#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vig s ASN 7 N 0.00 2.73 -0.44 7.28 -0.87 -1.26 -4.96 114.94 117.42 1vig s ASN 7 Ca 0.00 -3.07 0.05 0.00 -1.57 0.00 0.00 52.86 48.27 1vig s ASN 7 Cb 0.00 -0.80 0.43 0.00 -0.02 0.00 0.00 41.25 40.86 1vig s ASN 7 CO 0.00 -0.18 1.29 0.54 -2.57 0.00 0.00 177.10 176.17 1vig n ARG 8 N 2.91 3.38 -1.83 -0.60 3.00 -1.26 -5.04 116.66 117.22 1vig n ARG 8 Ca 0.22 -4.22 0.00 0.00 -0.01 0.00 0.00 57.85 53.84 1vig n ARG 8 Cb 0.42 -2.27 0.00 0.00 0.00 0.00 0.00 32.46 30.61 1vig n ARG 8 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.63 176.30 1vig n MET 9 N -0.60 -4.96 -4.02 5.56 2.81 -1.26 -4.97 117.12 109.68 1vig n MET 9 Ca 0.44 3.57 -0.33 0.00 -1.81 0.00 0.00 57.70 59.56 1vig n MET 9 Cb 0.73 -3.84 -0.15 0.00 -0.71 0.00 0.00 33.22 29.25 1vig n MET 9 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1vig s ASP 10 N -1.08 4.52 0.26 7.83 1.01 -1.01 -4.98 116.67 123.23 1vig s ASP 10 Ca 0.00 -1.32 0.10 0.00 0.71 0.00 0.00 52.55 52.04 1vig s ASP 10 Cb 0.00 -1.60 -0.04 0.00 1.01 0.00 0.00 42.92 42.29 1vig s ASP 10 CO 0.00 -0.20 -0.04 -0.72 0.21 0.00 0.00 175.17 174.42 1vig s TYR 11 N 1.16 2.64 0.09 4.23 1.13 -1.26 -0.19 117.35 125.14 1vig s TYR 11 Ca -0.07 -0.24 -0.20 0.00 -1.41 0.00 0.00 57.07 55.15 1vig s TYR 11 Cb -0.20 -1.17 0.05 0.00 -1.10 0.00 0.00 41.96 39.54 1vig s TYR 11 CO -0.04 0.63 0.48 0.54 -2.51 0.00 0.00 175.55 174.65 1vig s VAL 12 N -2.33 0.04 -0.22 -3.49 0.11 0.15 -4.96 120.40 109.71 1vig s VAL 12 Ca 0.31 -0.35 0.01 0.00 -2.93 0.00 0.00 61.98 59.02 1vig s VAL 12 Cb -0.06 -1.04 0.05 0.00 -1.53 0.00 0.00 36.38 33.80 1vig s VAL 12 CO 0.19 -0.19 -0.08 -1.61 -3.33 0.00 0.00 175.10 170.07 1vig s GLU 13 N -3.07 1.88 -0.21 1.54 2.02 -1.26 -1.86 118.70 117.74 1vig s GLU 13 Ca -0.02 -0.93 -0.15 0.00 0.02 0.00 0.00 54.97 53.90 1vig s GLU 13 Cb 0.00 -2.50 -0.04 0.00 0.10 0.00 0.00 34.13 31.69 1vig s GLU 13 CO -0.07 -0.50 0.35 0.96 0.02 0.00 0.00 175.26 176.02 1vig s ILE 14 N 1.38 5.23 -0.04 -1.63 -4.36 -0.98 -4.98 121.20 115.81 1vig s ILE 14 Ca -0.03 0.59 -0.30 0.00 -0.26 0.00 0.00 60.65 60.65 1vig s ILE 14 Cb -0.17 -3.68 -0.03 0.00 1.25 0.00 0.00 42.46 39.83 1vig s ILE 14 CO -0.07 0.27 1.07 0.21 0.24 0.00 0.00 174.94 176.66 1vig s ASN 15 N 1.07 7.21 0.08 4.36 3.04 -1.26 -1.76 114.94 127.68 1vig s ASN 15 Ca 0.16 1.70 0.08 0.00 0.04 0.00 0.00 52.86 54.85 1vig s ASN 15 Cb -0.14 -2.56 -0.03 0.00 -1.54 0.00 0.00 41.25 36.97 1vig s ASN 15 CO 0.07 -0.43 -0.22 -0.63 -3.04 0.00 0.00 177.10 172.85 1vig s ILE 16 N 1.65 1.80 0.00 -5.21 -1.09 -0.96 -4.95 121.20 112.44 1vig s ILE 16 Ca 0.53 -1.45 0.00 0.00 -2.23 0.00 0.00 60.65 