 -1.25 -4.66 118.70 120.47 2fh3 s GLU 610 Ca 0.34 1.39 -0.12 0.00 0.03 0.00 0.00 54.97 56.62 2fh3 s GLU 610 Cb 0.42 -3.27 0.14 0.00 -0.80 0.00 0.00 34.13 30.62 2fh3 s GLU 610 CO -0.03 0.53 1.09 -1.25 -1.33 0.00 0.00 175.26 174.28 2fh3 s PRO 611 N -1.18 1.15 0.14 -4.83 0.04 -1.26 -4.98 135.00 124.08 2fh3 s PRO 611 Ca 0.40 0.72 -0.30 0.00 0.04 0.00 0.00 61.00 61.86 2fh3 s PRO 611 Cb -0.25 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.44 2fh3 s PRO 611 CO 0.30 -2.29 1.56 -0.44 0.04 0.00 0.00 177.00 176.17 2fh3 h ASP 612 N -1.58 -1.61 0.29 6.66 3.45 -2.02 -2.93 116.42 118.67 2fh3 h ASP 612 Ca -0.50 0.23 -0.00 0.00 0.43 0.00 0.00 57.03 57.18 2fh3 h ASP 612 Cb 1.29 0.68 -0.00 0.00 -0.56 0.00 0.00 39.33 40.74 2fh3 h ASP 612 CO 0.56 -0.39 -0.02 1.23 -1.57 0.00 0.00 179.24 179.05 2fh3 h GLY 613 N -0.37 0.00 0.93 2.75 0.00 -1.99 -2.23 103.07 102.16 2fh3 h GLY 613 Ca 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.40 2fh3 h GLY 613 CO -0.58 0.00 -0.39 -2.75 0.00 0.00 0.00 176.54 172.83 2fh3 h PHE 614 N 0.00 -1.00 -0.04 5.60 3.04 -1.90 -1.87 116.94 120.77 2fh3 h PHE 614 Ca -0.00 -0.02 -0.00 0.00 3.98 0.00 0.00 57.97 61.92 2fh3 h PHE 614 Cb 0.17 0.33 -0.00 0.00 2.56 0.00 0.00 35.95 39.01 2fh3 h PHE 614 CO 0.00 -0.61 0.02 -1.49 -2.02 0.00 0.00 178.31 174.21 2fh3 h TRP 615 N -1.17 0.06 -0.69 0.41 -0.00 -1.50 -2.72 115.95 110.34 2fh3 h TRP 615 Ca -0.11 -0.00 0.14 0.00 -0.00 0.00 0.00 58.89 58.92 2fh3 h TRP 615 Cb 0.84 -0.02 -0.10 0.00 -0.00 0.00 0.00 29.16 29.88 2fh3 h TRP 615 CO -0.01 0.15 0.17 1.49 -0.00 0.00 0.00 178.44 180.24 2fh3 h GLU 616 N -0.05 0.27 0.00 0.49 4.81 -1.50 0.81 114.58 119.42 2fh3 h GLU 616 Ca 0.01 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2fh3 h GLU 616 Cb 0.11 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.43 2fh3 h GLU 616 CO -0.00 0.18 0.00 0.00 -0.73 0.00 0.00 179.01 178.46 2fh3 h ALA 617 N 1.56 1.00 -0.67 2.92 0.00 -1.01 -0.87 119.26 122.19 2fh3 h ALA 617 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2fh3 h ALA 617 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2fh3 h ALA 617 CO -0.47 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.06 2fh3 n LEU 618 N -2.81 3.87 0.00 0.00 4.77 0.14 -4.91 117.00 118.06 2fh3 n LEU 618 Ca -0.02 -1.91 0.00 0.00 -0.03 0.00 0.00 56.01 54.04 2fh3 n LEU 618 Cb 0.08 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 2fh3 n LEU 618 CO 0.17 0.95 0.00 0.61 -1.33 0.00 0.00 177.39 177.79 2fh3 n GLY 619 N 1.61 0.55 0.00 -0.72 0.00 -0.33 -3.55 105.19 102.75 2fh3 n GLY 619 Ca 0.24 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2fh3 n GLY 619 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fh3 n GLY 620 N -2.82 2.53 3.70 -0.02 0.00 -0.39 -4.99 105.19 103.21 2fh3 n GLY 620 Ca 0.00 -1.83 -0.32 0.00 0.00 0.00 0.00 46.02 43.87 2fh3 n GLY 620 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fh3 s LYS 621 N -3.51 1.55 0.22 1.61 2.20 -1.26 -4.43 119.74 116.12 2fh3 s LYS 621 Ca 0.00 1.60 -0.22 0.00 -0.36 0.00 0.00 55.97 56.98 2fh3 s LYS 621 Cb 0.00 -1.78 0.05 0.00 -1.51 0.00 0.00 37.83 34.59 2fh3 s LYS 621 CO 0.00 -2.24 0.89 0.00 -0.36 0.00 0.00 175.35 173.64 2fh3 s ALA 622 N -2.42 -1.42 0.37 3.13 0.00 -1.26 -4.99 121.76 115.18 2fh3 s ALA 622 Ca 0.69 -0.17 -0.26 0.00 0.00 0.00 0.00 51.96 52.23 2fh3 s ALA 622 Cb -0.25 0.72 -0.09 0.00 0.00 0.00 0.00 23.12 23.50 2fh3 s ALA 622 CO 0.53 -1.04 1.10 0.00 0.00 0.00 0.00 175.76 176.35 2fh3 s ALA 623 N -3.16 3.17 0.00 0.00 0.00 -1.26 -4.79 121.76 115.72 2fh3 s ALA 623 Ca 0.14 0.83 0.00 0.00 0.00 0.00 0.00 51.96 52.93 2fh3 s ALA 623 Cb -0.03 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.77 2fh3 s ALA 623 CO 0.05 -0.31 0.00 2.48 0.00 0.00 0.00 175.76 177.99 2fh3 n TYR 624 N 0.24 0.00 -2.70 0.00 0.18 -1.26 -4.05 117.16 109.57 2fh3 n TYR 624 Ca 0.03 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.39 2fh3 n TYR 624 Cb 0.48 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.40 2fh3 n TYR 624 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 2fh3 s ARG 625 N -0.94 3.39 0.05 -3.48 0.52 -0.67 -4.82 118.95 112.99 2fh3 s ARG 625 Ca 0.00 -0.96 -0.03 0.00 -0.52 0.00 0.00 55.73 54.22 2fh3 s ARG 625 Cb 0.00 -4.72 -0.03 0.00 0.52 0.00 0.00 34.95 30.72 2fh3 s ARG 625 CO 0.00 -2.02 0.02 -0.08 0.02 0.00 0.00 175.30 173.24 2fh3 s THR 626 N 4.51 0.17 0.09 0.02 -1.32 -1.26 -2.43 115.64 115.42 2fh3 s THR 626 Ca 0.35 -1.43 -0.26 0.00 -1.21 0.00 0.00 61.69 59.14 2fh3 s THR 626 Cb -0.07 -1.15 0.08 0.00 -1.51 0.00 0.00 72.50 69.86 2fh3 s THR 