#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vig h ASN 7 N 0.00 0.00 -5.18 7.28 2.35 -2.11 -3.50 115.58 114.43 1vig h ASN 7 Ca 0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 1vig h ASN 7 Cb 0.00 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.40 1vig h ASN 7 CO 0.00 0.25 -0.13 0.54 -1.65 0.00 0.00 177.43 176.43 1vig n ARG 8 N -3.06 -1.35 -3.98 0.81 5.12 -1.26 -5.05 116.66 107.88 1vig n ARG 8 Ca -0.02 1.31 -0.08 0.00 -1.93 0.00 0.00 57.85 57.13 1vig n ARG 8 Cb 0.07 -5.41 -0.09 0.00 -1.16 0.00 0.00 32.46 25.88 1vig n ARG 8 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 1vig s MET 9 N -3.21 0.70 -0.28 5.56 -1.94 -1.26 -4.95 119.30 113.91 1vig s MET 9 Ca 0.07 -1.07 0.00 0.00 -1.71 0.00 0.00 55.69 52.98 1vig s MET 9 Cb -0.01 0.26 0.08 0.00 2.01 0.00 0.00 34.83 37.18 1vig s MET 9 CO 0.68 -0.18 0.03 -0.51 -0.01 0.00 0.00 175.02 175.04 1vig s ASP 10 N -2.82 4.01 0.30 3.03 1.01 -0.99 -4.97 116.67 116.23 1vig s ASP 10 Ca 0.05 -1.51 0.08 0.00 0.71 0.00 0.00 52.55 51.88 1vig s ASP 10 Cb 0.06 -1.10 -0.04 0.00 1.01 0.00 0.00 42.92 42.86 1vig s ASP 10 CO -0.10 -0.34 0.19 -0.72 0.21 0.00 0.00 175.17 174.41 1vig s TYR 11 N 1.42 2.89 -0.30 4.23 -0.85 -1.26 -0.19 117.35 123.29 1vig s TYR 11 Ca 0.04 -0.25 -0.18 0.00 -0.52 0.00 0.00 57.07 56.16 1vig s TYR 11 Cb -0.18 -1.56 0.21 0.00 0.38 0.00 0.00 41.96 40.81 1vig s TYR 11 CO -0.14 0.38 1.31 0.54 -1.52 0.00 0.00 175.55 176.13 1vig s VAL 12 N -2.28 -0.00 -0.21 -3.49 0.11 0.15 -4.92 120.40 109.75 1vig s VAL 12 Ca 0.36 0.00 -0.07 0.00 -2.93 0.00 0.00 61.98 59.34 1vig s VAL 12 Cb -0.06 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.76 1vig s VAL 12 CO 0.24 0.00 0.06 -1.83 -3.33 0.00 0.00 175.10 170.24 1vig s GLU 13 N 1.54 3.82 -0.03 1.54 -1.05 -1.26 -0.41 118.70 122.85 1vig s GLU 13 Ca -0.03 -0.41 -0.21 0.00 -0.15 0.00 0.00 54.97 54.17 1vig s GLU 13 Cb -0.01 -3.23 -0.05 0.00 -0.44 0.00 0.00 34.13 30.40 1vig s GLU 13 CO -0.13 0.09 0.60 0.96 0.95 0.00 0.00 175.26 177.73 1vig s ILE 14 N 0.87 4.97 0.17 1.83 -4.36 0.29 -4.90 121.20 120.06 1vig s ILE 14 Ca 0.03 1.24 -0.30 0.00 -0.26 0.00 0.00 60.65 61.36 1vig s ILE 14 Cb -0.14 -3.93 -0.08 0.00 1.25 0.00 0.00 42.46 39.56 1vig s ILE 14 CO 0.02 0.38 1.19 0.21 0.24 0.00 0.00 174.94 176.98 1vig s ASN 15 N 0.09 7.10 0.04 4.36 3.84 -1.26 -1.10 114.94 128.00 1vig s ASN 15 Ca 0.31 2.20 -0.00 0.00 0.21 0.00 0.00 52.86 55.58 1vig s ASN 15 Cb -0.18 -2.60 -0.03 0.00 -0.55 0.00 0.00 41.25 37.89 1vig s ASN 15 CO 0.16 -0.37 -0.03 -0.63 -2.79 0.00 0.00 177.10 173.44 1vig s ILE 16 N 0.04 0.19 0.00 -5.21 -1.09 -0.97 -4.89 121.20 109.27 1vig s ILE 16 Ca 0.53 -1.41 0.00 0.00 -2.23 0.00 0.00 60.65 57.54 1vig s ILE 16 Cb -0.32 -0.96 