57.50 1vig s ILE 16 Cb -0.22 -1.60 0.00 0.00 -1.58 0.00 0.00 42.46 39.06 1vig s ILE 16 CO 0.23 0.08 0.00 0.47 -1.23 0.00 0.00 174.94 174.49 1vig n ASP 17 N 1.37 0.00 -4.13 3.58 8.00 -1.26 0.34 116.55 124.45 1vig n ASP 17 Ca -0.18 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.01 1vig n ASP 17 Cb 0.53 0.00 0.17 0.00 -0.02 0.00 0.00 41.12 41.80 1vig n ASP 17 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1vig n HIS 18 N -1.02 -1.61 -1.46 1.24 8.25 -1.26 -4.44 115.22 114.91 1vig n HIS 18 Ca 0.00 0.12 -0.41 0.00 -0.26 0.00 0.00 57.72 57.17 1vig n HIS 18 Cb 0.00 -1.51 -0.04 0.00 1.12 0.00 0.00 29.99 29.55 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 -1.89 1.88 0.08 -0.41 5.02 -1.26 -4.61 118.16 116.97 1vig n LYS 19 Ca 0.01 -2.16 -0.11 0.00 -2.02 0.00 0.00 58.31 54.04 1vig n LYS 19 Cb 0.59 -3.13 -0.04 0.00 -0.02 0.00 0.00 35.03 32.43 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 7.73 0.40 0.01 2.13 -1.00 -1.98 -3.27 116.94 120.96 1vig h PHE 20 Ca 0.43 -0.23 -0.00 0.00 2.81 0.00 0.00 57.97 60.98 1vig h PHE 20 Cb 0.71 -0.04 -0.00 0.00 3.61 0.00 0.00 35.95 40.23 1vig h PHE 20 CO 1.29 1.06 -0.01 0.45 -1.61 0.00 0.00 178.31 179.50 1vig h HIS 21 N 0.14 -0.02 -0.96 -0.55 3.86 -1.97 0.99 115.15 116.64 1vig h HIS 21 Ca -0.06 -0.00 0.28 0.00 -1.16 0.00 0.00 60.37 59.43 1vig h HIS 21 Cb 1.58 0.01 -0.04 0.00 1.06 0.00 0.00 27.41 30.02 1vig h HIS 21 CO 0.04 -0.01 0.87 0.07 0.86 0.00 0.00 177.93 179.76 1vig h ARG 22 N -0.02 0.00 0.18 2.45 -0.00 -1.91 0.62 114.38 115.70 1vig h ARG 22 Ca -0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 59.98 59.67 1vig h ARG 22 Cb 0.01 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.00 1vig h ARG 22 CO 0.00 0.00 -1.48 0.45 -0.00 0.00 0.00 179.97 178.94 1vig h HIS 23 N 0.00 0.68 0.33 4.08 3.86 -1.51 -2.93 115.15 119.66 1vig h HIS 23 Ca 0.46 -0.50 -0.02 0.00 -1.16 0.00 0.00 60.37 59.15 1vig h HIS 23 Cb 2.18 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 30.63 1vig h HIS 23 CO 0.00 1.58 -0.16 -0.07 0.86 0.00 0.00 177.93 180.14 1vig h LEU 24 N -0.06 -0.38 -2.44 2.43 3.38 0.57 -3.25 115.31 115.56 1vig h LEU 24 Ca -0.29 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1vig h LEU 24 Cb 1.96 0.10 -0.00 0.00 0.09 0.00 0.00 40.66 42.81 1vig h LEU 24 CO 0.16 0.08 0.01 0.16 0.09 0.00 0.00 178.44 178.94 1vig h ILE 25 N -1.11 0.54 0.00 1.22 3.07 -0.24 -3.43 117.51 117.57 1vig h ILE 25 Ca -0.05 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.36 1vig h ILE 25 Cb 0.37 0.99 0.00 0.00 -0.27 0.00 0.00 36.82 37.91 1vig h ILE 25 CO 0.07 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.78 1vig n GLY 26 N -1.34 