#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 7.02 0.00 7.28 0.01 -1.26 -4.90 114.94 123.09 1vig s ASN 7 Ca 0.00 1.32 0.00 0.00 -0.71 0.00 0.00 52.86 53.47 1vig s ASN 7 Cb 0.00 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 39.12 1vig s ASN 7 CO 0.00 -0.75 0.00 0.54 -1.51 0.00 0.00 177.10 175.38 1vig n ARG 8 N 6.54 0.00 -3.87 -0.60 5.12 -1.26 -5.16 116.66 117.43 1vig n ARG 8 Ca 0.12 0.00 -0.10 0.00 -1.93 0.00 0.00 57.85 55.95 1vig n ARG 8 Cb 0.46 -0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.76 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 -0.01 2.08 -0.13 5.56 -1.94 -1.26 -5.04 119.30 118.56 1vig s MET 9 Ca 0.00 -1.42 -0.00 0.00 -1.71 0.00 0.00 55.69 52.56 1vig s MET 9 Cb 0.00 0.58 0.03 0.00 2.01 0.00 0.00 34.83 37.46 1vig s MET 9 CO 0.00 -0.95 -0.07 -0.51 -0.01 0.00 0.00 175.02 173.48 1vig s ASP 10 N -3.07 2.44 0.16 3.03 1.11 -0.98 -5.04 116.67 114.31 1vig s ASP 10 Ca 0.18 -0.44 0.09 0.00 0.18 0.00 0.00 52.55 52.55 1vig s ASP 10 Cb -0.04 -0.88 -0.04 0.00 1.07 0.00 0.00 42.92 43.03 1vig s ASP 10 CO 0.12 -0.14 -0.20 -0.72 1.18 0.00 0.00 175.17 175.41 1vig s TYR 11 N 1.68 1.92 -0.30 4.23 -0.85 -1.26 -0.75 117.35 122.02 1vig s TYR 11 Ca 0.03 -0.44 -0.16 0.00 -0.52 0.00 0.00 57.07 55.98 1vig s TYR 11 Cb -0.14 -0.98 0.18 0.00 0.38 0.00 0.00 41.96 41.40 1vig s TYR 11 CO -0.08 0.34 1.10 0.54 -1.52 0.00 0.00 175.55 175.94 1vig s VAL 12 N -1.80 -0.18 -0.17 -3.49 0.11 0.17 -4.96 120.40 110.08 1vig s VAL 12 Ca 0.15 0.00 -0.07 0.00 -2.93 0.00 0.00 61.98 59.13 1vig s VAL 12 Cb -0.07 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.74 1vig s VAL 12 CO 0.07 0.00 0.05 -1.83 -3.33 0.00 0.00 175.10 170.06 1vig s GLU 13 N 1.82 3.89 0.10 1.54 -1.05 -1.26 -0.63 118.70 123.11 1vig s GLU 13 Ca -0.05 -0.36 -0.05 0.00 -0.15 0.00 0.00 54.97 54.37 1vig s GLU 13 Cb -0.04 -3.16 -0.05 0.00 -0.44 0.00 0.00 34.13 30.44 1vig s GLU 13 CO -0.15 0.31 0.34 0.96 0.95 0.00 0.00 175.26 177.66 1vig s ILE 14 N 0.27 5.21 0.13 1.83 -4.36 0.64 -4.90 121.20 120.01 1vig s ILE 14 Ca 0.03 0.06 -0.29 0.00 -0.26 0.00 0.00 60.65 60.19 1vig s ILE 14 Cb -0.12 -3.62 -0.06 0.00 1.25 0.00 0.00 42.46 39.91 1vig s ILE 14 CO 0.01 0.14 0.93 0.20 0.24 0.00 0.00 174.94 176.45 1vig s ASN 15 N -2.23 7.49 0.03 4.36 0.01 -1.26 -0.94 114.94 122.40 1vig s ASN 15 Ca 0.37 1.77 -0.02 0.00 -0.71 0.00 0.00 52.86 54.27 1vig s ASN 15 Cb -0.13 -2.57 -0.02 0.00 0.41 0.00 0.00 41.25 38.94 1vig s ASN 15 CO 0.23 -0.01 0.01 -0.63 -1.51 0.00 0.00 177.10 175.19 1vig s ILE 16 N -0.24 0.13 0.00 0.60 -1.09 0.91 -4.89 121.20 116.63 1vig s ILE 16 Ca 0.45 -1.08 0.00 0.00 -2.23 0.00 0.00 60.65 57.78 