0.00 0.00 -1.58 0.00 0.00 42.46 39.60 1vig s ILE 16 CO 0.36 -0.77 0.00 0.47 -1.23 0.00 0.00 174.94 173.77 1vig n ASP 17 N 0.78 0.00 -4.04 3.58 8.00 -1.26 0.18 116.55 123.80 1vig n ASP 17 Ca -0.18 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.02 1vig n ASP 17 Cb 0.58 -0.00 0.12 0.00 -0.02 0.00 0.00 41.12 41.80 1vig n ASP 17 CO 0.00 0.00 0.00 1.57 -0.39 0.00 0.00 177.20 178.38 1vig n HIS 18 N -1.16 -1.55 -0.79 1.24 -0.00 -1.26 -4.21 115.22 107.48 1vig n HIS 18 Ca 0.00 0.29 -0.31 0.00 0.46 0.00 0.00 57.72 58.16 1vig n HIS 18 Cb 0.00 -1.46 -0.05 0.00 -0.12 0.00 0.00 29.99 28.36 1vig n HIS 18 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 1vig n LYS 19 N -0.49 1.30 -1.09 1.57 5.02 -1.26 -4.60 118.16 118.60 1vig n LYS 19 Ca 0.01 -1.44 -0.25 0.00 -2.02 0.00 0.00 58.31 54.61 1vig n LYS 19 Cb 0.58 -2.60 0.06 0.00 -0.02 0.00 0.00 35.03 33.05 1vig n LYS 19 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1vig n PHE 20 N 6.34 2.34 0.00 2.13 3.01 -1.26 -4.20 117.46 125.81 1vig n PHE 20 Ca 0.41 -2.45 0.00 0.00 1.01 0.00 0.00 57.45 56.43 1vig n PHE 20 Cb 0.27 -1.18 0.00 0.00 -0.01 0.00 0.00 39.48 38.56 1vig n PHE 20 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 1vig n HIS 21 N -0.26 0.00 -0.06 1.38 8.25 -1.26 -4.51 115.22 118.75 1vig n HIS 21 Ca 0.46 0.00 0.24 0.00 -0.26 0.00 0.00 57.72 58.16 1vig n HIS 21 Cb 0.64 0.01 0.72 0.00 1.12 0.00 0.00 29.99 32.48 1vig n HIS 21 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1vig h ARG 22 N 0.00 0.00 0.12 -0.41 2.47 -1.92 -0.77 114.38 113.88 1vig h ARG 22 Ca 0.00 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 1vig h ARG 22 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 1vig h ARG 22 CO 0.00 0.00 -0.06 1.25 0.56 0.00 0.00 179.97 181.72 1vig h HIS 23 N 0.00 -0.15 0.13 3.04 2.76 -1.86 -0.93 115.15 118.14 1vig h HIS 23 Ca 0.32 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.50 1vig h HIS 23 Cb 1.40 0.05 -0.02 0.00 1.55 0.00 0.00 27.41 30.39 1vig h HIS 23 CO 0.00 0.32 -0.16 -0.07 -1.30 0.00 0.00 177.93 176.72 1vig h LEU 24 N -0.73 -0.44 -1.77 0.26 4.07 -1.42 -1.95 115.31 113.33 1vig h LEU 24 Ca -0.02 0.05 -0.03 0.00 0.08 0.00 0.00 57.88 57.96 1vig h LEU 24 Cb 0.54 0.16 -0.00 0.00 1.08 0.00 0.00 40.66 42.43 1vig h LEU 24 CO 0.03 -0.24 -0.16 0.16 -1.08 0.00 0.00 178.44 177.14 1vig h ILE 25 N -0.34 0.83 0.00 1.22 3.07 -1.33 -3.37 117.51 117.59 1vig h ILE 25 Ca 0.01 -0.62 0.00 0.00 1.55 0.00 0.00 64.86 65.80 1vig h ILE 25 Cb 0.34 1.36 0.00 0.00 -0.27 0.00 0.00 36.82 38.25 1vig h ILE 25 CO -0.06 0.16 0.00 0.61 -1.05 0.00 0.00 178.15 177.80 1vig n GLY 26 N -0.80 1.26 3.60 0.16 0.00 -0.35 0.51 105.19 109.58 1vig n GLY 26 Ca -0.02 -0.65 -0.40 0.00 