#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vig n ASN 7 N 0.00 0.00 -3.62 9.51 2.85 -1.26 -5.14 115.26 117.60 1vig n ASN 7 Ca 0.00 0.00 -0.10 0.00 -0.11 0.00 0.00 54.58 54.37 1vig n ASN 7 Cb 0.00 0.09 -0.06 0.00 1.24 0.00 0.00 39.78 41.05 1vig n ASN 7 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 1vig s ARG 8 N -1.76 0.54 0.19 1.20 3.52 -1.26 -5.14 118.95 116.24 1vig s ARG 8 Ca 0.00 0.46 -0.32 0.00 -0.13 0.00 0.00 55.73 55.74 1vig s ARG 8 Cb 0.00 0.26 -0.11 0.00 -1.56 0.00 0.00 34.95 33.54 1vig s ARG 8 CO 0.00 -0.10 1.69 -1.64 -0.81 0.00 0.00 175.30 174.44 1vig s MET 9 N -0.19 4.15 -0.16 5.12 -1.94 -1.26 -4.74 119.30 120.28 1vig s MET 9 Ca 0.01 2.54 -0.04 0.00 -1.71 0.00 0.00 55.69 56.49 1vig s MET 9 Cb -0.04 -3.14 -0.03 0.00 2.01 0.00 0.00 34.83 33.63 1vig s MET 9 CO -0.04 -0.72 -0.02 -0.51 -0.01 0.00 0.00 175.02 173.72 1vig s ASP 10 N 1.31 4.90 0.41 3.03 1.11 -0.96 -5.00 116.67 121.46 1vig s ASP 10 Ca 0.74 -0.11 0.07 0.00 0.18 0.00 0.00 52.55 53.44 1vig s ASP 10 Cb -0.48 -1.81 -0.08 0.00 1.07 0.00 0.00 42.92 41.63 1vig s ASP 10 CO 0.32 0.16 0.01 -0.72 1.18 0.00 0.00 175.17 176.13 1vig s TYR 11 N 0.40 2.52 -0.30 4.23 -0.85 -1.26 -1.01 117.35 121.08 1vig s TYR 11 Ca -0.03 -0.66 -0.37 0.00 -0.52 0.00 0.00 57.07 55.49 1vig s TYR 11 Cb -0.14 -1.77 0.17 0.00 0.38 0.00 0.00 41.96 40.60 1vig s TYR 11 CO 0.03 0.45 1.39 0.54 -1.52 0.00 0.00 175.55 176.44 1vig s VAL 12 N -2.70 0.00 0.02 -3.49 0.11 0.14 -4.95 120.40 109.52 1vig s VAL 12 Ca 0.35 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.44 1vig s VAL 12 Cb 0.09 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.93 1vig s VAL 12 CO 0.18 0.00 -0.11 -1.61 -3.33 0.00 0.00 175.10 170.23 1vig s GLU 13 N -1.84 0.82 -0.19 1.54 2.02 -1.26 -0.26 118.70 119.52 1vig s GLU 13 Ca 0.12 -0.57 -0.02 0.00 0.02 0.00 0.00 54.97 54.52 1vig s GLU 13 Cb -0.01 -0.78 -0.01 0.00 0.10 0.00 0.00 34.13 33.43 1vig s GLU 13 CO -0.03 0.20 -0.09 0.96 0.02 0.00 0.00 175.26 176.32 1vig s ILE 14 N -0.62 3.12 0.04 -1.63 -4.36 -0.93 -4.91 121.20 111.90 1vig s ILE 14 Ca 0.01 -0.59 -0.30 0.00 -0.26 0.00 0.00 60.65 59.50 1vig s ILE 14 Cb -0.06 -2.38 -0.08 0.00 1.25 0.00 0.00 42.46 41.19 1vig s ILE 14 CO 0.00 0.47 1.63 0.20 0.24 0.00 0.00 174.94 177.48 1vig s ASN 15 N 1.16 6.64 -0.03 4.36 -0.87 -1.26 -1.73 114.94 123.20 1vig s ASN 15 Ca 0.02 2.41 -0.13 0.00 -1.57 0.00 0.00 52.86 53.58 1vig s ASN 15 Cb -0.14 -2.56 0.02 0.00 -0.02 0.00 0.00 41.25 38.55 1vig s ASN 15 CO -0.02 -0.88 0.29 -0.63 -2.57 0.00 0.00 177.10 173.29 1vig s ILE 16 N 2.87 0.05 -0.39 0.60 1.01 -0.30 -4.96 121.20 120.09 1vig s ILE 16 Ca 0.73 -0.41 0.01 0.00 0.00 0.00 0.00 60.65 60.98 1vig s ILE 16 Cb -0.38 -0.56 