1vig s ILE 16 Cb -0.23 -0.63 0.00 0.00 -1.58 0.00 0.00 42.46 40.02 1vig s ILE 16 CO 0.29 -0.60 0.72 0.47 -1.23 0.00 0.00 174.94 174.59 1vig n ASP 17 N 1.16 -0.69 -1.70 3.58 8.00 -1.26 -0.56 116.55 125.07 1vig n ASP 17 Ca -0.21 -1.43 -0.18 0.00 0.71 0.00 0.00 54.79 53.68 1vig n ASP 17 Cb 0.57 0.21 0.07 0.00 -0.02 0.00 0.00 41.12 41.95 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 0.00 2.13 -2.17 1.24 -0.00 -1.26 -4.91 115.22 110.25 1vig n HIS 18 Ca -0.19 -2.09 -0.11 0.00 0.46 0.00 0.00 57.72 55.79 1vig n HIS 18 Cb 0.57 -0.41 -0.02 0.00 -0.12 0.00 0.00 29.99 30.01 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 -0.84 -2.06 -0.21 1.57 5.02 -1.26 -4.80 118.16 115.58 1vig n LYS 19 Ca 0.40 0.55 -0.05 0.00 -2.02 0.00 0.00 58.31 57.18 1vig n LYS 19 Cb 0.90 -5.04 0.11 0.00 -0.02 0.00 0.00 35.03 30.99 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 1.05 -0.31 2.13 0.04 -1.96 -2.99 116.94 114.90 1vig h PHE 20 Ca -0.25 -0.10 0.03 0.00 2.80 0.00 0.00 57.97 60.45 1vig h PHE 20 Cb 1.07 -0.31 -0.05 0.00 2.20 0.00 0.00 35.95 38.86 1vig h PHE 20 CO 0.62 0.85 -0.35 0.45 -0.60 0.00 0.00 178.31 179.28 1vig h HIS 21 N 0.98 -1.09 0.00 -0.55 3.86 -1.97 1.44 115.15 117.82 1vig h HIS 21 Ca 0.21 0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.47 1vig h HIS 21 Cb 0.31 0.52 -0.00 0.00 1.06 0.00 0.00 27.41 29.30 1vig h HIS 21 CO 0.02 -0.30 -0.04 0.07 0.86 0.00 0.00 177.93 178.55 1vig h ARG 22 N -0.21 0.00 0.01 2.45 0.11 -1.93 -2.64 114.38 112.17 1vig h ARG 22 Ca 0.05 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.13 1vig h ARG 22 Cb 0.35 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.43 1vig h ARG 22 CO -0.41 0.04 -0.01 0.45 0.10 0.00 0.00 179.97 180.14 1vig h HIS 23 N 0.00 -0.02 -0.51 4.08 3.86 -0.32 -2.23 115.15 120.01 1vig h HIS 23 Ca -0.00 -0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.31 1vig h HIS 23 Cb 0.14 0.01 -0.08 0.00 1.06 0.00 0.00 27.41 28.54 1vig h HIS 23 CO 0.00 0.77 0.04 -0.07 0.86 0.00 0.00 177.93 179.53 1vig h LEU 24 N -0.93 -0.14 -0.85 2.43 4.07 0.20 0.46 115.31 120.55 1vig h LEU 24 Ca -0.00 0.11 -0.06 0.00 0.08 0.00 0.00 57.88 58.01 1vig h LEU 24 Cb 0.80 0.19 -0.01 0.00 1.08 0.00 0.00 40.66 42.72 1vig h LEU 24 CO 0.00 -0.04 -0.30 0.16 -1.08 0.00 0.00 178.44 177.17 1vig h ILE 25 N 0.16 0.68 0.00 1.22 3.07 -1.61 -3.31 117.51 117.72 1vig h ILE 25 Ca 0.26 -1.41 0.00 0.00 1.55 0.00 0.00 64.86 65.27 1vig h ILE 25 Cb 0.39 1.93 0.00 0.00 -0.27 0.00 0.00 36.82 38.86 1vig h ILE 25 CO -0.40 0.30 0.00 0.61 -1.05 0.00 0.00 178.15 177.61 1vig n GLY 26 N 0.38 2.53 0.10 0.16 0.00 0.15 -1.05 105.19 107.46 1vig n GLY 26 Ca 0.00 -0.29 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 1vig n GLY 26 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vig h LYS 27 N 0.00 0.21 0.00 1.61 1.57 -1.88 -3.45 116.57 114.63 1vig h LYS 27 Ca 0.00 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1vig h LYS 27 Cb 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1vig h LYS 27 CO 0.00 0.55 0.00 0.43 -0.57 0.00 0.00 179.45 179.86 1vig n SER 28 N -4.73 0.00 0.00 0.86 7.64 -1.18 -5.12 113.62 111.09 1vig n SER 28 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.82 1vig n SER 28 Cb 0.26 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 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 3.44 -0.58 0.05 0.23 0.00 -0.22 -4.78 105.19 103.34 1vig n GLY 29 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 46.02 46.72 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 2.04 -0.26 4.61 0.00 -1.22 -4.79 120.51 120.89 1vig n ALA 30 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 1vig n ALA 30 Cb 0.00 0.37 0.18 0.00 0.00 0.00 0.00 19.45 20.00 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 -0.19 -1.01 0.00 -1.24 -1.82 0.32 115.58 111.64 1vig h ASN 31 Ca 0.00 0.18 0.24 0.00 0.71 0.00 0.00 56.30 57.43 1vig h ASN 31 Cb 0.73 0.29 -0.11 0.00 0.73 0.00 0.00 38.32 39.96 1vig h ASN 31 CO 0.00 -0.14 0.62 0.16 -1.29 0.00 0.00 177.43 176.79 1vig h ILE 32 N 0.16 0.57 -0.01 2.57 3.07 -1.87 0.66 117.51 122.67 1vig h ILE 32 Ca 0.43 -0.19 -0.15 0.00 1.55 0.00 0.00 64.86 66.51 1vig h ILE 32 Cb 0.78 -0.03 -0.02 0.00 -0.27 0.00 0.00 36.82 37.29 1vig h ILE 32 CO -0.62 0.10 -0.68 0.78 -1.05 0.00 0.00 178.15 176.68 1vig h ASN 33 N 0.55 0.04 -0.36 2.16 2.35 -0.70 -2.52 115.58 117.10 1vig h ASN 33 Ca 0.61 -0.02 0.04 0.00 -0.55 0.00 0.00 56.30 56.38 1vig h ASN 33 Cb 1.26 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 39.58 1vig h ASN 33 CO -0.39 0.71 0.13 -0.09 -1.65 0.00 0.00 177.43 176.14 1vig h ARG 34 N 0.02 0.27 0.19 0.81 2.43 0.98 -2.17 114.38 116.92 1vig h ARG 34 Ca -0.01 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1vig h ARG 34 Cb 1.21 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 1vig h ARG 34 CO 0.09 0.18 -0.09 0.82 -1.51 0.00 0.00 179.97 179.46 1vig h ILE 35 N 0.28 0.79 -1.76 1.20 5.03 -1.46 0.39 117.51 121.98 1vig h ILE 35 Ca 0.16 -1.03 0.53 0.00 -0.12 0.00 0.00 64.86 64.40 1vig h ILE 35 Cb 0.13 1.31 -0.09 0.00 -3.03 0.00 0.00 36.82 35.14 1vig h ILE 35 CO -0.16 0.20 1.24 0.50 -0.68 0.00 0.00 178.15 179.24 1vig h LYS 36 N -0.85 0.01 0.00 2.37 3.64 -1.36 0.76 116.57 121.14 1vig h LYS 36 Ca -0.03 -0.00 -0.45 0.00 -1.27 0.00 0.00 60.65 58.90 1vig h LYS 36 Cb 