2.25 0.01 0.16 0.00 -1.11 -3.20 105.19 101.97 1vig n GLY 26 Ca -0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 46.02 45.89 1vig n GLY 26 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1vig n LYS 27 N 0.00 0.08 -1.91 1.61 4.01 -1.26 -4.71 118.16 115.97 1vig n LYS 27 Ca 0.00 0.11 -0.02 0.00 -0.51 0.00 0.00 58.31 57.89 1vig n LYS 27 Cb 0.00 -0.72 0.03 0.00 -0.51 0.00 0.00 35.03 33.83 1vig n LYS 27 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 1vig n SER 28 N -2.75 -0.31 0.00 4.39 7.64 -1.26 -5.02 113.62 116.31 1vig n SER 28 Ca -0.02 -2.07 0.00 0.00 1.01 0.00 0.00 58.87 57.79 1vig n SER 28 Cb 0.07 0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 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 -0.47 0.20 5.00 0.23 0.00 -1.19 -5.03 105.19 103.92 1vig n GLY 29 Ca -0.12 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.37 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 -1.00 0.00 -0.17 4.61 0.00 -1.26 -4.44 120.51 118.24 1vig n ALA 30 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1vig n ALA 30 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 1vig n ALA 30 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1vig h ASN 31 N 0.00 -0.86 -1.11 0.00 4.21 -1.83 0.37 115.58 116.36 1vig h ASN 31 Ca 0.00 0.19 0.31 0.00 1.21 0.00 0.00 56.30 58.01 1vig h ASN 31 Cb 0.00 0.46 -0.08 0.00 -1.12 0.00 0.00 38.32 37.58 1vig h ASN 31 CO 0.00 -0.26 0.75 0.16 -1.29 0.00 0.00 177.43 176.78 1vig h ILE 32 N -0.12 0.45 -0.20 2.81 3.07 -1.88 0.69 117.51 122.33 1vig h ILE 32 Ca 0.24 -0.07 -0.17 0.00 1.55 0.00 0.00 64.86 66.40 1vig h ILE 32 Cb 0.50 0.22 -0.00 0.00 -0.27 0.00 0.00 36.82 37.26 1vig h ILE 32 CO -0.60 0.04 -0.58 -1.13 -1.05 0.00 0.00 178.15 174.82 1vig h ASN 33 N 0.22 0.73 -0.68 2.16 -1.24 -0.58 -2.58 115.58 113.61 1vig h ASN 33 Ca 0.59 -0.41 0.05 0.00 0.71 0.00 0.00 56.30 57.25 1vig h ASN 33 Cb 1.86 -0.21 -0.05 0.00 0.73 0.00 0.00 38.32 40.65 1vig h ASN 33 CO -0.19 1.15 0.40 -0.09 -1.29 0.00 0.00 177.43 177.41 1vig h ARG 34 N 0.49 0.73 0.30 6.67 2.43 1.00 -1.80 114.38 124.19 1vig h ARG 34 Ca 0.00 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1vig h ARG 34 Cb 1.15 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 1vig h ARG 34 CO 0.11 0.48 -0.14 0.82 -1.51 0.00 0.00 179.97 179.73 1vig h ILE 35 N 0.75 0.72 -1.30 1.20 5.03 -1.40 0.13 117.51 122.64 1vig h ILE 35 Ca 0.29 -0.51 0.38 0.00 -0.12 0.00 0.00 64.86 64.91 1vig h ILE 35 Cb 0.13 0.99 -0.08 0.00 -3.03 0.00 0.00 36.82 34.83 1vig h ILE 35 CO -0.16 0.10 0.90 0.50 -0.68 0.00 0.00 178.15 178.82 1vig h LYS 36 N -0.69 0.09 0.00 2.37 3.64 -1.17 1.47 116.57 122.29 1vig h