626 CO 0.01 -0.79 0.88 -0.94 -2.21 0.00 0.00 174.62 171.57 2fh3 s SER 627 N -2.48 -0.30 0.25 8.08 1.04 -1.26 -4.38 113.70 114.64 2fh3 s SER 627 Ca 0.00 -0.20 -0.03 0.00 0.48 0.00 0.00 55.95 56.20 2fh3 s SER 627 Cb 0.03 0.47 0.50 0.00 0.10 0.00 0.00 66.02 67.11 2fh3 s SER 627 CO -0.07 -0.81 1.71 -0.65 0.98 0.00 0.00 173.24 174.40 2fh3 h PRO 628 N 2.00 0.36 -0.01 4.02 0.11 -2.02 -1.11 132.00 135.36 2fh3 h PRO 628 Ca -0.24 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.75 2fh3 h PRO 628 Cb 1.24 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2fh3 h PRO 628 CO 0.29 0.24 -0.48 -0.09 -0.21 0.00 0.00 178.00 177.75 2fh3 h ARG 629 N 0.38 0.03 0.00 1.05 9.65 -1.97 -2.19 114.38 121.32 2fh3 h ARG 629 Ca 0.43 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.30 2fh3 h ARG 629 Cb 0.72 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.30 2fh3 h ARG 629 CO -0.46 0.51 0.00 -0.07 2.80 0.00 0.00 179.97 182.75 2fh3 h LEU 630 N 0.02 0.00 -0.09 3.80 3.38 -1.80 -3.13 115.31 117.49 2fh3 h LEU 630 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2fh3 h LEU 630 Cb 0.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.61 2fh3 h LEU 630 CO 0.06 0.00 -0.39 0.29 0.09 0.00 0.00 178.44 178.49 2fh3 n LYS 631 N -3.02 0.16 -2.44 1.13 5.02 -0.47 -2.26 118.16 116.29 2fh3 n LYS 631 Ca 0.03 -0.09 -0.43 0.00 -2.02 0.00 0.00 58.31 55.80 2fh3 n LYS 631 Cb 0.42 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.91 2fh3 n LYS 631 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2fh3 s ASP 632 N -2.90 6.88 0.13 4.39 -1.08 -1.07 -3.13 116.67 119.90 2fh3 s ASP 632 Ca 0.14 1.53 -0.01 0.00 -0.52 0.00 0.00 52.55 53.70 2fh3 s ASP 632 Cb 0.18 -2.54 -0.11 0.00 -1.46 0.00 0.00 42.92 38.99 2fh3 s ASP 632 CO 0.64 -0.85 1.29 0.11 0.52 0.00 0.00 175.17 176.89 2fh3 h LYS 633 N 8.46 0.25 -5.71 4.34 1.57 -1.82 -3.39 116.57 120.27 2fh3 h LYS 633 Ca -0.26 -0.31 -0.49 0.00 -1.87 0.00 0.00 60.65 57.71 2fh3 h LYS 633 Cb 1.10 0.10 -0.06 0.00 0.08 0.00 0.00 32.23 33.45 2fh3 h LYS 633 CO 0.99 1.06 1.54 0.21 -0.57 0.00 0.00 179.45 182.68 2fh3 s LYS 634 N -3.04 3.21 -0.34 3.15 2.47 -1.26 -4.66 119.74 119.26 2fh3 s LYS 634 Ca -0.04 -1.41 0.16 0.00 -1.56 0.00 0.00 55.97 53.12 2fh3 s LYS 634 Cb 0.09 -5.36 0.42 0.00 -1.46 0.00 0.00 37.83 31.52 2fh3 s LYS 634 CO 0.85 -3.06 0.87 -0.12 0.16 0.00 0.00 175.35 174.04 2fh3 n MET 635 N 8.44 1.07 -0.08 4.03 1.56 -1.26 -4.80 117.12 126.08 2fh3 n MET 635 Ca 0.45 -3.29 -0.19 0.00 -0.27 0.00 0.00 57.70 54.39 2fh3 n MET 635 Cb 0.47 -1.42 -0.12 0.00 2.15 0.00 0.00 33.22 34.30 2fh3 n MET 635 CO 0.00 0.00 0.00 0.38 -0.73 0.00 0.00 175.97 175.62 2fh3 h ASP 636 N 3.00 0.03 0.00 6.12 2.03 -1.97 -3.44 116.42 122.19 2fh3 h ASP 636 Ca -0.02 -0.69 0.00 0.00 -0.73 0.00 0.00 57.03 55.59 2fh3 h ASP 636 Cb 1.10 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.59 2fh3 h ASP 636 CO 0.50 1.35 0.00 0.00 -1.03 0.00 0.00 179.24 180.06 2fh3 n ALA 637 N -3.13 -0.39 -3.69 4.15 0.00 -1.26 -4.49 120.51 111.71 2fh3 n ALA 637 Ca -0.25 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.82 2fh3 n ALA 637 Cb 0.64 0.04 -0.09 0.00 0.00 0.00 0.00 19.45 20.03 2fh3 n ALA 637 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2fh3 s HIS 638 N -2.68 3.43 0.66 0.00 3.76 -1.26 -5.09 115.29 114.12 2fh3 s HIS 638 Ca 0.00 -2.68 -0.14 0.00 -0.15 0.00 0.00 55.06 52.08 2fh3 s HIS 638 Cb 0.00 -3.24 0.00 0.00 1.11 0.00 0.00 32.58 30.45 2fh3 s HIS 638 CO 0.00 -0.85 1.10 -1.25 -0.85 0.00 0.00 174.74 172.89 2fh3 s PRO 639 N -0.12 2.83 0.40 8.40 0.04 -1.26 -4.93 135.00 140.36 2fh3 s PRO 639 Ca 0.17 1.32 -0.25 0.00 0.04 0.00 0.00 61.00 62.28 2fh3 s PRO 639 Cb -0.19 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.30 2fh3 s PRO 639 CO -0.04 -1.22 1.14 -2.14 0.04 0.00 0.00 177.00 174.78 2fh3 s PRO 640 N -4.22 4.08 -0.06 0.56 0.02 -1.26 -4.96 135.00 129.14 2fh3 s PRO 640 Ca 0.65 1.76 0.04 0.00 0.02 0.00 0.00 61.00 63.47 2fh3 s PRO 640 Cb -0.19 -2.64 -0.02 0.00 0.02 0.00 0.00 34.50 31.67 2fh3 s PRO 640 CO 0.43 -0.28 -0.19 1.03 -0.33 0.00 0.00 177.00 177.66 2fh3 s ARG 641 N -2.34 2.65 -0.18 5.54 0.52 -0.97 -4.96 118.95 119.21 2fh3 s ARG 641 Ca 0.57 -0.79 -0.01 0.00 -0.52 0.00 0.00 55.73 54.98 2fh3 s ARG 641 Cb -0.29 -2.32 -0.00 0.00 0.52 0.00 0.00 34.95 32.86 2fh3 s ARG 641 CO 0.36 0.45 -0.12 -1.17 0.02 0.00 0.00 175.30 174.85 2fh3 s LEU 642 N -0.31 2.59 0.04 2.53 2.96 -1.26 -0.84 118.68 124.39 2fh3 s LEU 642 Ca 0.02 -0.46 0.05 0.00 -0.22 0.00 0.00 54.13 53.51 2fh3 s LEU 642 Cb -0.13 -1.62 -0.04 0.00 0.50 