0.00 0.00 0.00 46.02 44.95 1vig n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vig s LYS 27 N 0.00 3.97 -1.19 1.61 1.02 -1.26 -4.16 119.74 119.73 1vig s LYS 27 Ca 0.00 0.15 0.00 0.00 0.02 0.00 0.00 55.97 56.14 1vig s LYS 27 Cb 0.00 -3.68 0.00 0.00 -0.52 0.00 0.00 37.83 33.63 1vig s LYS 27 CO 0.00 -0.39 0.00 0.43 -0.92 0.00 0.00 175.35 174.47 1vig n SER 28 N 5.52 -3.94 -0.81 2.83 7.64 -1.26 -4.36 113.62 119.24 1vig n SER 28 Ca -0.05 0.21 0.00 0.00 1.01 0.00 0.00 58.87 60.04 1vig n SER 28 Cb 0.50 -3.42 0.00 0.00 -1.01 0.00 0.00 64.21 60.28 1vig n SER 28 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vig n GLY 29 N -0.68 -3.97 1.97 0.23 0.00 -1.14 -5.07 105.19 96.53 1vig n GLY 29 Ca -0.15 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.05 1vig n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vig n ALA 30 N -0.43 1.49 -0.04 4.61 0.00 0.18 -4.93 120.51 121.39 1vig n ALA 30 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1vig n ALA 30 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 1vig n ALA 30 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1vig h ASN 31 N 0.00 0.21 -1.44 0.00 -0.73 -1.72 -2.90 115.58 108.99 1vig h ASN 31 Ca 0.00 -0.39 0.42 0.00 1.87 0.00 0.00 56.30 58.20 1vig h ASN 31 Cb 0.00 -0.06 -0.08 0.00 0.27 0.00 0.00 38.32 38.45 1vig h ASN 31 CO 0.00 0.55 1.00 0.16 -0.37 0.00 0.00 177.43 178.78 1vig h ILE 32 N -0.14 0.24 0.20 2.57 3.07 -1.85 0.93 117.51 122.52 1vig h ILE 32 Ca 0.02 -0.02 -0.31 0.00 1.55 0.00 0.00 64.86 66.10 1vig h ILE 32 Cb 0.47 0.17 0.02 0.00 -0.27 0.00 0.00 36.82 37.22 1vig h ILE 32 CO 0.01 0.01 -1.41 -1.13 -1.05 0.00 0.00 178.15 174.58 1vig h ASN 33 N 0.06 0.67 -0.54 2.16 -0.73 -1.89 -2.62 115.58 112.70 1vig h ASN 33 Ca 0.74 -0.73 0.05 0.00 1.87 0.00 0.00 56.30 58.23 1vig h ASN 33 Cb 2.70 -0.22 -0.05 0.00 0.27 0.00 0.00 38.32 41.02 1vig h ASN 33 CO -0.13 1.58 0.27 -0.09 -0.37 0.00 0.00 177.43 178.68 1vig h ARG 34 N 0.12 0.49 0.38 6.67 2.43 0.11 -1.69 114.38 122.89 1vig h ARG 34 Ca -0.22 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 58.91 1vig h ARG 34 Cb 2.09 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 31.53 1vig h ARG 34 CO 0.24 0.33 -0.18 0.82 -1.51 0.00 0.00 179.97 179.67 1vig h ILE 35 N 0.51 0.00 -1.87 1.20 5.03 -1.43 0.18 117.51 121.13 1vig h ILE 35 Ca 0.24 -0.49 0.55 0.00 -0.12 0.00 0.00 64.86 65.05 1vig h ILE 35 Cb 0.17 0.00 -0.09 0.00 -3.03 0.00 0.00 36.82 33.88 1vig h ILE 35 CO -0.18 0.00 1.33 0.50 -0.68 0.00 0.00 178.15 179.12 1vig h LYS 36 N -1.00 0.00 0.08 2.37 3.64 -1.43 0.88 116.57 121.11 1vig h LYS 36 Ca -0.05 -0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 58.98 1vig h LYS 36 Cb 0.39 