#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 4.60 0.23 4.38 2.47 -1.26 -5.12 114.94 120.24 1vig s ASN 7 Ca 0.00 -0.08 0.10 0.00 0.42 0.00 0.00 52.86 53.30 1vig s ASN 7 Cb 0.00 -1.36 -0.05 0.00 -1.45 0.00 0.00 41.25 38.39 1vig s ASN 7 CO 0.00 0.29 -0.19 -0.13 -3.72 0.00 0.00 177.10 173.36 1vig s ARG 8 N -0.39 1.49 0.06 0.43 0.52 -1.26 -5.15 118.95 114.65 1vig s ARG 8 Ca 0.06 -1.62 -0.00 0.00 -0.52 0.00 0.00 55.73 53.64 1vig s ARG 8 Cb -0.12 -1.51 -0.04 0.00 0.52 0.00 0.00 34.95 33.79 1vig s ARG 8 CO 0.02 0.29 0.21 0.00 0.02 0.00 0.00 175.30 175.84 1vig s MET 9 N -3.32 3.43 -0.19 3.54 0.23 -1.26 -4.90 119.30 116.83 1vig s MET 9 Ca 0.24 -0.44 0.01 0.00 -1.03 0.00 0.00 55.69 54.47 1vig s MET 9 Cb -0.04 -3.04 0.04 0.00 -1.53 0.00 0.00 34.83 30.26 1vig s MET 9 CO 0.11 0.61 -0.11 -0.51 -2.03 0.00 0.00 175.02 173.09 1vig s ASP 10 N -2.49 3.27 0.41 -1.18 1.11 -0.98 -5.04 116.67 111.77 1vig s ASP 10 Ca 0.35 -0.82 0.07 0.00 0.18 0.00 0.00 52.55 52.33 1vig s ASP 10 Cb -0.13 -1.21 -0.08 0.00 1.07 0.00 0.00 42.92 42.57 1vig s ASP 10 CO 0.28 -0.13 0.01 -0.72 1.18 0.00 0.00 175.17 175.79 1vig s TYR 11 N 1.42 2.52 -0.25 4.23 1.13 -1.26 -0.17 117.35 124.97 1vig s TYR 11 Ca -0.00 -0.66 -0.26 0.00 -1.41 0.00 0.00 57.07 54.73 1vig s TYR 11 Cb -0.16 -1.78 0.13 0.00 -1.10 0.00 0.00 41.96 39.06 1vig s TYR 11 CO -0.09 0.44 1.07 0.54 -2.51 0.00 0.00 175.55 175.00 1vig s VAL 12 N -2.70 0.00 -0.13 -3.49 0.11 0.72 -4.93 120.40 109.98 1vig s VAL 12 Ca 0.35 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.39 1vig s VAL 12 Cb 0.10 -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 -0.16 3.38 -0.23 1.54 2.02 -1.26 -1.36 118.70 122.64 1vig s GLU 13 Ca 0.02 -0.64 -0.06 0.00 0.02 0.00 0.00 54.97 54.31 1vig s GLU 13 Cb -0.04 -2.68 -0.03 0.00 0.10 0.00 0.00 34.13 31.48 1vig s GLU 13 CO -0.05 0.26 0.03 0.96 0.02 0.00 0.00 175.26 176.49 1vig s ILE 14 N 0.25 4.12 0.26 -1.63 -4.36 -0.72 -4.99 121.20 114.12 1vig s ILE 14 Ca -0.07 -0.24 -0.29 0.00 -0.26 0.00 0.00 60.65 59.78 1vig s ILE 14 Cb -0.15 -2.90 -0.09 0.00 1.25 0.00 0.00 42.46 40.57 1vig s ILE 14 CO 0.05 0.38 1.26 0.20 0.24 0.00 0.00 174.94 177.07 1vig s ASN 15 N 1.32 6.95 0.14 4.36 0.02 -1.26 -1.67 114.94 124.80 1vig s ASN 15 Ca 0.04 2.46 0.02 0.00 -1.02 0.00 0.00 52.86 54.37 1vig s ASN 15 Cb -0.15 -2.63 -0.04 0.00 0.02 0.00 0.00 41.25 38.45 1vig s ASN 15 CO 0.02 -0.43 -0.04 -0.63 0.02 0.00 0.00 177.10 176.03 1vig s ILE 16 N -0.59 0.79 0.00 0.60 -1.09 -0.05 -4.91 121.20 115.94 1vig s ILE 16 Ca 0.51 -1.98 0.00 0.00 -2.23 0.00 0.00 60.65 56.95 1vig s ILE 16 Cb -0.36 -1.92 0.00 0.00 -1.58 0.00 0.00 42.46 38.60 1vig s ILE 16 CO 0.44 -0.67 0.00 0.47 -1.23 