LYS 36 Ca -0.04 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.25 1vig h LYS 36 Cb 0.48 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 1vig h LYS 36 CO 0.07 0.06 -1.17 0.22 -2.27 0.00 0.00 179.45 176.36 1vig h ASP 37 N 0.10 0.00 0.00 4.20 1.82 -1.07 -2.22 116.42 119.24 1vig h ASP 37 Ca 0.67 0.00 -0.10 0.00 -0.39 0.00 0.00 57.03 57.22 1vig h ASP 37 Cb 2.39 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 42.39 1vig h ASP 37 CO -0.14 0.28 -0.65 -0.61 -1.61 0.00 0.00 179.24 176.52 1vig h GLN 38 N 0.00 0.00 -0.66 0.28 5.75 0.36 -3.39 115.11 117.46 1vig h GLN 38 Ca -0.08 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.42 1vig h GLN 38 Cb 1.28 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.83 1vig h GLN 38 CO 0.02 0.62 0.00 0.66 -2.65 0.00 0.00 178.83 177.48 1vig n TYR 39 N -4.56 1.12 -3.96 3.99 4.02 0.33 -4.96 117.16 113.14 1vig n TYR 39 Ca -0.17 -0.55 -0.27 0.00 -0.01 0.00 0.00 57.90 56.90 1vig n TYR 39 Cb 0.45 -0.10 -0.01 0.00 -0.02 0.00 0.00 39.34 39.65 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 1.29 -3.74 -3.33 -0.72 3.00 -0.85 -4.49 118.16 109.31 1vig n LYS 40 Ca 0.24 0.45 -0.16 0.00 -0.00 0.00 0.00 58.31 58.84 1vig n LYS 40 Cb 0.71 -4.82 -0.04 0.00 0.00 0.00 0.00 35.03 30.89 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 -4.41 0.00 -3.81 3.15 0.24 -1.12 -4.71 118.33 107.67 1vig n VAL 41 Ca -0.21 -1.23 -0.29 0.00 -2.04 0.00 0.00 64.34 60.57 1vig n VAL 41 Cb 0.63 0.32 -0.12 0.00 -1.47 0.00 0.00 33.84 33.20 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 -2.39 4.03 -0.08 -1.34 0.15 0.17 -3.98 113.70 110.26 1vig s SER 42 Ca 0.04 -3.32 -0.28 0.00 0.70 0.00 0.00 55.95 53.09 1vig s SER 42 Cb 0.00 -1.36 -0.02 0.00 -1.71 0.00 0.00 66.02 62.93 1vig s SER 42 CO 0.03 -0.16 0.92 -0.69 1.20 0.00 0.00 173.24 174.53 1vig s VAL 43 N -0.64 4.86 -0.16 4.45 1.01 -1.26 -2.15 120.40 126.52 1vig s VAL 43 Ca 0.23 1.88 -0.00 0.00 0.00 0.00 0.00 61.98 64.09 1vig s VAL 43 Cb -0.12 -4.24 0.04 0.00 0.00 0.00 0.00 36.38 32.05 1vig s VAL 43 CO -0.10 0.09 -0.08 -0.13 0.00 0.00 0.00 175.10 174.88 1vig s ARG 44 N 1.60 1.66 -0.49 2.72 1.81 0.65 -4.76 118.95 122.15 1vig s ARG 44 Ca 0.46 -0.53 -0.16 0.00 -1.72 0.00 0.00 55.73 53.77 1vig s ARG 44 Cb -0.19 -2.02 0.08 0.00 -0.45 0.00 0.00 34.95 32.38 1vig s ARG 44 CO 0.19 -0.38 0.45 0.42 -0.68 0.00 0.00 175.30 175.30 1vig s ILE 45 N 1.59 5.17 -0.37 1.52 -1.09 -1.26 -1.30 121.20 125.45 1vig s ILE 45 Ca 0.02 -1.04 -0.29 0.00 -2.23 0.00 0.00 60.65 57.11 1vig s ILE 45 Cb -0.15 -4.19 0.02 0.00 -1.58 0.00 0.00 42.46 36.56 1vig s ILE 45 CO -0.08 -0.66 1.20 -2.16 -1.23 0.00 0.00 174.94 172.01 1vig s PRO 