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 1vig h LYS 36 CO 0.09 0.00 -1.98 -3.47 -2.27 0.00 0.00 179.45 171.82 1vig n ASP 37 N -4.05 2.05 0.10 4.20 -0.08 -0.64 -2.45 116.55 115.68 1vig n ASP 37 Ca 0.43 0.20 -0.04 0.00 -1.51 0.00 0.00 54.79 53.87 1vig n ASP 37 Cb 1.93 -0.81 -0.02 0.00 2.34 0.00 0.00 41.12 44.56 1vig n ASP 37 CO 0.00 0.00 0.00 -0.61 0.12 0.00 0.00 177.20 176.71 1vig h GLN 38 N -0.18 -0.25 0.00 -0.67 5.75 0.34 -3.24 115.11 116.86 1vig h GLN 38 Ca -0.45 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.07 1vig h GLN 38 Cb 1.87 0.06 0.00 0.00 1.07 0.00 0.00 27.48 30.47 1vig h GLN 38 CO -0.02 -0.17 0.00 0.66 -2.65 0.00 0.00 178.83 176.66 1vig n TYR 39 N -3.06 0.00 -3.82 3.99 4.02 0.24 -4.89 117.16 113.64 1vig n TYR 39 Ca -0.03 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.62 1vig n TYR 39 Cb 0.10 -0.05 0.01 0.00 -0.02 0.00 0.00 39.34 39.38 1vig n TYR 39 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1vig n LYS 40 N -1.05 -4.40 -2.87 -0.72 3.00 -1.10 -4.45 118.16 106.57 1vig n LYS 40 Ca 0.19 0.54 -0.10 0.00 -0.00 0.00 0.00 58.31 58.94 1vig n LYS 40 Cb 0.11 -5.00 -0.02 0.00 0.00 0.00 0.00 35.03 30.12 1vig n LYS 40 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1vig n VAL 41 N -4.36 0.00 -3.83 3.15 0.24 -1.02 -4.77 118.33 107.73 1vig n VAL 41 Ca -0.25 -0.82 -0.30 0.00 -2.04 0.00 0.00 64.34 60.93 1vig n VAL 41 Cb 0.66 0.23 -0.15 0.00 -1.47 0.00 0.00 33.84 33.11 1vig n VAL 41 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1vig s SER 42 N -1.91 4.17 -0.06 -1.34 0.15 0.14 -4.13 113.70 110.72 1vig s SER 42 Ca 0.04 -1.70 -0.04 0.00 0.70 0.00 0.00 55.95 54.95 1vig s SER 42 Cb 0.00 -1.09 -0.04 0.00 -1.71 0.00 0.00 66.02 63.18 1vig s SER 42 CO 0.03 -0.38 0.12 0.54 1.20 0.00 0.00 173.24 174.74 1vig s VAL 43 N 1.41 5.15 -0.03 4.45 0.11 -1.26 -1.58 120.40 128.65 1vig s VAL 43 Ca 0.08 -0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 1vig s VAL 43 Cb -0.18 -3.30 0.03 0.00 -1.53 0.00 0.00 36.38 31.40 1vig s VAL 43 CO -0.18 0.48 -0.00 -0.13 -3.33 0.00 0.00 175.10 171.94 1vig s ARG 44 N -1.41 0.36 -0.57 1.54 1.81 -0.08 -5.00 118.95 115.60 1vig s ARG 44 Ca 0.20 0.07 -0.08 0.00 -1.72 0.00 0.00 55.73 54.19 1vig s ARG 44 Cb -0.12 -0.55 0.15 0.00 -0.45 0.00 0.00 34.95 33.98 1vig s ARG 44 CO 0.10 -0.14 0.44 0.42 -0.68 0.00 0.00 175.30 175.43 1vig s ILE 45 N 1.10 4.30 -0.38 1.52 -1.09 -1.26 -2.18 121.20 123.20 1vig s ILE 45 Ca -0.09 -2.22 -0.29 0.00 -2.23 0.00 0.00 60.65 55.83 1vig s ILE 45 Cb -0.13 -3.79 0.01 0.00 -1.58 0.00 0.00 42.46 36.96 1vig s ILE 45 CO -0.02 -0.84 1.39 -2.16 -1.23 0.00 0.00 174.94 172.07 1vig s PRO 46 N 0.78 3.66 -0.47 2.79 0.04 -1.26 -4.97 135.00 135.57 1vig s PRO 46 Ca 0.11 1.01 -0.29 