0.00 0.00 174.94 173.95 1vig n ASP 17 N -0.17 0.00 0.04 3.58 9.92 -1.26 -0.95 116.55 127.71 1vig n ASP 17 Ca -0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.17 1vig n ASP 17 Cb 0.62 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.10 1vig n ASP 17 CO 0.00 0.00 0.00 1.57 0.13 0.00 0.00 177.20 178.90 1vig n HIS 18 N -0.38 -2.53 -2.22 1.24 -0.00 -1.26 -2.21 115.22 107.86 1vig n HIS 18 Ca 0.00 0.24 -0.34 0.00 0.46 0.00 0.00 57.72 58.08 1vig n HIS 18 Cb 0.00 1.00 -0.04 0.00 -0.12 0.00 0.00 29.99 30.83 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 -2.65 2.19 0.14 1.57 4.01 -1.26 -4.08 118.16 118.08 1vig n LYS 19 Ca 0.00 -2.75 0.00 0.00 -0.51 0.00 0.00 58.31 55.05 1vig n LYS 19 Cb 0.00 -3.62 0.00 0.00 -0.51 0.00 0.00 35.03 30.90 1vig n LYS 19 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 1vig n PHE 20 N 11.96 -2.59 -0.27 2.13 3.01 -1.26 -4.84 117.46 125.61 1vig n PHE 20 Ca 0.47 0.54 -0.07 0.00 1.01 0.00 0.00 57.45 59.39 1vig n PHE 20 Cb 0.46 0.97 -0.03 0.00 -0.01 0.00 0.00 39.48 40.87 1vig n PHE 20 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1vig h HIS 21 N 0.00 -1.32 -0.60 1.38 3.86 -1.97 1.73 115.15 118.24 1vig h HIS 21 Ca 0.00 0.09 0.17 0.00 -1.16 0.00 0.00 60.37 59.48 1vig h HIS 21 Cb 0.00 0.68 -0.02 0.00 1.06 0.00 0.00 27.41 29.13 1vig h HIS 21 CO 0.00 -0.41 0.48 -0.09 0.86 0.00 0.00 177.93 178.77 1vig h ARG 22 N -0.15 0.00 0.00 2.45 9.65 -1.87 -0.95 114.38 123.52 1vig h ARG 22 Ca 0.21 0.00 -0.06 0.00 -1.10 0.00 0.00 59.98 59.04 1vig h ARG 22 Cb 0.55 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.12 1vig h ARG 22 CO -0.79 0.00 -0.32 0.45 2.80 0.00 0.00 179.97 182.11 1vig h HIS 23 N 0.00 0.00 -1.47 2.20 3.86 0.16 -3.31 115.15 116.59 1vig h HIS 23 Ca 0.28 0.00 0.44 0.00 -1.16 0.00 0.00 60.37 59.93 1vig h HIS 23 Cb 1.24 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 29.63 1vig h HIS 23 CO 0.00 1.05 1.03 -0.07 0.86 0.00 0.00 177.93 180.80 1vig h LEU 24 N -1.00 0.09 -8.50 2.43 -0.00 0.29 -3.33 115.31 105.29 1vig h LEU 24 Ca -0.09 0.04 -0.65 0.00 -0.00 0.00 0.00 57.88 57.18 1vig h LEU 24 Cb 1.01 0.03 -0.27 0.00 -0.00 0.00 0.00 40.66 41.43 1vig h LEU 24 CO -0.05 -0.03 -0.73 0.27 -0.00 0.00 0.00 178.44 177.90 1vig s ILE 25 N -5.04 3.32 0.01 1.22 -4.36 -0.70 -4.08 121.20 111.57 1vig s ILE 25 Ca -0.06 -0.53 -0.03 0.00 -0.26 0.00 0.00 60.65 59.77 1vig s ILE 25 Cb 0.26 -2.47 -0.01 0.00 1.25 0.00 0.00 42.46 41.49 1vig s ILE 25 CO 0.84 0.46 1.05 1.23 0.24 0.00 0.00 174.94 178.76 1vig h GLY 26 N 7.55 -2.09 0.00 6.27 0.00 -1.78 -3.43 103.07 109.59 1vig h GLY 26 Ca -0.36 0.93 0.00 0.00 0.00 0.00 0.00 47.33 47.89 1vig h GLY 26 CO 0.60 -0.77 -0.08 1.17 