0.52 -0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.27 1vig h LYS 36 CO 0.04 0.01 -2.53 -3.47 -2.27 0.00 0.00 179.45 171.23 1vig n ASP 37 N -4.18 1.96 -0.10 4.20 -0.08 -0.82 -0.43 116.55 117.10 1vig n ASP 37 Ca 0.42 0.27 0.18 0.00 -1.51 0.00 0.00 54.79 54.15 1vig n ASP 37 Cb 1.84 -0.76 0.58 0.00 2.34 0.00 0.00 41.12 45.12 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 -0.85 0.24 0.00 -0.67 5.75 0.14 -1.84 115.11 117.88 1vig h GLN 38 Ca -0.68 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 57.80 1vig h GLN 38 Cb 1.66 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 30.15 1vig h GLN 38 CO -0.38 0.16 0.00 0.66 -2.65 0.00 0.00 178.83 176.62 1vig n TYR 39 N -4.43 0.00 -3.96 3.99 4.02 0.25 -5.00 117.16 112.03 1vig n TYR 39 Ca 0.13 -0.40 -0.27 0.00 -0.01 0.00 0.00 57.90 57.34 1vig n TYR 39 Cb 0.57 -0.04 -0.01 0.00 -0.02 0.00 0.00 39.34 39.84 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 -0.40 -3.87 -2.61 -0.72 5.02 -0.69 -4.41 118.16 110.47 1vig n LYS 40 Ca 0.00 0.46 -0.07 0.00 -2.02 0.00 0.00 58.31 56.68 1vig n LYS 40 Cb 0.21 -4.89 -0.02 0.00 -0.02 0.00 0.00 35.03 30.32 1vig n LYS 40 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1vig n VAL 41 N -4.42 0.00 -3.68 -0.18 0.24 0.42 -4.52 118.33 106.19 1vig n VAL 41 Ca -0.18 -0.56 -0.29 0.00 -2.04 0.00 0.00 64.34 61.26 1vig n VAL 41 Cb 0.62 0.13 -0.13 0.00 -1.47 0.00 0.00 33.84 33.00 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 -1.64 3.56 0.09 -1.34 0.15 0.18 -4.15 113.70 110.54 1vig s SER 42 Ca 0.01 -2.58 -0.15 0.00 0.70 0.00 0.00 55.95 53.93 1vig s SER 42 Cb 0.00 -0.96 -0.06 0.00 -1.71 0.00 0.00 66.02 63.29 1vig s SER 42 CO 0.01 -0.27 0.51 0.54 1.20 0.00 0.00 173.24 175.23 1vig s VAL 43 N 0.43 4.89 -0.01 4.45 0.11 -1.26 -2.30 120.40 126.70 1vig s VAL 43 Ca 0.18 0.89 0.00 0.00 -2.93 0.00 0.00 61.98 60.12 1vig s VAL 43 Cb -0.24 -3.76 0.02 0.00 -1.53 0.00 0.00 36.38 30.87 1vig s VAL 43 CO 0.00 0.40 0.02 -0.13 -3.33 0.00 0.00 175.10 172.06 1vig s ARG 44 N -1.55 -0.02 -0.56 1.54 1.81 -0.59 -4.93 118.95 114.65 1vig s ARG 44 Ca 0.32 0.13 -0.13 0.00 -1.72 0.00 0.00 55.73 54.33 1vig s ARG 44 Cb -0.16 -0.17 0.14 0.00 -0.45 0.00 0.00 34.95 34.31 1vig s ARG 44 CO 0.18 -0.11 0.49 0.42 -0.68 0.00 0.00 175.30 175.59 1vig s ILE 45 N 0.73 4.90 -0.33 1.52 -1.09 -1.26 -2.29 121.20 123.38 1vig s ILE 45 Ca -0.06 -1.78 -0.29 0.00 -2.23 0.00 0.00 60.65 56.29 1vig s ILE 45 Cb -0.09 -4.15 -0.00 0.00 -1.58 0.00 0.00 42.46 36.64 1vig s ILE 45 CO -0.02 -0.86 1.48 -2.16 -1.23 0.00 0.00 174.94 172.14 1vig s PRO 46 N 1.26 3.68 -0.05 2.79 0.04 -1.26 -4.93 135.00 136.53 1vig s PRO 46 Ca 0.06 