46 N 1.80 3.85 0.83 2.79 0.04 -1.26 -5.03 135.00 138.02 1vig s PRO 46 Ca 0.06 0.95 -0.14 0.00 0.04 0.00 0.00 61.00 61.90 1vig s PRO 46 Cb -0.24 -3.87 0.20 0.00 0.04 0.00 0.00 34.50 30.63 1vig s PRO 46 CO 0.07 -1.20 0.89 -0.35 0.04 0.00 0.00 177.00 176.44 1vig n PRO 47 N 7.46 -1.91 -2.66 0.56 -0.04 -1.26 -4.81 135.00 132.35 1vig n PRO 47 Ca 0.13 -1.39 -0.05 0.00 -0.04 0.00 0.00 63.50 62.15 1vig n PRO 47 Cb 0.48 -1.13 -0.04 0.00 -0.04 0.00 0.00 33.50 32.76 1vig n PRO 47 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1vig n ASP 48 N -4.07 -1.63 -4.20 3.54 5.68 -1.26 -5.06 116.55 109.55 1vig n ASP 48 Ca 0.12 1.33 -0.12 0.00 -0.50 0.00 0.00 54.79 55.62 1vig n ASP 48 Cb 0.43 -4.99 -0.10 0.00 -1.14 0.00 0.00 41.12 35.32 1vig n ASP 48 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1vig s SER 49 N -0.72 1.34 0.00 -1.12 1.04 -1.26 -5.10 113.70 107.88 1vig s SER 49 Ca -0.24 -1.03 0.00 0.00 0.48 0.00 0.00 55.95 55.16 1vig s SER 49 Cb 0.02 0.07 0.00 0.00 0.10 0.00 0.00 66.02 66.20 1vig s SER 49 CO 0.74 -0.44 0.00 -0.62 0.98 0.00 0.00 173.24 173.90 1vig n GLU 50 N -0.11 0.00 -0.01 4.02 1.02 -1.26 -5.00 120.64 119.29 1vig n GLU 50 Ca -0.11 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.02 1vig n GLU 50 Cb 0.61 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 32.02 1vig n GLU 50 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1vig n LYS 51 N -0.97 1.11 -5.07 3.49 4.76 -1.26 -5.03 118.16 115.19 1vig n LYS 51 Ca 0.00 0.01 -0.32 0.00 -2.87 0.00 0.00 58.31 55.13 1vig n LYS 51 Cb 0.00 -1.05 -0.15 0.00 -1.84 0.00 0.00 35.03 31.99 1vig n LYS 51 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1vig s SER 52 N -3.95 3.51 0.49 4.39 1.04 -1.26 -4.87 113.70 113.05 1vig s SER 52 Ca -0.03 -0.39 0.07 0.00 0.48 0.00 0.00 55.95 56.08 1vig s SER 52 Cb 0.01 -0.99 0.02 0.00 0.10 0.00 0.00 66.02 65.15 1vig s SER 52 CO 0.06 0.26 0.44 0.20 0.98 0.00 0.00 173.24 175.18 1vig s ASN 53 N -0.22 4.88 -0.30 7.02 -0.87 0.15 -4.97 114.94 120.64 1vig s ASN 53 Ca -0.01 -0.96 -0.04 0.00 -1.57 0.00 0.00 52.86 50.28 1vig s ASN 53 Cb -0.13 -0.07 0.19 0.00 -0.02 0.00 0.00 41.25 41.22 1vig s ASN 53 CO 0.03 -0.92 0.84 -0.76 -2.57 0.00 0.00 177.10 173.72 1vig s LEU 54 N -4.25 -0.97 0.20 0.60 1.02 -1.26 -2.27 118.68 111.75 1vig s LEU 54 Ca 0.44 0.20 -0.29 0.00 0.02 0.00 0.00 54.13 54.50 1vig s LEU 54 Cb -0.03 1.65 -0.08 0.00 0.02 0.00 0.00 46.19 47.75 1vig s LEU 54 CO 0.27 -0.18 0.91 -0.63 0.02 0.00 0.00 176.35 176.74 1vig s ILE 55 N 2.90 4.22 -0.31 -0.59 1.01 -0.72 -4.63 121.20 123.08 1vig s ILE 55 Ca 0.17 2.00 -0.14 0.00 0.00 0.00 0.00 60.65 62.68 1vig s ILE 55 Cb -0.07 -4.29 -0.03 