0.19 0.00 0.01 0.00 0.00 42.46 41.72 1vig s ILE 16 CO 0.31 -0.22 0.83 1.51 0.00 0.00 0.00 174.94 177.37 1vig s ASP 17 N -1.05 -1.00 -0.31 3.58 -4.77 -1.26 -1.08 116.67 110.78 1vig s ASP 17 Ca -0.11 -0.63 0.01 0.00 -3.30 0.00 0.00 52.55 48.52 1vig s ASP 17 Cb -0.05 1.28 0.06 0.00 -1.09 0.00 0.00 42.92 43.12 1vig s ASP 17 CO 0.03 -0.10 1.07 1.41 0.70 0.00 0.00 175.17 178.28 1vig n HIS 18 N 3.86 -0.16 -2.15 2.11 8.25 -1.26 -4.94 115.22 120.93 1vig n HIS 18 Ca 0.10 -0.59 -0.15 0.00 -0.26 0.00 0.00 57.72 56.82 1vig n HIS 18 Cb 0.60 1.13 -0.02 0.00 1.12 0.00 0.00 29.99 32.82 1vig n HIS 18 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1vig n LYS 19 N -0.40 -1.86 -0.08 -0.41 5.02 -1.26 -4.84 118.16 114.34 1vig n LYS 19 Ca -0.28 0.76 -0.12 0.00 -2.02 0.00 0.00 58.31 56.66 1vig n LYS 19 Cb 0.64 -5.29 -0.05 0.00 -0.02 0.00 0.00 35.03 30.32 1vig n LYS 19 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1vig h PHE 20 N 0.00 0.47 0.33 2.13 -1.00 -1.95 -2.62 116.94 114.30 1vig h PHE 20 Ca -0.34 -0.09 -0.01 0.00 2.81 0.00 0.00 57.97 60.34 1vig h PHE 20 Cb 1.18 -0.12 -0.01 0.00 3.61 0.00 0.00 35.95 40.61 1vig h PHE 20 CO 0.59 0.63 -0.30 0.45 -1.61 0.00 0.00 178.31 178.08 1vig h HIS 21 N 0.17 -0.81 -1.09 -0.55 3.86 -1.96 1.30 115.15 116.07 1vig h HIS 21 Ca 0.06 0.00 0.31 0.00 -1.16 0.00 0.00 60.37 59.58 1vig h HIS 21 Cb 0.47 0.31 -0.06 0.00 1.06 0.00 0.00 27.41 29.19 1vig h HIS 21 CO 0.04 -0.40 0.76 -0.09 0.86 0.00 0.00 177.93 179.10 1vig h ARG 22 N -0.62 0.12 0.00 2.45 1.12 -1.97 0.61 114.38 116.09 1vig h ARG 22 Ca -0.04 -0.01 -0.00 0.00 -1.11 0.00 0.00 59.98 58.82 1vig h ARG 22 Cb 0.53 -0.03 0.00 0.00 -0.01 0.00 0.00 29.97 30.46 1vig h ARG 22 CO -0.01 0.08 -0.00 0.45 -3.11 0.00 0.00 179.97 177.38 1vig h HIS 23 N 0.12 -0.00 -0.11 2.20 3.86 -0.98 -3.22 115.15 117.02 1vig h HIS 23 Ca 0.55 -0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.80 1vig h HIS 23 Cb 1.94 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 30.34 1vig h HIS 23 CO -0.00 0.67 -0.41 -0.07 0.86 0.00 0.00 177.93 178.98 1vig h LEU 24 N -1.00 -1.26 -1.99 2.43 4.07 0.29 0.23 115.31 118.08 1vig h LEU 24 Ca -0.00 0.17 0.11 0.00 0.08 0.00 0.00 57.88 58.23 1vig h LEU 24 Cb 0.67 0.51 -0.01 0.00 1.08 0.00 0.00 40.66 42.91 1vig h LEU 24 CO 0.00 -0.42 0.42 0.16 -1.08 0.00 0.00 178.44 177.52 1vig h ILE 25 N -0.49 0.35 0.00 1.22 3.07 -1.10 -3.36 117.51 117.21 1vig h ILE 25 Ca 0.07 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.48 1vig h ILE 25 Cb 0.62 0.66 0.00 0.00 -0.27 0.00 0.00 36.82 37.83 1vig h ILE 25 CO -0.38 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.33 1vig n GLY 26 N -1.47 1.23 3.44 0.16 0.00 0.81 0.28 105.19 109.65 1vig n GLY 26 