0.00 0.00 46.19 44.91 2fh3 s LEU 642 CO 0.02 0.03 -0.09 -0.36 -1.32 0.00 0.00 176.35 174.64 2fh3 s PHE 643 N 1.14 2.81 -0.21 5.38 0.40 0.18 -0.47 117.98 127.21 2fh3 s PHE 643 Ca 0.01 -0.10 -0.10 0.00 -0.60 0.00 0.00 56.93 56.14 2fh3 s PHE 643 Cb -0.14 -1.54 -0.05 0.00 0.51 0.00 0.00 43.02 41.79 2fh3 s PHE 643 CO -0.04 0.37 0.13 0.00 0.70 0.00 0.00 175.22 176.39 2fh3 s ALA 644 N -1.05 3.64 -0.18 5.36 0.00 0.16 -0.25 121.76 129.43 2fh3 s ALA 644 Ca 0.18 -0.76 -0.01 0.00 0.00 0.00 0.00 51.96 51.37 2fh3 s ALA 644 Cb -0.11 -2.20 0.00 0.00 0.00 0.00 0.00 23.12 20.81 2fh3 s ALA 644 CO 0.09 0.05 -0.12 0.00 0.00 0.00 0.00 175.76 175.78 2fh3 s SER 646 N 1.17 -0.35 -0.25 0.00 0.15 -1.03 -2.16 113.70 111.22 2fh3 s SER 646 Ca 0.01 0.62 0.12 0.00 0.70 0.00 0.00 55.95 57.40 2fh3 s SER 646 Cb -0.14 0.67 0.52 0.00 -1.71 0.00 0.00 66.02 65.36 2fh3 s SER 646 CO -0.05 -0.19 1.47 -0.46 1.20 0.00 0.00 173.24 175.21 2fh3 n ASN 647 N 2.57 3.09 -0.14 5.45 2.04 -1.26 -0.38 115.26 126.61 2fh3 n ASN 647 Ca -0.15 -3.46 0.25 0.00 -0.44 0.00 0.00 54.58 50.78 2fh3 n ASN 647 Cb 0.57 -0.61 0.68 0.00 -2.53 0.00 0.00 39.78 37.89 2fh3 n ASN 647 CO 0.00 0.00 0.00 0.50 -0.44 0.00 0.00 177.26 177.32 2fh3 h LYS 648 N 1.29 0.06 -0.40 -3.83 3.64 -1.96 -1.09 116.57 114.29 2fh3 h LYS 648 Ca 0.15 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2fh3 h LYS 648 Cb 1.63 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.44 2fh3 h LYS 648 CO 0.36 0.04 0.00 0.44 -2.27 0.00 0.00 179.45 178.02 2fh3 n ILE 649 N -4.33 0.53 0.00 2.00 -5.35 -1.26 -4.92 119.36 106.02 2fh3 n ILE 649 Ca 0.16 -0.67 0.00 0.00 -0.27 0.00 0.00 62.75 61.98 2fh3 n ILE 649 Cb 0.83 0.65 0.00 0.00 -1.74 0.00 0.00 39.64 39.39 2fh3 n ILE 649 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2fh3 n GLY 650 N 1.40 3.00 3.23 3.28 0.00 -0.41 -5.06 105.19 110.64 2fh3 n GLY 650 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 2fh3 n GLY 650 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fh3 s ARG 651 N -0.62 1.01 -0.07 1.61 0.52 -1.26 -5.06 118.95 115.09 2fh3 s ARG 651 Ca 0.00 -1.43 -0.30 0.00 -0.52 0.00 0.00 55.73 53.48 2fh3 s ARG 651 Cb 0.00 -0.52 -0.03 0.00 0.52 0.00 0.00 34.95 34.92 2fh3 s ARG 651 CO 0.00 0.05 1.23 0.12 0.02 0.00 0.00 175.30 176.72 2fh3 s PHE 652 N -3.40 3.11 -0.09 -0.53 5.36 -1.26 -4.19 117.98 116.98 2fh3 s PHE 652 Ca 0.16 1.15 0.01 0.00 -0.96 0.00 0.00 56.93 57.28 2fh3 s PHE 652 Cb 0.03 -3.46 0.02 0.00 -0.34 0.00 0.00 43.02 39.28 2fh3 s PHE 652 CO -0.01 -1.47 -0.09 0.08 -1.46 0.00 0.00 175.22 172.27 2fh3 s VAL 653 N 2.41 1.00 -0.19 3.12 1.01 0.48 -4.98 120.40 123.25 2fh3 s VAL 653 Ca 0.56 -0.33 -0.08 0.00 0.00 0.00 0.00 61.98 62.14 2fh3 s VAL 653 Cb -0.25 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 2fh3 s VAL 653 CO 0.21 0.35 0.07 -0.63 0.00 0.00 0.00 175.10 175.10 2fh3 s ILE 654 N 1.26 4.78 -0.01 2.22 1.01 -1.26 -2.45 121.20 126.74 2fh3 s ILE 654 Ca -0.04 -0.04 0.05 0.00 0.00 0.00 0.00 60.65 60.62 2fh3 s ILE 654 Cb -0.14 -3.16 -0.01 0.00 0.01 0.00 0.00 42.46 39.16 2fh3 s ILE 654 CO -0.03 0.44 -0.15 -1.61 0.00 0.00 0.00 174.94 173.60 2fh3 s GLU 655 N 0.52 1.20 0.39 2.79 2.02 -0.78 -4.96 118.70 119.87 2fh3 s GLU 655 Ca 0.03 -0.53 -0.24 0.00 0.02 0.00 0.00 54.97 54.26 2fh3 s GLU 655 Cb -0.13 -1.16 -0.09 0.00 0.10 0.00 0.00 34.13 32.85 2fh3 s GLU 655 CO 0.01 0.32 1.01 -2.00 0.02 0.00 0.00 175.26 174.61 2fh3 s GLU 656 N -0.34 4.26 -0.10 1.61 2.12 -1.26 0.37 118.70 125.35 2fh3 s GLU 656 Ca 0.06 1.40 -0.23 0.00 0.36 0.00 0.00 54.97 56.56 2fh3 s GLU 656 Cb -0.06 -2.53 -0.03 0.00 0.26 0.00 0.00 34.13 31.77 2fh3 s GLU 656 CO -0.01 -0.04 0.69 0.08 -0.54 0.00 0.00 175.26 175.44 2fh3 s VAL 657 N -1.74 5.04 0.79 3.70 1.01 0.38 -4.87 120.40 124.71 2fh3 s VAL 657 Ca 0.57 1.38 -0.08 0.00 0.00 0.00 0.00 61.98 63.85 2fh3 s VAL 657 Cb -0.19 -4.02 0.12 0.00 0.00 0.00 0.00 36.38 32.30 2fh3 s VAL 657 CO 0.24 0.21 1.11 -2.16 0.00 0.00 0.00 175.10 174.50 2fh3 s PRO 658 N 1.12 1.55 3.05 2.72 0.04 -1.26 -4.70 135.00 137.53 2fh3 s PRO 658 Ca 0.35 -0.53 0.00 0.00 0.04 0.00 0.00 61.00 60.86 2fh3 s PRO 658 Cb -0.17 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.26 2fh3 s PRO 658 CO 0.16 -1.68 0.00 0.41 0.04 0.00 0.00 177.00 175.92 2fh3 n GLY 659 N -3.18 0.49 3.79 0.56 0.00 -1.26 -4.75 105.19 100.84 2fh3 n GLY 659 Ca 0.12 -0.88 -0.36 0.00 0.00 0.00 0.00 46.02 44.91 2fh3 n GLY 659 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fh3 s GLU 660 N 0.00 4.45 -0.06 1.61 0.41 -0.45 -5.00 118.70 119.67 2fh3 s GLU 660 Ca 0.00 1.21 -0.30 0.00 -0.41 0.00 0.00 54.97 55.47 2fh3 s GLU 660 Cb 0.00 -2.68 -0.03 0.00 -1.78 0.00 0.00 34.13 29.64 2fh3 s GLU 660 CO 0.00 0.23 1.20 -0.51 -0.49 0.00 0.00 175.26 175.69 2fh3 s LEU 661 N -2.30 4.28 0.07 1.80 1.43 -1.26 -4.88 118.68 117.82 2fh3 s LEU 661 Ca 0.52 1.81 0.04 0.00 -1.03 0.00 0.00 54.13 55.46 2fh3 s LEU 661 Cb -0.16 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.47 2fh3 s LEU 661 CO 0.21 -0.59 -0.11 -0.04 0.23 0.00 0.00 176.35 176.05 2fh3 s MET 662 N 2.24 0.74 0.38 1.70 -1.94 -1.26 -0.92 119.30 120.24 2fh3 s MET 662 Ca 0.56 -0.96 0.10 0.00 -1.71 0.00 0.00 55.69 53.68 2fh3 s MET 662 Cb -0.25 -0.57 0.87 0.00 2.01 0.00 0.00 34.83 36.90 2fh3 s MET 662 CO 0.22 0.11 1.91 0.37 -0.01 0.00 0.00 175.02 177.61 2fh3 h GLN 663 N 4.11 0.60 0.00 2.03 4.15 -1.86 0.19 115.11 124.32 2fh3 h GLN 663 Ca -0.38 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 58.98 2fh3 h GLN 663 Cb 1.19 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 28.74 2fh3 h GLN 663 CO 0.45 0.40 -0.12 1.49 -1.93 0.00 0.00 178.83 179.11 2fh3 h GLU 664 N 0.62 0.00 0.00 1.69 4.57 -1.96 -2.71 114.58 116.79 2fh3 h GLU 664 Ca 0.39 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.55 2fh3 h GLU 664 Cb 0.65 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.23 2fh3 h GLU 664 CO -0.15 0.12 -0.07 -0.44 -1.18 0.00 0.00 179.01 177.29 2fh3 h ASP 665 N 0.00 0.00 -1.79 1.04 3.32 -1.02 -3.39 116.42 114.58 2fh3 h ASP 665 Ca -0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 2fh3 h ASP 665 Cb 0.23 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.69 2fh3 h ASP 665 CO 0.02 0.07 1.25 -0.76 -1.72 0.00 0.00 179.24 178.10 2fh3 s LEU 666 N -6.74 3.31 -0.27 1.55 1.43 -1.02 -4.96 118.68 111.98 2fh3 s LEU 666 Ca -0.02 -0.87 -0.29 0.00 -1.03 0.00 0.00 54.13 51.92 2fh3 s LEU 666 Cb 0.12 -2.56 -0.02 0.00 0.03 0.00 0.00 46.19 43.76 2fh3 s LEU 666 CO 0.54 -1.72 1.57 0.00 0.23 0.00 0.00 176.35 176.98 2fh3 s ALA 667 N 5.53 3.19 -0.32 4.21 0.00 -1.26 -4.88 121.76 128.23 2fh3 s ALA 667 Ca 0.41 0.30 0.23 0.00 0.00 0.00 0.00 51.96 52.90 2fh3 s ALA 667 Cb -0.05 -3.88 1.09 0.00 0.00 0.00 0.00 23.12 20.29 2fh3 s ALA 667 CO 0.04 -2.09 1.69 0.25 0.00 0.00 0.00 175.76 175.65 2fh3 n THR 668 N 6.63 0.95 0.78 0.00 -2.24 -1.26 -1.04 114.28 118.10 2fh3 n THR 668 Ca 0.19 0.51 0.13 0.00 -2.27 0.00 0.00 64.05 62.61 2fh3 n THR 668 Cb 0.46 -1.49 0.40 0.00 -2.10 0.00 0.00 70.33 67.60 2fh3 n THR 668 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2fh3 n ASP 669 N -2.26 0.51 -1.55 3.42 9.92 -1.26 -0.90 116.55 124.44 2fh3 n ASP 669 Ca 0.00 0.35 -0.03 0.00 -0.53 0.00 0.00 54.79 54.58 2fh3 n ASP 669 Cb 0.12 -0.37 -0.01 0.00 -0.64 0.00 0.00 41.12 40.22 2fh3 n ASP 669 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2fh3 n ASP 670 N -1.90 0.40 -4.18 -2.24 10.43 -0.20 -3.76 116.55 115.09 2fh3 n ASP 670 Ca 0.06 -1.31 -0.30 0.00 2.57 0.00 0.00 54.79 55.80 2fh3 n ASP 670 Cb 0.39 0.20 -0.17 0.00 1.84 0.00 0.00 41.12 43.38 2fh3 n ASP 670 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2fh3 s VAL 671 N -1.99 1.84 0.06 2.53 1.01 -0.92 -1.67 120.40 121.25 2fh3 s VAL 671 Ca 0.04 -0.90 0.03 0.00 0.00 0.00 0.00 61.98 61.15 2fh3 s VAL 671 Cb 0.00 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 2fh3 s VAL 671 CO 0.03 0.51 0.05 -0.04 0.00 0.00 0.00 175.10 175.65 2fh3 s MET 672 N 0.34 2.83 -0.25 2.72 1.00 0.37 -0.47 119.30 125.83 2fh3 s MET 672 Ca -0.16 -0.68 -0.04 0.00 0.00 0.00 0.00 55.69 54.81 2fh3 s MET 672 Cb -0.17 -2.70 0.01 0.00 0.00 0.00 0.00 34.83 31.97 2fh3 s MET 672 CO 0.07 0.58 -0.01 -0.51 0.00 0.00 0.00 175.02 175.15 2fh3 s LEU 673 N -2.17 3.26 -0.34 -0.03 1.02 0.65 -0.22 118.68 120.85 2fh3 s LEU 673 Ca 0.26 -0.62 -0.06 0.00 0.02 0.00 0.00 54.13 53.72 2fh3 s LEU 673 Cb -0.12 -1.76 0.04 0.00 0.02 0.00 0.00 46.19 44.37 2fh3 s LEU 673 CO 0.18 -0.10 0.11 -0.22 0.02 0.00 0.00 176.35 176.34 2fh3 s LEU 674 N 1.44 4.34 -0.51 1.79 0.20 -0.18 0.47 118.68 126.23 2fh3 s LEU 674 Ca 0.03 -1.15 -0.16 0.00 0.69 0.00 0.00 54.13 53.54 2fh3 s LEU 674 Cb -0.16 -1.87 0.11 0.00 -0.43 0.00 0.00 46.19 43.84 2fh3 s LEU 674 CO -0.02 -0.33 0.45 -0.62 -0.29 0.00 0.00 176.35 175.54 2fh3 s ASP 675 N 1.42 6.16 -0.28 3.68 -1.08 -0.02 -0.33 116.67 126.22 2fh3 s ASP 675 Ca -0.02 -1.60 0.04 0.00 -0.52 0.00 0.00 52.55 50.46 2fh3 s ASP 675 Cb -0.20 -2.19 0.48 0.00 -1.46 0.00 0.00 42.92 39.55 2fh3 s ASP 675 CO 0.03 -0.77 1.57 0.35 0.52 0.00 0.00 175.17 176.87 2fh3 n THR 676 N 5.22 2.39 0.00 1.71 -2.24 -0.03 -2.29 114.28 119.04 2fh3 n THR 676 Ca -0.13 -1.24 0.00 0.00 -2.27 0.00 0.00 64.05 60.41 2fh3 n THR 676 Cb 0.42 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 2fh3 n THR 676 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 2fh3 n TRP 677 N -0.41 0.00 0.43 4.78 -0.00 -1.26 -3.98 117.44 116.99 2fh3 n TRP 677 Ca 0.37 0.00 0.13 0.00 -0.00 0.00 0.00 57.50 58.00 2fh3 n TRP 677 Cb 1.22 0.00 0.44 0.00 -0.00 0.00 0.00 31.31 32.98 2fh3 n TRP 677 CO 0.00 0.00 0.00 0.38 -0.00 0.00 0.00 177.69 178.07 2fh3 h ASP 678 N 0.00 0.00 -4.99 5.87 -0.00 -1.99 -3.45 116.42 111.85 2fh3 h ASP 678 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.03 57.06 2fh3 h ASP 678 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 39.33 39.23 2fh3 h ASP 678 CO 0.00 0.00 0.24 0.00 -0.00 0.00 0.00 179.24 179.48 2fh3 s GLN 679 N -3.29 1.44 -0.19 4.15 -2.07 -1.26 -4.54 119.66 113.91 2fh3 s GLN 679 Ca 0.06 -0.66 -0.00 0.00 -1.82 0.00 0.00 55.36 52.95 2fh3 s GLN 679 Cb 0.10 0.58 0.01 0.00 -1.09 0.00 0.00 33.01 32.61 2fh3 s GLN 679 CO 0.53 -0.64 -0.17 0.08 -1.32 0.00 0.00 175.29 173.77 2fh3 s VAL 680 N -3.76 2.36 -0.08 3.63 1.01 -0.98 -0.85 120.40 121.72 2fh3 s VAL 680 Ca 0.05 -0.84 -0.18 0.00 0.00 0.00 0.00 61.98 61.01 2fh3 s VAL 680 Cb -0.03 -2.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 2fh3 s VAL 680 CO -0.05 0.51 0.48 -0.36 0.00 0.00 0.00 175.10 175.68 2fh3 s PHE 681 N 1.30 3.58 -0.49 5.22 0.08 0.56 -1.30 117.98 126.93 2fh3 s PHE 681 Ca 0.05 0.95 -0.11 0.00 0.12 0.00 0.00 56.93 57.94 2fh3 s PHE 681 Cb -0.13 -2.50 0.12 0.00 -0.57 0.00 0.00 43.02 39.94 2fh3 s PHE 681 CO -0.10 0.30 0.39 0.08 -0.10 0.00 0.00 175.22 175.79 2fh3 s VAL 682 N 0.14 4.50 -0.34 -0.44 1.01 -0.29 -1.01 120.40 123.96 2fh3 s VAL 682 Ca 0.26 -1.71 -0.25 0.00 0.00 0.00 0.00 61.98 60.28 2fh3 s VAL 682 Cb -0.16 -3.94 0.01 0.00 0.00 0.00 0.00 36.38 32.29 2fh3 s VAL 682 CO 0.12 -0.80 0.88 0.86 0.00 0.00 0.00 175.10 176.15 2fh3 s TRP 683 N 1.43 3.13 -0.52 5.22 -0.00 0.69 -1.36 118.94 127.53 2fh3 s TRP 683 Ca 0.05 0.81 -0.18 0.00 -0.00 0.00 0.00 56.10 56.78 2fh3 s TRP 683 Cb -0.27 -3.48 0.08 0.00 -0.00 0.00 0.00 33.47 29.80 2fh3 s TRP 683 CO 0.00 -0.72 0.56 0.08 -0.00 0.00 0.00 176.95 176.88 2fh3 s VAL 684 N 3.27 5.00 0.46 5.86 1.01 0.82 -0.48 120.40 136.35 2fh3 s VAL 684 Ca 0.36 -0.85 -0.24 0.00 0.00 0.00 0.00 61.98 61.26 2fh3 s VAL 684 Cb -0.13 -4.29 -0.09 0.00 0.00 0.00 0.00 36.38 31.87 2fh3 s VAL 684 CO 0.16 -0.81 1.14 0.61 0.00 0.00 0.00 175.10 176.20 2fh3 n GLY 685 N 5.21 0.16 0.23 4.51 0.00 -0.67 -1.68 105.19 112.95 2fh3 n GLY 685 Ca -0.09 0.11 0.02 0.00 0.00 0.00 0.00 46.02 46.05 2fh3 n GLY 685 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2fh3 h LYS 686 N 1.57 0.21 -0.58 1.61 3.64 -1.83 -2.70 116.57 118.49 2fh3 h LYS 686 Ca -0.47 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 2fh3 h LYS 686 Cb 1.32 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.12 2fh3 h LYS 686 CO 0.57 0.41 0.00 -0.25 -2.27 0.00 0.00 179.45 177.91 2fh3 n ASP 687 N -4.22 5.63 -4.89 4.20 8.00 -0.07 -4.99 116.55 120.20 2fh3 n ASP 687 Ca -0.01 -2.88 -0.29 0.00 0.71 0.00 0.00 54.79 52.32 2fh3 n ASP 687 Cb 0.31 -0.67 -0.01 0.00 -0.02 0.00 0.00 41.12 40.73 2fh3 n ASP 687 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2fh3 s SER 688 N -0.82 6.32 0.15 -2.24 1.04 -1.02 -4.66 113.70 112.47 2fh3 s SER 688 Ca 0.54 1.06 -0.13 0.00 0.48 0.00 0.00 55.95 57.91 2fh3 s SER 688 Cb 0.41 -2.30 -0.07 0.00 0.10 0.00 0.00 66.02 64.15 2fh3 s SER 688 CO 0.17 -0.59 0.53 -1.10 0.98 0.00 0.00 173.24 173.23 2fh3 s GLN 689 N -4.61 3.93 0.29 4.02 -0.21 -1.26 -4.99 119.66 116.83 2fh3 s GLN 689 Ca 0.50 0.43 0.03 0.00 0.02 0.00 0.00 55.36 56.34 2fh3 s GLN 689 Cb -0.10 -2.90 0.63 0.00 1.00 0.00 0.00 33.01 31.63 2fh3 s GLN 689 CO 0.43 0.47 1.81 1.49 -2.12 0.00 0.00 175.29 177.37 2fh3 h GLU 690 N 3.45 0.88 -0.87 2.91 4.57 -2.00 -0.13 114.58 123.39 2fh3 h GLU 690 Ca -0.48 -0.05 0.01 0.00 -1.18 0.00 0.00 59.36 57.65 2fh3 h GLU 690 Cb 1.19 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 29.54 2fh3 h GLU 690 CO 0.66 0.58 0.58 0.93 -1.18 0.00 0.00 179.01 180.58 2fh3 h GLU 691 N 0.91 1.15 -0.70 1.92 3.07 -1.99 -2.10 114.58 116.82 2fh3 h GLU 691 Ca 0.53 -0.07 -0.05 0.00 -0.50 0.00 0.00 59.36 59.27 2fh3 h GLU 691 Cb 0.65 -0.26 -0.03 0.00 -0.84 0.00 0.00 28.75 28.27 2fh3 h GLU 691 CO -0.31 0.76 0.23 0.93 -1.40 0.00 0.00 179.01 179.21 2fh3 h GLU 692 N 1.18 1.07 -0.67 2.33 5.08 -1.42 -0.35 114.58 121.80 2fh3 h GLU 692 Ca 0.32 -0.22 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 2fh3 h GLU 692 Cb -0.13 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 28.93 2fh3 h GLU 692 CO -0.07 0.91 0.27 -0.22 -1.00 0.00 0.00 179.01 178.90 2fh3 h LYS 693 N 1.04 1.01 -0.01 2.33 3.64 -1.14 -1.85 116.57 121.59 2fh3 h LYS 693 Ca 0.23 -0.18 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2fh3 h LYS 693 Cb 0.28 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.93 2fh3 h LYS 693 CO -0.01 0.83 -0.00 1.15 -2.27 0.00 0.00 179.45 179.15 2fh3 h THR 694 N 0.95 1.31 -0.43 1.00 2.02 -0.90 -1.47 112.91 115.40 2fh3 h THR 694 Ca 0.23 -0.92 -0.06 0.00 0.77 0.00 0.00 66.41 66.43 2fh3 h THR 694 Cb 0.20 1.