0.00 0.00 0.00 176.54 177.46 1vig n LYS 27 N -3.02 0.00 -2.04 4.80 4.81 -1.26 -4.92 118.16 116.53 1vig n LYS 27 Ca -0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1vig n LYS 27 Cb 0.03 -0.40 0.05 0.00 0.02 0.00 0.00 35.03 34.73 1vig n LYS 27 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1vig n SER 28 N -3.44 1.67 0.00 3.14 2.88 -1.26 -4.98 113.62 111.63 1vig n SER 28 Ca 0.00 -2.33 0.00 0.00 -1.33 0.00 0.00 58.87 55.21 1vig n SER 28 Cb 0.04 -0.40 0.00 0.00 -0.75 0.00 0.00 64.21 63.10 1vig n SER 28 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vig n GLY 29 N -0.22 0.79 0.22 0.46 0.00 -1.26 -5.05 105.19 100.13 1vig n GLY 29 Ca 0.11 -0.75 0.02 0.00 0.00 0.00 0.00 46.02 45.41 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 0.00 2.35 -0.01 4.61 0.00 -1.26 -4.63 120.51 121.57 1vig n ALA 30 Ca 0.00 -0.72 -0.03 0.00 0.00 0.00 0.00 53.44 52.70 1vig n ALA 30 Cb 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 19.45 19.27 1vig n ALA 30 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1vig n ASN 31 N 0.15 0.31 -0.32 0.00 5.15 -1.26 -4.52 115.26 114.77 1vig n ASN 31 Ca 0.04 0.05 0.19 0.00 -0.60 0.00 0.00 54.58 54.25 1vig n ASN 31 Cb 0.19 -0.12 0.39 0.00 -0.53 0.00 0.00 39.78 39.71 1vig n ASN 31 CO 0.00 0.00 0.00 0.16 1.40 0.00 0.00 177.26 178.82 1vig h ILE 32 N -0.10 0.37 0.56 -1.44 3.07 -1.86 0.78 117.51 118.88 1vig h ILE 32 Ca -0.07 -0.12 -0.03 0.00 1.55 0.00 0.00 64.86 66.20 1vig h ILE 32 Cb 0.96 -0.02 0.00 0.00 -0.27 0.00 0.00 36.82 37.49 1vig h ILE 32 CO -0.04 0.07 -0.29 -0.55 -1.05 0.00 0.00 178.15 176.29 1vig h ASN 33 N 0.36 -0.69 -0.88 2.16 -1.07 -1.84 -2.26 115.58 111.35 1vig h ASN 33 Ca 0.65 0.03 0.18 0.00 0.07 0.00 0.00 56.30 57.23 1vig h ASN 33 Cb 1.37 0.19 -0.17 0.00 -2.07 0.00 0.00 38.32 37.64 1vig h ASN 33 CO -0.58 -0.48 -0.21 -0.09 0.07 0.00 0.00 177.43 176.14 1vig h ARG 34 N -0.78 0.00 0.59 4.14 2.43 -1.09 0.15 114.38 119.82 1vig h ARG 34 Ca -0.07 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.07 1vig h ARG 34 Cb 0.61 -0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.16 1vig h ARG 34 CO 0.11 0.00 -0.28 0.82 -1.51 0.00 0.00 179.97 179.11 1vig h ILE 35 N 0.00 0.00 -1.41 1.20 5.03 -1.31 0.45 117.51 121.46 1vig h ILE 35 Ca 0.43 -0.06 0.43 0.00 -0.12 0.00 0.00 64.86 65.54 1vig h ILE 35 Cb 0.66 0.00 -0.10 0.00 -3.03 0.00 0.00 36.82 34.35 1vig h ILE 35 CO -0.90 0.00 0.96 0.50 -0.68 0.00 0.00 178.15 178.02 1vig h LYS 36 N -0.85 0.09 0.09 2.37 3.11 -0.73 1.28 116.57 121.93 1vig h LYS 36 Ca -0.08 -0.01 -0.29 0.00 -2.81 0.00 0.00 60.65 57.47 1vig h LYS 36 Cb 0.60 -0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.80 1vig h LYS 36 CO 0.13 0.06 -1.44 0.22 -2.81 0.00 0.00 179.45 175.61 1vig h ASP 37 N 0.09 0.28 0.00 4.20 1.82 -0.49 -2.31 116.42 120.02 1vig h ASP 37 Ca 0.78 -0.38 -0.00 0.00 -0.39 0.00 0.00 57.03 57.04 1vig h ASP 37 Cb 2.67 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 42.59 1vig h ASP 37 CO -0.25 1.32 -0.00 -0.61 -1.61 0.00 0.00 179.24 178.09 1vig h GLN 38 N 0.05 -0.00 -0.05 0.28 5.75 0.59 -3.35 115.11 118.38 1vig h GLN 38 Ca -0.20 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.30 1vig h GLN 38 Cb 1.97 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.52 1vig h GLN 38 CO 0.15 -0.00 0.00 0.66 -2.65 0.00 0.00 178.83 176.99 1vig n TYR 39 N -3.80 0.06 -4.15 3.99 4.02 0.31 -4.89 117.16 112.70 1vig n TYR 39 Ca -0.00 -0.03 -0.34 0.00 -0.01 0.00 0.00 57.90 57.52 1vig n TYR 39 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.30 1vig n TYR 39 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1vig n LYS 40 N -0.44 -3.40 -3.16 -0.72 4.01 -0.89 -4.47 118.16 109.08 1vig n LYS 40 Ca 0.08 0.40 -0.16 0.00 -0.51 0.00 0.00 58.31 58.12 1vig n LYS 40 Cb 0.09 -5.03 -0.02 0.00 -0.51 0.00 0.00 35.03 29.55 1vig n LYS 40 CO 0.00 0.00 0.00 1.33 -1.11 0.00 0.00 177.40 177.62 1vig n VAL 41 N -4.42 0.00 -3.91 -0.18 0.24 -1.07 -4.68 118.33 104.30 1vig n VAL 41 Ca 0.01 -1.21 -0.30 0.00 -2.04 0.00 0.00 64.34 60.79 1vig n VAL 41 Cb 0.53 0.08 -0.15 0.00 -1.47 0.00 0.00 33.84 32.82 1vig n VAL 41 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1vig s SER 42 N -2.53 4.12 -0.11 -1.34 1.04 0.15 -4.16 113.70 110.88 1vig s SER 42 Ca 0.05 -1.53 -0.05 0.00 0.48 0.00 0.00 55.95 54.91 1vig s SER 42 Cb -0.00 -1.22 -0.04 0.00 0.10 0.00 0.00 66.02 64.86 1vig s SER 42 CO 0.03 -0.31 0.10 0.54 0.98 0.00 0.00 173.24 174.58 1vig s VAL 43 N 1.33 5.13 -0.06 5.02 0.11 -1.26 -1.73 120.40 128.93 1vig s VAL 43 Ca 0.02 0.05 0.00 0.00 -2.93 0.00 0.00 61.98 59.12 1vig s VAL 43 Cb -0.19 -3.22 0.02 0.00 -1.53 0.00 0.00 36.38 31.47 1vig s VAL 43 CO -0.11 0.60 -0.03 -0.13 -3.33 0.00 0.00 175.10 172.11 1vig s ARG 44 N -1.02 0.79 -0.74 1.54 1.81 0.16 -4.97 118.95 116.52 1vig s ARG 44 Ca 0.15 -0.03 -0.08 0.00 -1.72 0.00 0.00 55.73 54.04 1vig s ARG 44 Cb -0.12 -0.94 0.19 0.00 -0.45 0.00 0.00 34.95 33.63 1vig s ARG 44 CO 0.04 -0.18 0.62 0.42 -0.68 0.00 0.00 175.30 175.52 1vig s ILE 45 N 1.38 4.67 -0.36 1.52 -1.09 -1.26 -2.00 121.20 124.07 1vig s ILE 45 Ca -0.04 -2.77 -0.29 0.00 -2.23 0.00 0.00 60.65 55.32 1vig s ILE 45 Cb -0.13 -3.95 -0.00 0.00 -1.58 0.00 0.00 42.46 36.80 1vig s ILE 45 CO -0.03 -0.96 1.57 -2.16 -1.23 0.00 0.00 174.94 172.14 1vig s PRO 46 N -0.03 3.52 -1.26 2.79 0.04 -1.26 -4.91 135.00 133.89 1vig s PRO 46 Ca 0.18 1.21 -0.08 0.00 