Ca 0.06 0.52 -0.44 0.00 0.00 0.00 0.00 46.02 46.17 1vig n GLY 26 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vig s LYS 27 N 0.00 3.42 -0.92 1.61 2.47 -1.26 -4.37 119.74 120.69 1vig s LYS 27 Ca 0.00 -1.51 -0.01 0.00 -1.56 0.00 0.00 55.97 52.88 1vig s LYS 27 Cb 0.00 -4.67 0.01 0.00 -1.46 0.00 0.00 37.83 31.71 1vig s LYS 27 CO 0.00 -1.75 0.08 -1.13 0.16 0.00 0.00 175.35 172.71 1vig n SER 28 N 6.73 -3.40 -0.41 1.43 3.41 -1.25 -4.23 113.62 115.89 1vig n SER 28 Ca 0.13 0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.90 1vig n SER 28 Cb 0.47 -2.91 0.00 0.00 -0.26 0.00 0.00 64.21 61.52 1vig n SER 28 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vig n GLY 29 N -0.81 -3.03 1.31 5.00 0.00 0.14 -5.07 105.19 102.73 1vig n GLY 29 Ca -0.10 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.07 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 0.34 1.37 -0.24 4.61 0.00 -0.44 -4.88 120.51 121.27 1vig n ALA 30 Ca 0.00 0.00 0.25 0.00 0.00 0.00 0.00 53.44 53.69 1vig n ALA 30 Cb 0.00 0.00 0.62 0.00 0.00 0.00 0.00 19.45 20.07 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 -0.56 0.00 -0.73 -1.76 0.46 115.58 113.19 1vig h ASN 31 Ca 0.00 0.03 0.03 0.00 1.87 0.00 0.00 56.30 58.23 1vig h ASN 31 Cb 0.00 -0.01 -0.03 0.00 0.27 0.00 0.00 38.32 38.55 1vig h ASN 31 CO 0.00 0.07 0.37 0.16 -0.37 0.00 0.00 177.43 177.66 1vig h ILE 32 N 0.20 1.07 0.00 2.57 3.07 -1.86 0.23 117.51 122.78 1vig h ILE 32 Ca 0.48 -0.22 -0.19 0.00 1.55 0.00 0.00 64.86 66.48 1vig h ILE 32 Cb 1.55 0.37 -0.03 0.00 -0.27 0.00 0.00 36.82 38.44 1vig h ILE 32 CO -0.11 0.12 -0.91 -1.13 -1.05 0.00 0.00 178.15 175.07 1vig h ASN 33 N 0.64 0.00 0.41 2.16 -0.00 -0.43 -1.86 115.58 116.50 1vig h ASN 33 Ca 0.22 0.00 -0.02 0.00 -0.00 0.00 0.00 56.30 56.50 1vig h ASN 33 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.42 1vig h ASN 33 CO -0.06 0.89 -0.20 0.03 -0.00 0.00 0.00 177.43 178.09 1vig h ARG 34 N 0.00 -0.53 0.20 6.67 3.08 -0.41 -1.75 114.38 121.64 1vig h ARG 34 Ca -0.02 0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 1vig h ARG 34 Cb 1.69 0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.86 1vig h ARG 34 CO 0.11 -0.25 -0.10 0.82 -1.07 0.00 0.00 179.97 179.49 1vig h ILE 35 N -1.03 0.81 -0.47 2.04 1.08 -0.75 0.45 117.51 119.65 1vig h ILE 35 Ca -0.06 -0.07 0.07 0.00 -0.39 0.00 0.00 64.86 64.42 1vig h ILE 35 Cb 0.54 0.85 -0.09 0.00 -3.07 0.00 0.00 36.82 35.05 1vig h ILE 35 CO 0.09 0.02 -0.46 0.50 -0.69 0.00 0.00 178.15 177.60 1vig h LYS 36 N -0.31 -0.30 0.00 2.37 3.11 -1.43 0.88 116.57 120.90 1vig h LYS 36 Ca -0.03 0.02 -0.09 0.00 -2.81 0.00 0.00 60.65 57.74 1vig h LYS 36 Cb 0.24 0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 