0.00 0.04 0.00 0.00 61.00 61.87 1vig s PRO 46 Cb -0.22 -3.99 0.03 0.00 0.04 0.00 0.00 34.50 30.36 1vig s PRO 46 CO -0.03 -1.46 1.16 -1.25 0.04 0.00 0.00 177.00 175.46 1vig s PRO 47 N 4.75 3.72 0.00 0.56 0.04 -1.26 -4.72 135.00 138.09 1vig s PRO 47 Ca 0.60 0.61 0.00 0.00 0.04 0.00 0.00 61.00 62.25 1vig s PRO 47 Cb -0.14 -3.91 0.00 0.00 0.04 0.00 0.00 34.50 30.49 1vig s PRO 47 CO 0.30 -1.38 0.00 -0.40 0.04 0.00 0.00 177.00 175.56 1vig n ASP 48 N 7.88 0.09 -2.24 6.66 5.68 -1.26 -5.02 116.55 128.35 1vig n ASP 48 Ca 0.12 0.00 -0.16 0.00 -0.50 0.00 0.00 54.79 54.25 1vig n ASP 48 Cb 0.49 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.45 1vig n ASP 48 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1vig n SER 49 N -2.37 -4.62 -4.11 -1.12 7.64 -1.26 -4.86 113.62 102.91 1vig n SER 49 Ca 0.00 0.16 -0.43 0.00 1.01 0.00 0.00 58.87 59.61 1vig n SER 49 Cb 0.06 -3.95 0.00 0.00 -1.01 0.00 0.00 64.21 59.31 1vig n SER 49 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1vig n GLU 50 N -2.73 3.51 0.00 1.43 1.02 -1.26 -4.80 120.64 117.81 1vig n GLU 50 Ca -0.18 -3.64 0.00 0.00 -0.02 0.00 0.00 57.16 53.32 1vig n GLU 50 Cb 0.62 -2.98 0.00 0.00 -0.02 0.00 0.00 31.44 29.06 1vig n GLU 50 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1vig n LYS 51 N 4.65 0.00 -4.13 3.49 4.81 -1.26 -4.76 118.16 120.96 1vig n LYS 51 Ca 0.39 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.55 1vig n LYS 51 Cb 0.39 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.37 1vig n LYS 51 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1vig s SER 52 N 0.00 5.12 0.36 3.14 0.15 -1.26 -4.89 113.70 116.32 1vig s SER 52 Ca 0.00 -0.22 0.09 0.00 0.70 0.00 0.00 55.95 56.52 1vig s SER 52 Cb 0.00 -1.23 -0.06 0.00 -1.71 0.00 0.00 66.02 63.02 1vig s SER 52 CO 0.00 0.12 0.01 0.20 1.20 0.00 0.00 173.24 174.77 1vig s ASN 53 N -2.71 4.05 -0.32 5.45 0.01 0.13 -4.66 114.94 116.88 1vig s ASN 53 Ca 0.28 -1.12 -0.03 0.00 -0.71 0.00 0.00 52.86 51.28 1vig s ASN 53 Cb -0.11 -0.46 0.19 0.00 0.41 0.00 0.00 41.25 41.29 1vig s ASN 53 CO 0.20 -0.31 0.85 -0.22 -1.51 0.00 0.00 177.10 176.11 1vig s LEU 54 N -3.71 -0.94 0.54 0.60 0.20 -1.25 -2.30 118.68 111.82 1vig s LEU 54 Ca 0.35 -0.11 -0.18 0.00 0.69 0.00 0.00 54.13 54.88 1vig s LEU 54 Cb 0.03 1.43 -0.06 0.00 -0.43 0.00 0.00 46.19 47.15 1vig s LEU 54 CO 0.19 -0.15 1.04 -0.63 -0.29 0.00 0.00 176.35 176.52 1vig s ILE 55 N 2.51 3.83 -0.04 6.68 1.01 -0.26 -4.71 121.20 130.22 1vig s ILE 55 Ca 0.18 1.00 0.06 0.00 0.00 0.00 0.00 60.65 61.89 1vig s ILE 55 Cb -0.03 -3.43 -0.02 0.00 0.01 0.00 0.00 42.46 38.99 1vig s ILE 55 CO -0.19 -0.39 -0.23 -0.13 0.00 0.00 0.00 174.94 174.01 1vig s ARG 56 N -3.67 2.39 0.09 2.79 0.52 -0.93 -0.55 118.95 119.60 1vig s ARG 56 Ca 0.65 -0.86 0.03 0.00 -0.52 0.00 0.00 55.73 55.03 1vig s ARG 56 Cb -0.16 -2.18 -0.04 0.00 0.52 0.00 0.00 34.95 33.10 1vig s ARG 56 CO 0.28 0.50 -0.09 0.42 0.02 0.00 0.00 175.30 176.43 1vig s ILE 57 N -0.45 0.86 -0.29 1.52 -1.09 0.45 -0.90 121.20 121.30 1vig s ILE 57 Ca 0.05 -1.67 -0.25 0.00 -2.23 0.00 0.00 60.65 56.55 1vig s ILE 57 Cb -0.12 -1.38 0.17 0.00 -1.58 0.00 0.00 42.46 39.56 1vig s ILE 57 CO 0.01 -0.62 1.32 -0.70 -1.23 0.00 0.00 174.94 173.72 1vig s GLU 58 N -2.94 0.19 0.00 2.79 -6.30 -0.62 0.31 118.70 112.14 1vig s GLU 58 Ca 0.06 0.22 0.00 0.00 -2.50 0.00 0.00 54.97 52.75 1vig s GLU 58 Cb -0.02 0.09 0.00 0.00 0.00 0.00 0.00 34.13 34.21 1vig s GLU 58 CO -0.01 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 175.66 1vig n GLY 59 N 1.70 2.66 1.81 -1.50 0.00 0.73 0.24 105.19 110.83 1vig n GLY 59 Ca -0.10 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1vig n GLY 59 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vig n ASP 60 N 0.00 -1.42 -2.51 1.61 8.00 -1.26 -2.35 116.55 118.61 1vig n ASP 60 Ca 0.00 0.33 0.00 0.00 0.71 0.00 0.00 54.79 55.83 1vig n ASP 60 Cb 0.00 1.61 0.00 0.00 -0.02 0.00 0.00 41.12 42.71 1vig n ASP 60 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1vig n PRO 61 N -2.75 -0.39 0.25 -0.24 -0.04 -1.26 -4.67 135.00 125.90 1vig n PRO 61 Ca 0.00 0.00 0.17 0.00 -0.04 0.00 0.00 63.50 63.63 1vig n PRO 61 Cb 0.00 0.00 0.91 0.00 -0.04 0.00 0.00 33.50 34.37 1vig n PRO 61 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1vig h GLN 62 N 0.00 0.00 -0.91 0.54 4.20 -2.00 -2.42 115.11 114.52 1vig h GLN 62 Ca 0.00 0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.81 1vig h GLN 62 Cb 0.00 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.71 1vig h GLN 62 CO 0.00 0.00 0.58 0.78 -0.67 0.00 0.00 178.83 179.52 1vig h GLY 63 N 0.04 1.33 0.49 3.46 0.00 -1.89 0.42 103.07 106.91 1vig h GLY 63 Ca 0.00 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 1vig h GLY 63 CO 0.00 0.21 -0.04 -0.24 0.00 0.00 0.00 176.54 176.48 1vig h VAL 64 N 0.92 1.43 0.00 4.60 3.04 -1.65 -1.16 116.25 123.43 1vig h VAL 64 Ca 0.42 -1.34 -0.05 0.00 -1.01 0.00 0.00 66.70 64.72 1vig h VAL 64 Cb 0.39 2.29 -0.01 0.00 -2.01 0.00 0.00 31.29 31.95 1vig h VAL 64 CO -0.18 0.36 -0.24 0.06 -1.01 0.00 0.00 177.57 176.55 1vig h GLN 65 N -0.47 0.00 0.22 4.17 3.07 -1.63 -0.14 115.11 120.33 1vig h GLN 65 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 1vig h GLN 65 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.16 1vig h GLN 65 CO 0.01 0.24 -0.11 0.37 0.09 0.00 0.00 178.83 179.43 1vig h GLN 66 N 0.00 -0.29 -0.54 0.06 5.75 -0.14 -2.61 115.11 117.35 1vig h GLN 66 Ca -0.00 0.02 