1.24 -0.01 0.00 0.04 0.00 0.00 61.00 62.33 1vig s PRO 46 Cb -0.26 -4.01 -0.00 0.00 0.04 0.00 0.00 34.50 30.27 1vig s PRO 46 CO -0.00 -1.43 -0.03 -1.00 0.04 0.00 0.00 177.00 174.59 1vig h PRO 47 N 10.62 0.00 -4.78 0.56 0.13 -1.97 -3.40 132.00 133.15 1vig h PRO 47 Ca -0.29 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.28 1vig h PRO 47 Cb 1.12 0.00 0.06 0.00 0.13 0.00 0.00 31.00 32.31 1vig h PRO 47 CO 1.05 0.00 1.77 -0.40 -0.23 0.00 0.00 178.00 180.19 1vig n ASP 48 N -3.27 2.12 -4.28 1.44 5.75 -1.26 -4.81 116.55 112.23 1vig n ASP 48 Ca -0.01 -2.62 -0.23 0.00 -0.01 0.00 0.00 54.79 51.92 1vig n ASP 48 Cb 0.04 -1.06 -0.09 0.00 -1.03 0.00 0.00 41.12 38.97 1vig n ASP 48 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1vig s SER 49 N 5.92 2.42 1.07 -1.12 0.01 -1.26 -5.15 113.70 115.58 1vig s SER 49 Ca 0.63 -1.52 -0.14 0.00 1.31 0.00 0.00 55.95 56.24 1vig s SER 49 Cb 0.12 0.23 0.21 0.00 0.21 0.00 0.00 66.02 66.79 1vig s SER 49 CO 0.19 -0.78 0.48 -1.84 0.41 0.00 0.00 173.24 171.70 1vig n GLU 50 N -0.77 -2.24 0.08 12.44 0.28 -1.26 -4.87 120.64 124.31 1vig n GLU 50 Ca -0.04 -0.80 -0.12 0.00 -0.16 0.00 0.00 57.16 56.04 1vig n GLU 50 Cb 0.66 -1.33 -0.05 0.00 1.43 0.00 0.00 31.44 32.14 1vig n GLU 50 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 1vig h LYS 51 N 0.00 -0.46 -6.92 3.44 1.57 -2.01 -3.41 116.57 108.78 1vig h LYS 51 Ca -0.22 0.03 -0.50 0.00 -1.87 0.00 0.00 60.65 58.09 1vig h LYS 51 Cb 0.73 0.10 0.04 0.00 0.08 0.00 0.00 32.23 33.18 1vig h LYS 51 CO 0.13 -0.30 0.47 0.45 -0.57 0.00 0.00 179.45 179.63 1vig s SER 52 N -4.83 6.73 0.16 0.86 0.15 -1.26 -5.03 113.70 110.47 1vig s SER 52 Ca -0.16 2.24 -0.12 0.00 0.70 0.00 0.00 55.95 58.62 1vig s SER 52 Cb 0.09 -2.61 -0.07 0.00 -1.71 0.00 0.00 66.02 61.72 1vig s SER 52 CO 0.65 -0.52 0.51 0.20 1.20 0.00 0.00 173.24 175.28 1vig s ASN 53 N -1.22 6.71 -0.31 5.45 0.01 0.28 -4.97 114.94 120.89 1vig s ASN 53 Ca 0.55 0.95 0.02 0.00 -0.71 0.00 0.00 52.86 53.67 1vig s ASN 53 Cb -0.28 -2.24 0.16 0.00 0.41 0.00 0.00 41.25 39.30 1vig s ASN 53 CO 0.36 0.06 0.40 -0.76 -1.51 0.00 0.00 177.10 175.65 1vig s LEU 54 N -2.23 -0.64 0.52 0.60 1.02 -1.26 -0.06 118.68 116.63 1vig s LEU 54 Ca 0.40 -0.63 -0.19 0.00 0.02 0.00 0.00 54.13 53.72 1vig s LEU 54 Cb -0.14 0.98 -0.07 0.00 0.02 0.00 0.00 46.19 46.99 1vig s LEU 54 CO 0.20 -0.34 1.05 -0.63 0.02 0.00 0.00 176.35 176.65 1vig s ILE 55 N 2.33 3.75 -0.07 -0.59 1.01 -0.11 -4.64 121.20 122.87 1vig s ILE 55 Ca 0.11 1.02 0.01 0.00 0.00 0.00 0.00 60.65 61.79 1vig s ILE 55 Cb -0.13 -3.42 -0.03 0.00 0.01 0.00 0.00 42.46 38.89 1vig s ILE 55 CO -0.26 -0.30 -0.08 -0.13 0.00 0.00 