31.52 1vig h LYS 36 CO 0.05 -0.20 -0.42 0.22 -2.81 0.00 0.00 179.45 176.29 1vig h ASP 37 N -0.31 0.00 0.11 4.20 3.58 -1.21 0.70 116.42 123.49 1vig h ASP 37 Ca 0.14 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.58 1vig h ASP 37 Cb 0.58 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.63 1vig h ASP 37 CO -0.62 0.42 -0.05 -0.61 -2.88 0.00 0.00 179.24 175.50 1vig h GLN 38 N 0.00 -0.14 -0.43 0.28 5.75 0.23 -3.31 115.11 117.49 1vig h GLN 38 Ca -0.00 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1vig h GLN 38 Cb 0.79 0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.37 1vig h GLN 38 CO 0.05 -0.09 0.00 0.66 -2.65 0.00 0.00 178.83 176.80 1vig n TYR 39 N -2.77 0.49 -4.00 3.99 4.02 0.28 -4.89 117.16 114.27 1vig n TYR 39 Ca -0.02 -0.21 -0.31 0.00 -0.01 0.00 0.00 57.90 57.35 1vig n TYR 39 Cb 0.06 -0.07 0.00 0.00 -0.02 0.00 0.00 39.34 39.31 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 0.29 -4.46 -2.65 -0.72 4.81 0.21 -4.50 118.16 111.15 1vig n LYS 40 Ca 0.10 0.50 -0.10 0.00 -0.87 0.00 0.00 58.31 57.94 1vig n LYS 40 Cb 0.34 -5.23 -0.01 0.00 0.02 0.00 0.00 35.03 30.14 1vig n LYS 40 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1vig n VAL 41 N -4.52 0.00 -3.55 3.15 0.24 0.63 -4.41 118.33 109.87 1vig n VAL 41 Ca -0.01 -0.73 -0.28 0.00 -2.04 0.00 0.00 64.34 61.28 1vig n VAL 41 Cb 0.54 -0.01 -0.11 0.00 -1.47 0.00 0.00 33.84 32.80 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 2.62 -0.13 -1.34 0.15 0.17 -4.12 113.70 109.15 1vig s SER 42 Ca 0.03 -3.08 -0.23 0.00 0.70 0.00 0.00 55.95 53.37 1vig s SER 42 Cb -0.00 -0.77 -0.03 0.00 -1.71 0.00 0.00 66.02 63.51 1vig s SER 42 CO 0.02 -0.18 0.68 0.54 1.20 0.00 0.00 173.24 175.50 1vig s VAL 43 N -0.12 5.02 -0.07 4.45 0.11 -1.26 -2.36 120.40 126.17 1vig s VAL 43 Ca 0.27 1.36 0.05 0.00 -2.93 0.00 0.00 61.98 60.73 1vig s VAL 43 Cb -0.05 -4.01 -0.00 0.00 -1.53 0.00 0.00 36.38 30.79 1vig s VAL 43 CO -0.14 0.18 -0.23 -0.13 -3.33 0.00 0.00 175.10 171.44 1vig s ARG 44 N 1.33 2.66 -0.65 1.54 0.52 0.64 -4.73 118.95 120.26 1vig s ARG 44 Ca 0.34 -0.85 -0.10 0.00 -0.52 0.00 0.00 55.73 54.61 1vig s ARG 44 Cb -0.17 -2.13 0.17 0.00 0.52 0.00 0.00 34.95 33.34 1vig s ARG 44 CO 0.14 0.27 0.54 0.42 0.02 0.00 0.00 175.30 176.69 1vig s ILE 45 N 0.11 4.67 -0.37 1.52 -1.09 -1.26 -1.99 121.20 122.79 1vig s ILE 45 Ca -0.11 -2.35 -0.29 0.00 -2.23 0.00 0.00 60.65 55.68 1vig s ILE 45 Cb -0.15 -3.98 -0.00 0.00 -1.58 0.00 0.00 42.46 36.74 1vig s ILE 45 CO 0.06 -0.91 1.52 -2.16 -1.23 0.00 0.00 174.94 172.22 1vig s PRO 46 N 0.54 3.56 0.27 2.79 0.04 -1.26 -4.89 135.00 136.05 1vig s PRO 46 Ca 0.13 1.14 0.12 0.00 0.04 0.00 0.00 61.00 62.43 1vig s PRO 46 Cb -0.19 -4.06 0.34 