0.00 0.01 0.00 0.00 42.46 38.08 1vig s ILE 55 CO -0.23 0.47 0.31 -0.13 0.00 0.00 0.00 174.94 175.36 1vig s ARG 56 N -0.94 3.75 -0.03 2.79 3.00 -0.42 -2.32 118.95 124.78 1vig s ARG 56 Ca 0.41 -0.32 0.07 0.00 0.00 0.00 0.00 55.73 55.89 1vig s ARG 56 Cb -0.25 -3.74 -0.02 0.00 0.00 0.00 0.00 34.95 30.95 1vig s ARG 56 CO 0.30 -0.38 -0.24 0.42 0.00 0.00 0.00 175.30 175.40 1vig s ILE 57 N 1.94 1.91 -0.28 1.52 -1.09 -0.78 -0.25 121.20 124.17 1vig s ILE 57 Ca 0.11 -1.02 -0.22 0.00 -2.23 0.00 0.00 60.65 57.29 1vig s ILE 57 Cb -0.16 -1.59 0.09 0.00 -1.58 0.00 0.00 42.46 39.21 1vig s ILE 57 CO 0.11 0.54 0.78 -0.70 -1.23 0.00 0.00 174.94 174.44 1vig s GLU 58 N -0.42 0.72 0.00 2.79 2.12 -0.91 0.29 118.70 123.28 1vig s GLU 58 Ca 0.05 0.97 0.00 0.00 0.36 0.00 0.00 54.97 56.35 1vig s GLU 58 Cb -0.11 0.29 0.00 0.00 0.26 0.00 0.00 34.13 34.57 1vig s GLU 58 CO 0.00 -0.10 0.00 0.41 -0.54 0.00 0.00 175.26 175.03 1vig n GLY 59 N 3.11 2.65 1.28 -1.50 0.00 0.74 0.44 105.19 111.91 1vig n GLY 59 Ca -0.16 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.14 -2.58 1.61 8.00 -1.26 -2.39 116.55 118.79 1vig n ASP 60 Ca 0.00 0.32 -0.05 0.00 0.71 0.00 0.00 54.79 55.77 1vig n ASP 60 Cb 0.00 1.31 0.04 0.00 -0.02 0.00 0.00 41.12 42.45 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 -2.61 -1.05 0.32 -0.24 -0.04 -1.26 -4.65 135.00 125.47 1vig n PRO 61 Ca 0.00 -0.31 0.19 0.00 -0.04 0.00 0.00 63.50 63.33 1vig n PRO 61 Cb 0.00 -0.27 1.00 0.00 -0.04 0.00 0.00 33.50 34.19 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 -0.62 0.54 4.20 -2.00 -2.40 115.11 114.83 1vig h GLN 62 Ca -0.07 0.00 0.08 0.00 0.06 0.00 0.00 58.65 58.72 1vig h GLN 62 Cb 0.21 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.92 1vig h GLN 62 CO 0.05 0.00 0.27 0.78 -0.67 0.00 0.00 178.83 179.26 1vig h GLY 63 N 0.00 0.88 0.99 3.46 0.00 -1.89 0.51 103.07 107.03 1vig h GLY 63 Ca 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 1vig h GLY 63 CO 0.00 0.03 0.34 -0.24 0.00 0.00 0.00 176.54 176.67 1vig h VAL 64 N 0.48 1.19 -0.01 4.60 3.04 -1.65 0.29 116.25 124.19 1vig h VAL 64 Ca 0.30 -0.48 -0.17 0.00 -1.01 0.00 0.00 66.70 65.34 1vig h VAL 64 Cb 0.32 0.40 -0.01 0.00 -2.01 0.00 0.00 31.29 29.99 1vig h VAL 64 CO -0.27 0.21 -0.77 0.06 -1.01 0.00 0.00 177.57 175.79 1vig h GLN 65 N 0.83 0.15 0.34 4.17 3.07 -1.57 -1.81 115.11 120.28 1vig h GLN 65 Ca 0.22 -0.14 -0.02 0.00 0.09 0.00 0.00 58.65 58.80 1vig h GLN 65 Cb 0.03 0.03 0.00 0.00 0.08 0.00 0.00 27.48 27.63 1vig h GLN 65 CO -0.04 0.85 -0.17 1.96 0.09 0.00 0.00 178.83 181.53 1vig h GLN 66 N 0.09 -0.44 -0.86 0.06 7.50 0.39 -2.16 115.11 119.69 1vig h GLN 66 Ca -0.02 0.03 0.19 