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.50 2fh3 h THR 694 CO -0.02 0.24 0.00 -0.33 0.37 0.00 0.00 175.52 175.79 2fh3 h GLU 695 N -0.36 0.68 -0.37 6.66 4.39 -1.14 -1.19 114.58 123.26 2fh3 h GLU 695 Ca 0.00 -0.17 -0.08 0.00 0.34 0.00 0.00 59.36 59.45 2fh3 h GLU 695 Cb 0.39 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 2fh3 h GLU 695 CO 0.00 0.70 -0.12 0.00 -1.16 0.00 0.00 179.01 178.43 2fh3 h ALA 696 N 1.36 1.11 -0.40 3.43 0.00 -1.29 0.73 119.26 124.20 2fh3 h ALA 696 Ca 0.13 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 2fh3 h ALA 696 Cb 0.40 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2fh3 h ALA 696 CO 0.01 0.56 -0.05 -0.07 0.00 0.00 0.00 179.25 179.70 2fh3 h LEU 697 N 0.59 0.74 -1.37 0.00 3.38 -0.79 -0.64 115.31 117.22 2fh3 h LEU 697 Ca 0.10 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2fh3 h LEU 697 Cb 0.55 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 2fh3 h LEU 697 CO 0.03 0.90 0.40 0.74 0.09 0.00 0.00 178.44 180.60 2fh3 h THR 698 N 0.56 1.16 -0.17 0.22 2.02 -0.96 0.41 112.91 116.15 2fh3 h THR 698 Ca 0.11 -0.32 -0.21 0.00 0.77 0.00 0.00 66.41 66.75 2fh3 h THR 698 Cb 0.55 0.27 0.01 0.00 -1.74 0.00 0.00 68.15 67.24 2fh3 h THR 698 CO 0.03 0.16 -0.73 -1.28 0.37 0.00 0.00 175.52 174.07 2fh3 h SER 699 N 0.84 0.93 0.22 4.18 0.87 -0.64 -0.66 113.55 119.29 2fh3 h SER 699 Ca 0.22 -0.62 -0.06 0.00 -1.23 0.00 0.00 61.79 60.11 2fh3 h SER 699 Cb -0.07 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.60 2fh3 h SER 699 CO -0.05 1.40 -0.24 0.00 -0.53 0.00 0.00 176.83 177.41 2fh3 h ALA 700 N 0.56 1.54 -0.35 6.23 0.00 -0.70 0.20 119.26 126.75 2fh3 h ALA 700 Ca -0.04 -0.24 -0.16 0.00 0.00 0.00 0.00 54.91 54.47 2fh3 h ALA 700 Cb 1.36 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 2fh3 h ALA 700 CO 0.15 0.34 -0.40 -0.22 0.00 0.00 0.00 179.25 179.12 2fh3 h LYS 701 N 0.05 0.89 -0.27 0.00 3.64 -0.71 -3.01 116.57 117.15 2fh3 h LYS 701 Ca 0.01 -0.49 -0.12 0.00 -1.27 0.00 0.00 60.65 58.78 2fh3 h LYS 701 Cb 0.46 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2fh3 h LYS 701 CO 0.03 1.13 -0.31 -0.09 -2.27 0.00 0.00 179.45 177.94 2fh3 h ARG 702 N 0.69 0.70 -0.92 1.90 2.43 -0.32 -2.83 114.38 116.02 2fh3 h ARG 702 Ca 0.05 -0.38 0.05 0.00 -0.81 0.00 0.00 59.98 58.88 2fh3 h ARG 702 Cb 0.99 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.51 2fh3 h ARG 702 CO 0.10 1.00 0.59 1.88 -1.51 0.00 0.00 179.97 182.03 2fh3 h TYR 703 N 0.43 1.10 -0.02 2.20 0.99 -0.67 -0.82 116.97 120.19 2fh3 h TYR 703 Ca 0.04 0.03 -0.15 0.00 2.00 0.00 0.00 58.73 60.65 2fh3 h TYR 703 Cb 0.89 -0.36 -0.02 0.00 1.00 0.00 0.00 36.73 38.24 2fh3 h TYR 703 CO 0.07 0.61 -0.69 0.82 -0.00 0.00 0.00 178.16 178.97 2fh3 h ILE 704 N 1.12 1.46 0.00 -2.88 2.04 -1.52 -3.30 117.51 114.43 2fh3 h ILE 704 Ca 0.38 -2.28 0.00 0.00 1.00 0.00 0.00 64.86 63.96 2fh3 h ILE 704 Cb 0.07 2.22 0.00 0.00 -0.74 0.00 0.00 36.82 38.37 2fh3 h ILE 704 CO -0.14 0.66 -1.15 -0.62 0.00 0.00 0.00 178.15 176.90 2fh3 n GLU 705 N -3.76 0.26 -0.28 2.37 1.02 -1.01 -4.52 120.64 114.73 2fh3 n GLU 705 Ca -0.02 -0.03 -0.10 0.00 -0.02 0.00 0.00 57.16 56.99 2fh3 n GLU 705 Cb 0.68 -1.56 -0.06 0.00 -0.02 0.00 0.00 31.44 30.48 2fh3 n GLU 705 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2fh3 h THR 706 N 0.00 0.03 -3.43 2.62 2.02 -1.24 -3.23 112.91 109.68 2fh3 h THR 706 Ca 0.00 0.00 -0.64 0.00 0.77 0.00 0.00 66.41 66.54 2fh3 h THR 706 Cb 0.71 0.03 -0.41 0.00 -1.74 0.00 0.00 68.15 66.74 2fh3 h THR 706 CO 0.00 0.00 -0.67 -0.62 0.37 0.00 0.00 175.52 174.60 2fh3 s ASP 707 N -5.27 4.37 0.29 4.18 3.68 -1.26 -4.97 116.67 117.69 2fh3 s ASP 707 Ca -0.13 -2.66 0.25 0.00 2.13 0.00 0.00 52.55 52.13 2fh3 s ASP 707 Cb 0.12 -1.54 0.64 0.00 -1.45 0.00 0.00 42.92 40.69 2fh3 s ASP 707 CO 0.64 -0.29 1.71 1.55 0.13 0.00 0.00 175.17 178.92 2fh3 h PRO 708 N 6.92 0.00 0.00 4.34 0.13 -1.80 -2.45 132.00 139.14 2fh3 h PRO 708 