0.00 0.04 0.00 0.00 34.50 30.63 1vig s PRO 46 CO -0.04 -1.59 1.59 -1.00 0.04 0.00 0.00 177.00 176.00 1vig h PRO 47 N 11.15 0.00 -5.16 0.56 0.13 -1.99 -3.38 132.00 133.31 1vig h PRO 47 Ca -0.30 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.23 1vig h PRO 47 Cb 1.12 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.21 1vig h PRO 47 CO 1.06 0.62 2.18 -0.40 -0.23 0.00 0.00 178.00 181.23 1vig n ASP 48 N -3.69 3.95 -3.15 1.44 5.68 -1.26 -4.67 116.55 114.85 1vig n ASP 48 Ca -0.01 -2.82 0.06 0.00 -0.50 0.00 0.00 54.79 51.52 1vig n ASP 48 Cb 0.64 -1.64 -0.01 0.00 -1.14 0.00 0.00 41.12 38.97 1vig n ASP 48 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1vig s SER 49 N 4.60 -0.14 -0.16 -1.12 0.01 -1.26 -5.07 113.70 110.56 1vig s SER 49 Ca 0.56 0.05 -0.18 0.00 1.31 0.00 0.00 55.95 57.69 1vig s SER 49 Cb 0.07 1.10 -0.15 0.00 0.21 0.00 0.00 66.02 67.25 1vig s SER 49 CO 0.06 -0.03 0.27 -0.33 0.41 0.00 0.00 173.24 173.63 1vig h GLU 50 N 7.49 0.00 -5.66 12.44 3.07 -1.95 -3.43 114.58 126.53 1vig h GLU 50 Ca -0.11 0.00 -0.62 0.00 -0.50 0.00 0.00 59.36 58.14 1vig h GLU 50 Cb 1.17 0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 29.00 1vig h GLU 50 CO -0.18 0.66 -0.34 0.21 -1.40 0.00 0.00 179.01 177.96 1vig s LYS 51 N -2.17 3.95 -0.45 2.33 2.47 -1.26 -4.61 119.74 119.99 1vig s LYS 51 Ca -0.19 0.11 -0.20 0.00 -1.56 0.00 0.00 55.97 54.13 1vig s LYS 51 Cb 0.02 -3.31 0.03 0.00 -1.46 0.00 0.00 37.83 33.10 1vig s LYS 51 CO 0.46 0.50 0.62 0.45 0.16 0.00 0.00 175.35 177.54 1vig n SER 52 N 2.68 -7.45 -4.44 1.43 2.88 -1.26 -4.88 113.62 102.58 1vig n SER 52 Ca -0.15 0.37 -0.44 0.00 -1.33 0.00 0.00 58.87 57.32 1vig n SER 52 Cb 0.53 -4.64 -0.01 0.00 -0.75 0.00 0.00 64.21 59.34 1vig n SER 52 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1vig s ASN 53 N -2.41 6.96 -0.81 -3.46 3.84 -0.24 -4.93 114.94 113.89 1vig s ASN 53 Ca 0.26 -2.77 -0.22 0.00 0.21 0.00 0.00 52.86 50.34 1vig s ASN 53 Cb -0.06 -2.37 0.08 0.00 -0.55 0.00 0.00 41.25 38.34 1vig s ASN 53 CO 0.79 -0.78 1.14 -0.76 -2.79 0.00 0.00 177.10 174.70 1vig s LEU 54 N 1.56 4.26 0.49 3.21 1.02 -1.26 -1.15 118.68 126.80 1vig s LEU 54 Ca 0.38 -1.30 -0.22 0.00 0.02 0.00 0.00 54.13 53.00 1vig s LEU 54 Cb -0.04 -2.46 -0.08 0.00 0.02 0.00 0.00 46.19 43.63 1vig s LEU 54 CO -0.04 -1.40 1.10 -0.38 0.02 0.00 0.00 176.35 175.65 1vig n ILE 55 N 6.03 3.00 -3.39 -0.59 5.41 -0.71 -4.64 119.36 124.47 1vig n ILE 55 Ca 0.12 -0.50 -0.37 0.00 1.00 0.00 0.00 62.75 62.99 1vig n ILE 55 Cb 0.48 -1.32 -0.06 0.00 -0.71 0.00 0.00 39.64 38.03 1vig n ILE 55 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1vig s ARG 56 N -2.38 4.29 -0.10 0.38 3.00 -0.84 -2.20 118.95 121.10 1vig s ARG 56 Ca 0.67 