0.00 0.50 0.00 0.00 58.65 59.34 1vig h GLN 66 Cb 1.35 0.10 -0.06 0.00 0.05 0.00 0.00 27.48 28.93 1vig h GLN 66 CO 0.11 -0.30 0.57 0.00 -1.50 0.00 0.00 178.83 177.72 1vig h ALA 67 N -1.48 2.19 -1.35 3.87 0.00 -0.54 0.27 119.26 122.21 1vig h ALA 67 Ca -0.05 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1vig h ALA 67 Cb 0.35 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1vig h ALA 67 CO 0.08 -0.45 0.00 1.17 0.00 0.00 0.00 179.25 180.05 1vig n LYS 68 N -4.49 0.00 -0.33 0.00 4.81 -0.68 -0.70 118.16 116.76 1vig n LYS 68 Ca 0.18 0.29 0.34 0.00 -0.87 0.00 0.00 58.31 58.24 1vig n LYS 68 Cb 0.65 -1.28 0.71 0.00 0.02 0.00 0.00 35.03 35.14 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 0.06 0.45 1.64 2.43 -1.14 0.00 114.38 117.82 1vig h ARG 69 Ca 0.00 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1vig h ARG 69 Cb 0.00 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1vig h ARG 69 CO 0.00 0.04 -0.22 1.49 -1.51 0.00 0.00 179.97 179.77 1vig h GLU 70 N 0.07 -0.59 -0.84 0.20 4.57 -0.74 -2.02 114.58 115.22 1vig h GLU 70 Ca 0.58 0.04 0.13 0.00 -1.18 0.00 0.00 59.36 58.94 1vig h GLU 70 Cb 2.18 0.13 -0.09 0.00 -0.16 0.00 0.00 28.75 30.81 1vig h GLU 70 CO -0.06 -0.29 0.44 -0.07 -1.18 0.00 0.00 179.01 177.84 1vig h LEU 71 N -0.85 0.56 -0.39 1.64 3.38 0.10 0.36 115.31 120.12 1vig h LEU 71 Ca -0.06 0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1vig h LEU 71 Cb 0.57 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1vig h LEU 71 CO 0.10 0.26 0.24 -0.07 0.09 0.00 0.00 178.44 179.06 1vig h LEU 72 N 0.66 0.40 0.00 1.67 3.38 -1.31 0.80 115.31 120.92 1vig h LEU 72 Ca 0.45 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.41 1vig h LEU 72 Cb 0.58 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1vig h LEU 72 CO -0.34 0.29 0.00 -0.62 0.09 0.00 0.00 178.44 177.87 1vig n GLU 73 N -4.85 0.00 -0.11 1.13 -0.58 -0.52 -4.57 120.64 111.14 1vig n GLU 73 Ca 0.01 0.14 -0.11 0.00 -0.42 0.00 0.00 57.16 56.78 1vig n GLU 73 Cb 0.04 -0.62 -0.03 0.00 -0.57 0.00 0.00 31.44 30.27 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 0.56 -2.16 -4.62 3.38 -0.49 -3.49 115.31 108.48 1vig h LEU 74 Ca 0.00 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.68 1vig h LEU 74 Cb 0.00 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.52 1vig h LEU 74 CO 0.00 0.72 -1.10 0.00 0.09 0.00 0.00 178.44 178.14 1vig n ALA 75 N -2.37 -2.72 0.00 1.53 0.00 0.27 -4.97 120.51 112.26 1vig n ALA 75 Ca -0.02 1.49 0.00 0.00 0.00 0.00 0.00 53.44 54.91 1vig n ALA 75 Cb 0.26 -3.14 0.00 0.00 0.00 0.00 0.00 19.45 16.57 1vig n ALA 75 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93