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2fh3 h PRO 708 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 2fh3 h PRO 708 CO 0.61 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.38 2fh3 n ALA 709 N -1.90 1.98 -0.18 -0.56 0.00 -1.26 -3.81 120.51 114.78 2fh3 n ALA 709 Ca 0.05 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2fh3 n ALA 709 Cb 0.47 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.49 2fh3 n ALA 709 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2fh3 n ASN 710 N -2.23 1.49 -3.66 0.00 3.02 -0.94 -4.98 115.26 107.95 2fh3 n ASN 710 Ca 0.04 -1.67 -0.11 0.00 -0.03 0.00 0.00 54.58 52.81 2fh3 n ASN 710 Cb 0.33 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.42 2fh3 n ASN 710 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2fh3 s ARG 711 N -0.67 0.66 -0.20 3.52 1.70 -1.08 -5.06 118.95 117.81 2fh3 s ARG 711 Ca 0.00 0.97 -0.36 0.00 -0.47 0.00 0.00 55.73 55.87 2fh3 s ARG 711 Cb 0.00 0.21 -0.17 0.00 -0.57 0.00 0.00 34.95 34.43 2fh3 s ARG 711 CO 0.00 -0.12 1.10 -3.47 -1.08 0.00 0.00 175.30 171.73 2fh3 n ASP 712 N 3.53 0.48 0.30 -2.89 2.03 -1.26 -4.69 116.55 114.06 2fh3 n ASP 712 Ca -0.17 0.98 0.19 0.00 0.52 0.00 0.00 54.79 56.30 2fh3 n ASP 712 Cb 0.57 -0.75 0.88 0.00 -0.72 0.00 0.00 41.12 41.10 2fh3 n ASP 712 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 2fh3 h ARG 713 N 3.29 0.00 -0.45 -0.67 -0.00 -1.92 -2.73 114.38 111.89 2fh3 h ARG 713 Ca -0.40 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.08 2fh3 h ARG 713 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.13 2fh3 h ARG 713 CO 0.67 0.00 0.00 0.54 0.00 0.00 0.00 179.97 181.18 2fh3 n ARG 714 N -3.07 2.11 -1.67 0.04 1.74 -1.26 -4.95 116.66 109.59 2fh3 n ARG 714 Ca -0.01 -1.72 -0.54 0.00 -0.77 0.00 0.00 57.85 54.82 2fh3 n ARG 714 Cb 0.22 -1.38 -0.06 0.00 -1.02 0.00 0.00 32.46 30.21 2fh3 n ARG 714 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 2fh3 n THR 715 N 0.90 0.26 -2.15 0.55 -1.04 -1.03 -4.93 114.28 106.82 2fh3 n THR 715 Ca 0.16 -0.05 -0.31 0.00 -2.04 0.00 0.00 64.05 61.82 2fh3 n THR 715 Cb 0.41 -1.25 -0.00 0.00 -1.82 0.00 0.00 70.33 67.67 2fh3 n THR 715 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2fh3 s PRO 716 N 2.70 3.67 -0.17 -2.82 0.05 -1.26 -4.95 135.00 132.21 2fh3 s PRO 716 Ca 0.93 0.68 0.01 0.00 0.05 0.00 0.00 61.00 62.67 2fh3 s PRO 716 Cb -0.95 -2.16 0.02 0.00 0.05 0.00 0.00 34.50 31.46 2fh3 s PRO 716 CO 0.57 -0.42 -0.20 0.42 0.05 0.00 0.00 177.00 177.42 2fh3 s ILE 717 N -2.95 2.01 -0.21 0.56 1.01 -1.26 -2.32 121.20 118.03 2fh3 s ILE 717 Ca 0.54 -0.92 -0.03 0.00 0.00 0.00 0.00 60.65 60.24 2fh3 s ILE 717 Cb -0.11 -1.81 -0.01 0.00 0.01 0.00 0.00 42.46 40.54 2fh3 s ILE 717 CO 0.47 0.53 -0.06 -0.89 0.00 0.00 0.00 174.94 174.99 2fh3 s THR 718 N 1.21 3.25 0.11 2.92 2.01 -0.42 -4.99 115.64 119.73 2fh3 s THR 718 Ca 0.03 -0.54 -0.28 0.00 0.31 0.00 0.00 61.69 61.21 2fh3 s THR 718 Cb -0.13 -2.47 -0.06 0.00 0.01 0.00 0.00 72.50 69.85 2fh3 s THR 718 CO -0.11 0.44 0.89 -0.69 -0.69 0.00 0.00 174.62 174.46 2fh3 s VAL 719 N 1.42 4.51 -0.03 3.82 1.01 -1.26 -1.14 120.40 128.72 2fh3 s VAL 719 Ca 0.05 1.93 -0.01 0.00 0.00 0.00 0.00 61.98 63.95 2fh3 s VAL 719 Cb -0.14 -4.26 0.03 0.00 0.00 0.00 0.00 36.38 32.01 2fh3 s VAL 719 CO -0.04 0.36 0.03 -0.69 0.00 0.00 0.00 175.10 174.77 2fh3 s VAL 720 N -0.20 0.00 0.04 2.92 1.01 -0.46 -4.93 120.40 118.77 2fh3 s VAL 720 Ca 0.43 0.27 -0.05 0.00 0.00 0.00 0.00 61.98 62.63 2fh3 s VAL 720 Cb -0.23 -0.18 -0.05 0.00 0.00 0.00 0.00 36.38 35.92 2fh3 s VAL 720 CO 0.28 0.15 0.28 -0.54 0.00 0.00 0.00 175.10 175.26 2fh3 s LYS 721 N 1.56 3.56 -0.13 2.72 1.02 -1.26 -0.12 119.74 127.08 2fh3 s LYS 721 Ca -0.03 -0.14 -0.37 0.00 0.02 0.00 0.00 55.97 55.45 2fh3 s LYS 721 Cb -0.13 -3.03 -0.14 0.00 -0.52 0.00 0.00 37.83 34.01 2fh3 s LYS 721 CO -0.03 0.61 1.72 0.94 -0.92 0.00 0.00 175.35 177.67 2fh3 n GLN 722 N 0.79 1.57 0.00 1.68 7.27 -0.67 -1.06 117.38 126.94 2fh3 n GLN 722 Ca -0.09 0.57 0.00 0.00 0.07 0.00 0.00 57.00 57.56 2fh3 n GLN 722 Cb 0.52 -2.31 0.00 0.00 2.41 0.00 0.00 30.24 30.86 2fh3 n GLN 722 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2fh3 n GLY 723 N 3.98 2.43 2.58 1.69 0.00 -1.26 -4.89 105.19 109.71 2fh3 n GLY 723 Ca 0.23 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.99 2fh3 n GLY 723 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2fh3 n PHE 724 N -2.00 3.49 -3.66 1.61 3.01 -0.23 -5.07 117.46 114.62 2fh3 n PHE 724 Ca 0.00 -3.31 -0.36 0.00 1.01 0.00 0.00 57.45 54.79 2fh3 n PHE 724 Cb 