0.04 0.00 0.00 61.00 62.34 1vig s PRO 46 Cb -0.15 -4.09 -0.10 0.00 0.04 0.00 0.00 34.50 30.21 1vig s PRO 46 CO -0.06 -1.63 2.77 -0.35 0.04 0.00 0.00 177.00 177.77 1vig n PRO 47 N 8.14 3.06 0.03 0.56 -0.04 -1.26 -4.41 135.00 141.08 1vig n PRO 47 Ca 0.19 -1.85 -0.22 0.00 -0.04 0.00 0.00 63.50 61.58 1vig n PRO 47 Cb 0.47 -2.61 -0.14 0.00 -0.04 0.00 0.00 33.50 31.18 1vig n PRO 47 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 1vig h ASP 48 N 5.16 0.45 -6.20 3.54 3.04 -2.00 -3.48 116.42 116.94 1vig h ASP 48 Ca 0.70 -0.88 -0.44 0.00 -3.24 0.00 0.00 57.03 53.16 1vig h ASP 48 Cb 0.37 -0.15 0.01 0.00 -1.04 0.00 0.00 39.33 38.52 1vig h ASP 48 CO 1.53 1.63 -0.81 -0.24 -2.04 0.00 0.00 179.24 179.31 1vig n SER 49 N -3.87 -2.27 -4.23 4.15 2.88 -1.26 -4.91 113.62 104.10 1vig n SER 49 Ca -0.24 -0.82 -0.42 0.00 -1.33 0.00 0.00 58.87 56.06 1vig n SER 49 Cb 0.93 -3.91 -0.01 0.00 -0.75 0.00 0.00 64.21 60.47 1vig n SER 49 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1vig n GLU 50 N -4.42 3.43 0.00 -1.46 2.13 -1.26 -4.93 120.64 114.13 1vig n GLU 50 Ca -0.19 -4.48 0.00 0.00 0.66 0.00 0.00 57.16 53.15 1vig n GLU 50 Cb 0.63 -2.51 0.00 0.00 0.27 0.00 0.00 31.44 29.83 1vig n GLU 50 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1vig n LYS 51 N 2.40 0.00 -3.45 5.31 4.01 -1.26 -4.54 118.16 120.64 1vig n LYS 51 Ca 0.24 0.00 -0.38 0.00 -0.51 0.00 0.00 58.31 57.66 1vig n LYS 51 Cb 0.38 0.00 -0.08 0.00 -0.51 0.00 0.00 35.03 34.82 1vig n LYS 51 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1vig s SER 52 N -4.00 6.35 0.56 4.39 0.15 -1.26 -4.57 113.70 115.32 1vig s SER 52 Ca 0.00 0.41 -0.05 0.00 0.70 0.00 0.00 55.95 57.01 1vig s SER 52 Cb 0.00 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 62.11 1vig s SER 52 CO 0.00 -0.05 0.85 0.20 1.20 0.00 0.00 173.24 175.44 1vig s ASN 53 N 1.07 5.66 -0.31 5.45 -0.87 -0.13 -4.93 114.94 120.89 1vig s ASN 53 Ca 0.16 0.64 0.02 0.00 -1.57 0.00 0.00 52.86 52.12 1vig s ASN 53 Cb -0.14 -1.69 0.19 0.00 -0.02 0.00 0.00 41.25 39.58 1vig s ASN 53 CO 0.07 -0.98 0.71 -0.22 -2.57 0.00 0.00 177.10 174.11 1vig s LEU 54 N -4.90 -1.32 0.19 0.60 2.96 -1.26 -0.87 118.68 114.07 1vig s LEU 54 Ca 0.53 -0.00 -0.30 0.00 -0.22 0.00 0.00 54.13 54.13 1vig s LEU 54 Cb -0.10 1.80 -0.08 0.00 0.50 0.00 0.00 46.19 48.31 1vig s LEU 54 CO 0.44 -0.22 1.07 -0.63 -1.32 0.00 0.00 176.35 175.68 1vig s ILE 55 N 2.66 3.91 -0.04 6.68 1.01 -0.67 -4.76 121.20 129.99 1vig s ILE 55 Ca 0.15 1.70 -0.14 0.00 0.00 0.00 0.00 60.65 62.36 1vig s ILE 55 Cb -0.07 -4.08 -0.05 0.00 0.01 0.00 0.00 42.46 38.26 1vig s ILE 55 CO -0.22 0.32 0.36 -0.13 0.00 0.00 0.00 174.94 175.27 1vig s ARG 56 N -0.57 3.91 0.02 