0.34 -0.02 0.00 0.00 0.00 0.00 55.73 56.72 1vig s ARG 56 Cb -0.49 -3.42 0.04 0.00 0.00 0.00 0.00 34.95 31.08 1vig s ARG 56 CO 0.53 0.21 0.03 0.42 0.00 0.00 0.00 175.30 176.49 1vig s ILE 57 N 0.49 0.26 -0.03 1.52 -1.09 0.64 -0.26 121.20 122.72 1vig s ILE 57 Ca 0.23 0.02 0.00 0.00 -2.23 0.00 0.00 60.65 58.67 1vig s ILE 57 Cb -0.15 -0.56 0.03 0.00 -1.58 0.00 0.00 42.46 40.20 1vig s ILE 57 CO 0.08 0.09 0.01 -0.70 -1.23 0.00 0.00 174.94 173.20 1vig s GLU 58 N 2.01 0.24 0.00 2.79 -6.30 -0.99 0.23 118.70 116.67 1vig s GLU 58 Ca 0.04 0.12 0.00 0.00 -2.50 0.00 0.00 54.97 52.62 1vig s GLU 58 Cb -0.14 -0.47 0.00 0.00 0.00 0.00 0.00 34.13 33.52 1vig s GLU 58 CO -0.06 -0.16 0.00 0.41 0.02 0.00 0.00 175.26 175.47 1vig n GLY 59 N 4.28 3.89 0.00 -1.50 0.00 -0.18 0.46 105.19 112.14 1vig n GLY 59 Ca -0.24 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1vig n GLY 59 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1vig n ASP 60 N 0.00 0.00 -0.05 1.61 2.03 -1.26 -2.28 116.55 116.60 1vig n ASP 60 Ca 0.00 -0.14 -0.13 0.00 0.52 0.00 0.00 54.79 55.04 1vig n ASP 60 Cb 0.00 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.28 1vig n ASP 60 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1vig h PRO 61 N 0.00 -0.01 0.00 -0.67 0.13 -1.92 -3.24 132.00 126.29 1vig h PRO 61 Ca 0.00 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.85 1vig h PRO 61 Cb 0.00 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.08 1vig h PRO 61 CO 0.00 0.81 -1.98 1.04 -0.23 0.00 0.00 178.00 177.65 1vig n GLN 62 N -4.69 0.66 -0.07 0.86 6.02 -1.26 -3.75 117.38 115.15 1vig n GLN 62 Ca -0.09 0.11 -0.12 0.00 -0.01 0.00 0.00 57.00 56.89 1vig n GLN 62 Cb 0.40 -1.65 -0.05 0.00 1.02 0.00 0.00 30.24 29.96 1vig n GLN 62 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1vig h GLY 63 N 3.80 0.44 1.21 1.08 0.00 -1.82 -1.49 103.07 106.30 1vig h GLY 63 Ca -0.35 -0.36 -0.22 0.00 0.00 0.00 0.00 47.33 46.39 1vig h GLY 63 CO 0.04 0.33 -0.79 -0.24 0.00 0.00 0.00 176.54 175.88 1vig h VAL 64 N 0.15 1.28 -0.08 4.60 3.04 -1.76 -2.46 116.25 121.01 1vig h VAL 64 Ca 0.06 -2.00 -0.11 0.00 -1.01 0.00 0.00 66.70 63.64 1vig h VAL 64 Cb 0.48 2.01 -0.01 0.00 -2.01 0.00 0.00 31.29 31.76 1vig h VAL 64 CO 0.02 0.63 -0.43 0.06 -1.01 0.00 0.00 177.57 176.84 1vig h GLN 65 N 0.52 0.18 -0.03 4.17 -0.00 -1.65 0.27 115.11 118.58 1vig h GLN 65 Ca -0.06 -0.09 -0.02 0.00 -0.00 0.00 0.00 58.65 58.48 1vig h GLN 65 Cb 1.42 -0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.90 1vig h GLN 65 CO 0.16 0.59 -0.07 0.37 -0.00 0.00 0.00 178.83 179.88 1vig h GLN 66 N 0.15 0.10 0.00 0.06 5.75 -1.27 -2.61 115.11 117.29 1vig h GLN 66 Ca 0.01 -0.07 -0.06 0.00 -0.15 0.00 0.00 58.65 58.39 