0.00 -0.18 -0.07 0.00 -0.01 0.00 0.00 39.48 39.22 2fh3 n PHE 724 CO 0.00 0.00 0.00 -1.83 1.01 0.00 0.00 176.76 175.94 2fh3 s GLU 725 N -3.51 4.01 0.60 -1.08 1.03 -1.25 -4.34 118.70 114.16 2fh3 s GLU 725 Ca 0.48 0.01 -0.16 0.00 0.03 0.00 0.00 54.97 55.33 2fh3 s GLU 725 Cb 0.38 -3.34 -0.03 0.00 -0.80 0.00 0.00 34.13 30.33 2fh3 s GLU 725 CO -0.17 0.43 1.07 -1.25 -1.33 0.00 0.00 175.26 174.01 2fh3 s PRO 726 N -0.09 3.22 0.30 -4.83 0.04 -1.26 -4.81 135.00 127.57 2fh3 s PRO 726 Ca 0.15 1.29 0.06 0.00 0.04 0.00 0.00 61.00 62.54 2fh3 s PRO 726 Cb -0.13 -2.01 0.77 0.00 0.04 0.00 0.00 34.50 33.17 2fh3 s PRO 726 CO 0.04 -0.90 1.74 -1.35 0.04 0.00 0.00 177.00 176.57 2fh3 h PRO 727 N 0.46 0.59 0.00 0.56 0.11 -1.94 0.22 132.00 131.99 2fh3 h PRO 727 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2fh3 h PRO 727 Cb 1.23 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2fh3 h PRO 727 CO 0.57 0.39 0.00 0.66 -0.21 0.00 0.00 178.00 179.41 2fh3 h SER 728 N 0.61 0.00 0.00 -2.05 4.64 -1.88 0.17 113.55 115.04 2fh3 h SER 728 Ca 0.59 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.89 2fh3 h SER 728 Cb 1.03 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.12 2fh3 h SER 728 CO -0.45 0.00 -0.13 0.15 -0.87 0.00 0.00 176.83 175.53 2fh3 h PHE 729 N 0.00 0.00 -0.27 4.77 3.57 -1.33 -3.38 116.94 120.30 2fh3 h PHE 729 Ca 0.00 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.52 2fh3 h PHE 729 Cb 0.32 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 2fh3 h PHE 729 CO 0.00 0.72 0.19 0.28 -2.23 0.00 0.00 178.31 177.27 2fh3 h VAL 730 N -1.00 1.01 -0.20 1.41 2.07 -0.72 -2.73 116.25 116.08 2fh3 h VAL 730 Ca -0.03 -0.09 0.06 0.00 0.82 0.00 0.00 66.70 67.45 2fh3 h VAL 730 Cb 0.73 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 2fh3 h VAL 730 CO -0.02 0.05 0.34 1.23 0.02 0.00 0.00 177.57 179.19 2fh3 h GLY 731 N 0.27 0.00 -0.53 2.17 0.00 -0.89 -1.86 103.07 102.24 2fh3 h GLY 731 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 2fh3 h GLY 731 CO -0.02 0.00 0.00 0.79 0.00 0.00 0.00 176.54 177.31 2fh3 n TRP 732 N -3.41 0.21 -4.77 5.60 7.02 -1.03 -4.86 117.44 116.20 2fh3 n TRP 732 Ca 0.02 -0.10 -0.31 0.00 -1.02 0.00 0.00 57.50 56.09 2fh3 n TRP 732 Cb 0.46 0.00 -0.13 0.00 -2.42 0.00 0.00 31.31 29.21 2fh3 n TRP 732 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 2fh3 s PHE 733 N -1.79 2.48 -0.73 -5.99 0.40 -0.70 -4.61 117.98 107.04 2fh3 s PHE 733 Ca 0.21 -0.31 -0.21 0.00 -0.60 0.00 0.00 56.93 56.02 2fh3 s PHE 733 Cb 0.11 -1.45 0.09 0.00 0.51 0.00 0.00 43.02 42.28 2fh3 s PHE 733 CO 0.15 0.20 0.98 -1.17 0.70 0.00 0.00 175.22 176.08 2fh3 s LEU 734 N -1.32 4.71 0.05 -0.37 2.96 -0.10 -4.71 118.68 119.90 2fh3 s LEU 734 Ca 0.13 -1.35 0.00 0.00 -0.22 0.00 0.00 54.13 52.70 2fh3 s LEU 734 Cb -0.10 -2.40 0.00 0.00 0.50 0.00 0.00 46.19 44.19 2fh3 s LEU 734 CO 0.04 -1.29 0.00 0.61 -1.32 0.00 0.00 176.35 174.38 2fh3 n GLY 735 N 5.38 -3.52 2.84 7.98 0.00 -1.26 -4.78 105.19 111.83 2fh3 n GLY 735 Ca 0.03 -0.92 -0.16 0.00 0.00 0.00 0.00 46.02 44.97 2fh3 n GLY 735 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2fh3 s TRP 736 N -1.21 -0.17 -0.28 1.61 -0.11 -1.26 -4.48 118.94 113.04 2fh3 s TRP 736 Ca 0.00 0.57 -0.08 0.00 1.22 0.00 0.00 56.10 57.82 2fh3 s TRP 736 Cb 0.00 -0.24 -0.01 0.00 -1.50 0.00 0.00 33.47 31.72 2fh3 s TRP 736 CO 0.00 -0.25 0.09 0.34 -4.62 0.00 0.00 176.95 172.52 2fh3 s ASP 737 N 2.09 5.22 0.20 5.86 3.68 -1.26 -4.90 116.67 127.56 2fh3 s ASP 737 Ca 0.01 -0.50 -0.11 0.00 2.13 0.00 0.00 52.55 54.08 2fh3 s ASP 737 Cb -0.12 -1.92 0.18 0.00 -1.45 0.00 0.00 42.92 39.60 2fh3 s ASP 737 CO -0.06 -0.14 1.81 0.44 0.13 0.00 0.00 175.17 177.35 2fh3 h ASP 738 N 8.27 0.54 -0.31 -0.34 3.32 -2.04 -3.02 116.42 122.84 2fh3 h ASP 738 Ca -0.34 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.63 2fh3 h ASP 738 Cb 1.15 -0.09 -0.06 0.00 0.22 0.00 0.00 39.33 40.55 2fh3 h ASP 738 CO 0.60 0.36 0.12 0.47 -1.72 0.00 0.00 179.24 179.07 2fh3 n ASP 739 N -4.78 3.09 0.20 6.45 8.00 -1.26 -4.24 116.55 124.00 2fh3 n ASP 739 Ca 0.06 -2.50 0.04 0.00 0.71 0.00 0.00 54.79 53.11 2fh3 n ASP 739 Cb 0.12 -0.60 0.41 0.00 -0.02 0.00 0.00 41.12 41.04 2fh3 n ASP 739 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2fh3 h TYR 740 N 1.06 0.00 -0.03 1.24 5.03 -1.97 -3.57 116.97 118.74 2fh3 h TYR 740 Ca 0.12 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.43 2fh3 h TYR 740 Cb 1.39 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.67 2fh3 h TYR 740 CO 0.53 0.32 0.00 0.91 -1.32 0.00 0.00 178.16 178.60