2.79 3.00 -0.85 -1.76 118.95 125.49 1vig s ARG 56 Ca 0.47 0.30 -0.01 0.00 0.00 0.00 0.00 55.73 56.49 1vig s ARG 56 Cb -0.29 -3.25 -0.02 0.00 0.00 0.00 0.00 34.95 31.39 1vig s ARG 56 CO 0.35 0.62 -0.01 0.42 0.00 0.00 0.00 175.30 176.69 1vig s ILE 57 N -0.80 0.12 -0.29 1.52 -1.09 -0.46 -0.66 121.20 119.53 1vig s ILE 57 Ca 0.22 -0.95 -0.26 0.00 -2.23 0.00 0.00 60.65 57.43 1vig s ILE 57 Cb -0.15 -0.39 0.17 0.00 -1.58 0.00 0.00 42.46 40.51 1vig s ILE 57 CO 0.11 -0.52 1.30 -0.70 -1.23 0.00 0.00 174.94 173.90 1vig s GLU 58 N -1.66 0.20 0.00 2.79 2.12 -0.71 -0.20 118.70 121.25 1vig s GLU 58 Ca -0.14 0.21 0.00 0.00 0.36 0.00 0.00 54.97 55.40 1vig s GLU 58 Cb -0.08 0.10 0.00 0.00 0.26 0.00 0.00 34.13 34.41 1vig s GLU 58 CO -0.01 -0.03 0.00 0.41 -0.54 0.00 0.00 175.26 175.08 1vig n GLY 59 N 1.61 4.61 1.80 -1.50 0.00 0.76 0.30 105.19 112.77 1vig n GLY 59 Ca -0.10 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.44 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 0.06 -1.64 1.61 2.03 -1.26 -2.32 116.55 115.03 1vig n ASP 60 Ca 0.00 0.30 0.00 0.00 0.52 0.00 0.00 54.79 55.61 1vig n ASP 60 Cb 0.00 0.18 0.00 0.00 -0.72 0.00 0.00 41.12 40.58 1vig n ASP 60 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1vig n PRO 61 N -3.22 1.26 0.15 -0.67 -0.04 -1.26 -4.66 135.00 126.56 1vig n PRO 61 Ca 0.00 0.00 0.19 0.00 -0.04 0.00 0.00 63.50 63.65 1vig n PRO 61 Cb 0.03 0.00 0.74 0.00 -0.04 0.00 0.00 33.50 34.23 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 -0.98 0.54 4.20 -2.00 -1.31 115.11 115.56 1vig h GLN 62 Ca 0.00 0.00 0.21 0.00 0.06 0.00 0.00 58.65 58.92 1vig h GLN 62 Cb 0.00 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 27.67 1vig h GLN 62 CO 0.00 0.00 0.56 0.78 -0.67 0.00 0.00 178.83 179.50 1vig h GLY 63 N 0.00 1.76 0.64 3.46 0.00 -1.91 0.43 103.07 107.45 1vig h GLY 63 Ca 0.15 -0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 1vig h GLY 63 CO -0.00 -0.15 -0.00 -0.24 0.00 0.00 0.00 176.54 176.15 1vig h VAL 64 N 0.65 1.29 -0.00 4.60 3.04 -1.45 0.25 116.25 124.62 1vig h VAL 64 Ca 0.59 -0.85 -0.06 0.00 -1.01 0.00 0.00 66.70 65.37 1vig h VAL 64 Cb 1.00 1.86 -0.01 0.00 -2.01 0.00 0.00 31.29 32.14 1vig h VAL 64 CO -0.43 0.22 -0.30 0.06 -1.01 0.00 0.00 177.57 176.11 1vig h GLN 65 N -0.36 0.00 -0.05 4.17 3.07 -1.49 0.16 115.11 120.62 1vig h GLN 65 Ca 0.00 -0.00 -0.16 0.00 0.09 0.00 0.00 58.65 58.58 1vig h GLN 65 Cb 0.36 -0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.93 1vig h GLN 65 CO 0.00 0.30 -0.57 1.96 0.09 0.00 0.00 178.83 180.61 1vig h GLN 66 N 0.00 0.48 -0.43 0.06 4.20 -0.04 -2.45 115.11 116.93 1vig h GLN 66 Ca -0.00 -0.45 -0.14 0.00 0.06 0.00 0.00 58.65 58.12 1vig h