0.13 0.00 -0.15 0.00 0.00 58.65 58.65 1vig h GLN 66 Cb 0.59 0.07 -0.03 0.00 1.07 0.00 0.00 27.48 29.18 1vig h GLN 66 CO 0.03 -0.19 0.37 0.00 -2.65 0.00 0.00 178.83 176.39 1vig h ALA 67 N -1.44 2.30 -1.58 3.38 0.00 -1.23 0.12 119.26 120.81 1vig h ALA 67 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1vig h ALA 67 Cb 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1vig h ALA 67 CO 0.05 -0.44 0.00 1.17 0.00 0.00 0.00 179.25 180.03 1vig n LYS 68 N -4.43 0.00 -0.15 0.00 4.81 -0.07 -0.64 118.16 117.68 1vig n LYS 68 Ca 0.09 0.24 0.27 0.00 -0.87 0.00 0.00 58.31 58.04 1vig n LYS 68 Cb 0.50 -1.24 0.71 0.00 0.02 0.00 0.00 35.03 35.03 1vig n LYS 68 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 1vig h ARG 69 N 0.00 0.02 0.35 1.64 2.43 -1.31 -0.29 114.38 117.22 1vig h ARG 69 Ca 0.00 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1vig h ARG 69 Cb 0.00 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1vig h ARG 69 CO 0.00 0.01 -0.17 1.49 -1.51 0.00 0.00 179.97 179.79 1vig h GLU 70 N 0.02 -0.46 -0.58 0.20 4.57 -0.59 0.68 114.58 118.42 1vig h GLU 70 Ca 0.40 0.03 0.05 0.00 -1.18 0.00 0.00 59.36 58.66 1vig h GLU 70 Cb 1.57 0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 30.21 1vig h GLU 70 CO -0.01 -0.28 0.31 -0.07 -1.18 0.00 0.00 179.01 177.78 1vig h LEU 71 N -0.52 0.44 -0.03 1.64 3.38 0.88 0.39 115.31 121.51 1vig h LEU 71 Ca -0.05 0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1vig h LEU 71 Cb 0.39 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1vig h LEU 71 CO 0.08 0.30 -0.05 -0.07 0.09 0.00 0.00 178.44 178.79 1vig h LEU 72 N 0.58 -0.13 0.00 1.67 3.38 -1.18 0.22 115.31 119.84 1vig h LEU 72 Ca 0.26 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1vig h LEU 72 Cb 0.16 0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1vig h LEU 72 CO -0.17 -0.07 0.00 -0.62 0.09 0.00 0.00 178.44 177.67 1vig n GLU 73 N -5.16 0.00 -0.08 1.13 -0.58 0.21 -4.18 120.64 111.98 1vig n GLU 73 Ca -0.06 0.36 -0.12 0.00 -0.42 0.00 0.00 57.16 56.93 1vig n GLU 73 Cb 0.09 -1.12 -0.07 0.00 -0.57 0.00 0.00 31.44 29.78 1vig n GLU 73 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1vig h LEU 74 N 0.00 -1.55 2.04 -4.62 -0.00 -0.35 -3.45 115.31 107.38 1vig h LEU 74 Ca 0.00 0.21 -0.36 0.00 -0.00 0.00 0.00 57.88 57.73 1vig h LEU 74 Cb 0.00 0.64 0.01 0.00 -0.00 0.00 0.00 40.66 41.31 1vig h LEU 74 CO 0.00 -0.41 -0.49 0.00 -0.00 0.00 0.00 178.44 177.54 1vig n ALA 75 N -3.04 -0.64 1.57 1.53 0.00 0.76 -5.05 120.51 115.65 1vig n ALA 75 Ca -0.03 0.18 0.14 0.00 0.00 0.00 0.00 53.44 53.74 1vig n ALA 75 Cb 0.36 -2.49 0.59 0.00 0.00 0.00 0.00 19.45 17.91 1vig n ALA 75 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95