0.00 174.94 174.17 1vig s ARG 56 N -3.45 2.77 -0.08 2.79 0.52 -0.97 -0.26 118.95 120.27 1vig s ARG 56 Ca 0.67 -0.58 -0.02 0.00 -0.52 0.00 0.00 55.73 55.28 1vig s ARG 56 Cb -0.17 -2.57 0.04 0.00 0.52 0.00 0.00 34.95 32.77 1vig s ARG 56 CO 0.25 0.63 0.04 0.42 0.02 0.00 0.00 175.30 176.65 1vig s ILE 57 N -0.71 0.13 -0.02 1.52 -1.09 0.19 -1.53 121.20 119.69 1vig s ILE 57 Ca 0.11 0.17 -0.01 0.00 -2.23 0.00 0.00 60.65 58.68 1vig s ILE 57 Cb -0.11 -0.41 0.01 0.00 -1.58 0.00 0.00 42.46 40.36 1vig s ILE 57 CO 0.01 0.13 0.03 -0.70 -1.23 0.00 0.00 174.94 173.18 1vig s GLU 58 N 2.07 0.02 0.00 2.79 2.12 -0.97 0.45 118.70 125.17 1vig s GLU 58 Ca 0.04 0.08 0.00 0.00 0.36 0.00 0.00 54.97 55.46 1vig s GLU 58 Cb -0.13 -0.04 0.00 0.00 0.26 0.00 0.00 34.13 34.22 1vig s GLU 58 CO -0.05 -0.04 0.00 0.41 -0.54 0.00 0.00 175.26 175.04 1vig n GLY 59 N 3.33 4.16 1.51 -1.50 0.00 0.07 0.50 105.19 113.26 1vig n GLY 59 Ca -0.16 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 0.43 -2.01 1.61 -0.08 -1.26 -2.32 116.55 112.91 1vig n ASP 60 Ca 0.00 0.29 0.00 0.00 -1.51 0.00 0.00 54.79 53.57 1vig n ASP 60 Cb 0.00 0.03 0.00 0.00 2.34 0.00 0.00 41.12 43.49 1vig n ASP 60 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1vig n PRO 61 N -3.42 0.90 0.28 -0.67 -0.04 -1.26 -4.69 135.00 126.09 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 0.03 0.00 0.92 0.00 -0.04 0.00 0.00 33.50 34.40 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 -0.49 0.54 4.20 -1.99 -1.90 115.11 115.47 1vig h GLN 62 Ca 0.00 0.00 0.12 0.00 0.06 0.00 0.00 58.65 58.83 1vig h GLN 62 Cb 0.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1vig h GLN 62 CO 0.00 0.00 0.34 0.78 -0.67 0.00 0.00 178.83 179.28 1vig h GLY 63 N 0.00 0.18 0.78 3.46 0.00 -1.91 0.47 103.07 106.06 1vig h GLY 63 Ca 0.00 -0.05 -0.15 0.00 0.00 0.00 0.00 47.33 47.13 1vig h GLY 63 CO 0.00 0.03 -0.59 -0.24 0.00 0.00 0.00 176.54 175.73 1vig h VAL 64 N 0.12 1.43 0.00 4.60 3.04 -1.55 -1.61 116.25 122.28 1vig h VAL 64 Ca 0.23 -2.07 -0.13 0.00 -1.01 0.00 0.00 66.70 63.72 1vig h VAL 64 Cb 0.75 2.59 -0.02 0.00 -2.01 0.00 0.00 31.29 32.60 1vig h VAL 64 CO -0.03 0.60 -0.61 0.06 -1.01 0.00 0.00 177.57 176.59 1vig h GLN 65 N -0.11 0.00 -0.05 4.17 -0.00 -1.54 -0.38 115.11 117.20 1vig h GLN 65 Ca -0.07 0.00 -0.12 0.00 -0.00 0.00 0.00 58.65 58.45 1vig h GLN 65 Cb 1.31 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 28.79 1vig h GLN 65 CO 0.12 0.61 -0.44 0.37 -0.00 0.00 0.00 178.83 179.48 1vig h GLN 66 N 0.00 0.39 -0.32 0.06 5.75 -0.14 -2.64 115.11 118.21 1vig h GLN 66 Ca -0.01 -0.35 -0.17 0.00 -0.15 0.00 0.00 58.65 57.97 1vig h GLN 66 Cb 1.22 0.08 -0.00 0.00 1.07 0.00 0.00 27.48 29.85 1vig h GLN 66 CO 0.08 1.01 -0.47 0.00 -2.65 0.00 0.00 178.83 176.80 1vig h ALA 67 N 0.39 0.56 0.21 3.38 0.00 -1.31 -0.45 119.26 122.05 1vig h ALA 67 Ca -0.04 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.40 1vig h ALA 67 Cb 1.12 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1vig h ALA 67 CO 0.09 0.68 -0.31 -0.22 0.00 0.00 0.00 179.25 179.49 1vig h LYS 68 N 0.69 -0.57 -0.57 0.00 3.11 -1.11 -0.80 116.57 117.31 1vig h LYS 68 Ca 0.04 0.04 -0.06 0.00 -2.81 0.00 0.00 60.65 57.86 1vig h LYS 68 Cb 1.06 0.13 -0.02 0.00 -1.00 0.00 0.00 32.23 32.39 1vig h LYS 68 CO 0.11 -0.38 0.14 0.00 -2.81 0.00 0.00 179.45 176.50 1vig h ARG 69 N -0.59 0.91 -0.95 1.90 3.08 -1.49 -1.11 114.38 116.13 1vig h ARG 69 Ca 0.01 -0.22 0.20 0.00 0.07 0.00 0.00 59.98 60.04 1vig h ARG 69 Cb 0.58 -0.12 -0.08 0.00 0.08 0.00 0.00 29.97 30.43 1vig h ARG 69 CO -0.13 0.85 0.61 1.49 -1.07 0.00 0.00 179.97 181.73 1vig h GLU 70 N 0.82 0.53 0.17 0.04 4.57 -0.65 -1.25 114.58 118.81 1vig h GLU 70 Ca 0.18 -0.03 -0.26 0.00 -1.18 0.00 0.00 59.36 58.07 1vig h GLU 70 Cb 0.35 -0.12 0.02 0.00 -0.16 0.00 0.00 28.75 28.84 1vig h GLU 70 CO 0.00 0.35 -1.18 -0.07 -1.18 0.00 0.00 179.01 176.93 1vig h LEU 71 N 0.54 0.58 -1.99 1.64 3.38 -0.77 -0.27 115.31 118.43 1vig h LEU 71 Ca 0.52 -0.93 0.26 0.00 0.09 0.00 0.00 57.88 57.82 1vig h LEU 71 Cb 1.09 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.62 1vig h LEU 71 CO -0.26 1.55 0.65 0.25 0.09 0.00 0.00 178.44 180.73 1vig h LEU 72 N -0.18 0.00 0.00 1.67 6.46 -0.04 0.42 115.31 123.64 1vig h LEU 72 Ca -0.22 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.54 1vig h LEU 72 Cb 1.85 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.78 1vig h LEU 72 CO 0.18 0.00 -0.57 -1.84 -0.62 0.00 0.00 178.44 175.59 1vig n GLU 73 N -4.22 0.29 -0.02 1.25 0.28 -0.86 -4.77 120.64 112.59 1vig n GLU 73 Ca 0.18 0.11 -0.17 0.00 -0.16 0.00 0.00 57.16 57.13 1vig n GLU 73 Cb 0.97 -1.00 -0.08 0.00 1.43 0.00 0.00 31.44 32.76 1vig n GLU 73 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 1vig h LEU 74 N -0.54 0.84 -2.99 -1.84 3.38 -1.10 -3.49 115.31 109.58 1vig h LEU 74 Ca -0.01 -0.64 -0.22 0.00 0.09 0.00 0.00 57.88 57.10 1vig h LEU 74 Cb 0.56 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.07 1vig h LEU 74 CO -0.01 1.35 -0.77 0.00 0.09 0.00 0.00 178.44 179.10 1vig n ALA 75 N -2.59 -2.65 1.10 1.53 0.00 0.15 -4.96 120.51 113.09 1vig n ALA 75 Ca -0.08 0.46 0.12 0.00 0.00 0.00 0.00 53.44 53.94 1vig n ALA 75 Cb 0.71 -2.37 0.19 0.00 0.00 0.00 0.00 19.45 17.97 1vig n ALA 75 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93