GLN 66 Cb 0.53 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 1vig h GLN 66 CO 0.04 1.09 -0.27 0.00 -0.67 0.00 0.00 178.83 179.02 1vig h ALA 67 N 0.40 0.70 -0.35 3.87 0.00 -0.25 -0.18 119.26 123.45 1vig h ALA 67 Ca -0.06 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1vig h ALA 67 Cb 1.25 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1vig h ALA 67 CO 0.12 0.67 0.22 -0.22 0.00 0.00 0.00 179.25 180.03 1vig h LYS 68 N 0.79 0.47 -0.22 0.00 3.64 -0.73 -1.92 116.57 118.60 1vig h LYS 68 Ca 0.09 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.32 1vig h LYS 68 Cb 0.84 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 1vig h LYS 68 CO 0.07 0.34 -0.33 -0.09 -2.27 0.00 0.00 179.45 177.17 1vig h ARG 69 N 0.46 0.47 -0.29 1.90 2.43 -1.35 -2.50 114.38 115.50 1vig h ARG 69 Ca 0.13 -0.20 0.01 0.00 -0.81 0.00 0.00 59.98 59.10 1vig h ARG 69 Cb -0.01 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1vig h ARG 69 CO -0.02 0.74 0.20 1.49 -1.51 0.00 0.00 179.97 180.86 1vig h GLU 70 N 0.40 0.36 0.02 0.20 4.57 -0.45 0.05 114.58 119.73 1vig h GLU 70 Ca 0.05 -0.02 -0.11 0.00 -1.18 0.00 0.00 59.36 58.10 1vig h GLU 70 Cb 0.78 -0.08 0.01 0.00 -0.16 0.00 0.00 28.75 29.29 1vig h GLU 70 CO 0.06 0.24 -0.43 -0.07 -1.18 0.00 0.00 179.01 177.63 1vig h LEU 71 N 0.37 0.35 -2.29 1.64 3.38 -1.00 0.14 115.31 117.90 1vig h LEU 71 Ca 0.11 -0.81 -0.01 0.00 0.09 0.00 0.00 57.88 57.27 1vig h LEU 71 Cb 0.00 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1vig h LEU 71 CO -0.02 1.12 -0.03 -0.07 0.09 0.00 0.00 178.44 179.52 1vig h LEU 72 N -0.38 0.00 0.06 1.67 3.38 -1.02 0.49 115.31 119.51 1vig h LEU 72 Ca -0.06 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.54 1vig h LEU 72 Cb 1.20 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 1vig h LEU 72 CO 0.08 0.03 -2.15 -0.62 0.09 0.00 0.00 178.44 175.87 1vig n GLU 73 N -3.25 0.69 -0.01 1.13 1.02 -0.04 -3.98 120.64 116.20 1vig n GLU 73 Ca -0.02 0.25 -0.01 0.00 -0.02 0.00 0.00 57.16 57.37 1vig n GLU 73 Cb 0.18 -1.63 -0.00 0.00 -0.02 0.00 0.00 31.44 29.97 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 -0.16 0.00 -0.75 -4.62 3.38 -0.49 -3.39 115.31 109.28 1vig h LEU 74 Ca -0.50 0.00 0.17 0.00 0.09 0.00 0.00 57.88 57.64 1vig h LEU 74 Cb 1.88 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 42.50 1vig h LEU 74 CO -0.05 0.12 0.10 0.00 0.09 0.00 0.00 178.44 178.69 1vig h ALA 75 N -1.84 0.90 -0.01 1.53 0.00 -0.22 -3.49 119.26 116.12 1vig h ALA 75 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1vig h ALA 75 Cb 0.07 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1vig h ALA 75 CO 0.00 -0.40 0.00 0.45 0.00 0.00 0.00 179.25 179.30