1vig h GLN 66 Cb 0.83 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.38 1vig h GLN 66 CO 0.06 0.66 -0.27 0.00 -2.65 0.00 0.00 178.83 176.63 1vig h ALA 67 N 0.43 1.21 0.65 3.38 0.00 -1.41 -0.83 119.26 122.70 1vig h ALA 67 Ca -0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 1vig h ALA 67 Cb 0.67 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.42 1vig h ALA 67 CO 0.02 0.34 -0.31 -0.22 0.00 0.00 0.00 179.25 179.08 1vig h LYS 68 N 0.00 -0.84 -0.44 0.00 3.64 -0.89 -2.22 116.57 115.81 1vig h LYS 68 Ca -0.00 0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.36 1vig h LYS 68 Cb 0.62 0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.61 1vig h LYS 68 CO 0.04 -0.53 -0.02 -0.09 -2.27 0.00 0.00 179.45 176.58 1vig h ARG 69 N -1.16 0.74 -0.92 1.90 2.43 -1.45 -1.66 114.38 114.26 1vig h ARG 69 Ca -0.09 -0.20 0.07 0.00 -0.81 0.00 0.00 59.98 58.95 1vig h ARG 69 Cb 0.70 -0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 30.10 1vig h ARG 69 CO 0.15 0.76 0.58 1.49 -1.51 0.00 0.00 179.97 181.43 1vig h GLU 70 N 0.69 1.01 0.01 0.20 4.57 -1.16 -0.65 114.58 119.25 1vig h GLU 70 Ca 0.13 -0.06 -0.10 0.00 -1.18 0.00 0.00 59.36 58.15 1vig h GLU 70 Cb 0.45 -0.23 0.01 0.00 -0.16 0.00 0.00 28.75 28.82 1vig h GLU 70 CO 0.02 0.67 -0.40 -0.07 -1.18 0.00 0.00 179.01 178.05 1vig h LEU 71 N 1.04 0.34 -2.31 1.64 3.38 -1.11 0.75 115.31 119.04 1vig h LEU 71 Ca 0.40 -0.79 0.04 0.00 0.09 0.00 0.00 57.88 57.62 1vig h LEU 71 Cb 0.19 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1vig h LEU 71 CO -0.18 1.08 0.16 0.25 0.09 0.00 0.00 178.44 179.84 1vig h LEU 72 N -0.37 0.00 0.00 1.67 6.46 -1.02 0.42 115.31 122.48 1vig h LEU 72 Ca -0.05 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.71 1vig h LEU 72 Cb 1.15 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.08 1vig h LEU 72 CO 0.08 0.00 0.00 -0.62 -0.62 0.00 0.00 178.44 177.28 1vig n GLU 73 N -3.72 0.00 -0.12 1.25 1.02 -0.27 -4.75 120.64 114.05 1vig n GLU 73 Ca 0.00 0.01 -0.13 0.00 -0.02 0.00 0.00 57.16 57.02 1vig n GLU 73 Cb 0.27 -0.26 -0.02 0.00 -0.02 0.00 0.00 31.44 31.41 1vig n GLU 73 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1vig h LEU 74 N 0.00 0.98 1.12 -4.62 3.38 -0.97 -3.47 115.31 111.73 1vig h LEU 74 Ca 0.00 -0.46 -0.35 0.00 0.09 0.00 0.00 57.88 57.16 1vig h LEU 74 Cb 0.00 -0.28 0.04 0.00 0.09 0.00 0.00 40.66 40.52 1vig h LEU 74 CO 0.00 1.24 -0.51 0.00 0.09 0.00 0.00 178.44 179.26 1vig n ALA 75 N -2.54 -0.78 0.55 1.53 0.00 0.15 -4.97 120.51 114.44 1vig n ALA 75 Ca -0.02 0.23 0.07 0.00 0.00 0.00 0.00 53.44 53.72 1vig n ALA 75 Cb 0.53 -3.18 0.05 0.00 0.00 0.00 0.00 19.45 16.86 1vig n ALA 75 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37