#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 2.45 -4.56 4.38 0.23 -1.26 -5.05 115.26 111.45 1vig n ASN 7 Ca 0.00 -2.51 -0.41 0.00 -0.53 0.00 0.00 54.58 51.13 1vig n ASN 7 Cb 0.00 -0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 37.67 1vig n ASN 7 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1vig s ARG 8 N -3.74 3.19 0.15 -3.83 3.52 -1.26 -4.99 118.95 111.99 1vig s ARG 8 Ca 0.22 -0.06 -0.30 0.00 -0.13 0.00 0.00 55.73 55.46 1vig s ARG 8 Cb -0.02 -4.17 -0.07 0.00 -1.56 0.00 0.00 34.95 29.13 1vig s ARG 8 CO 0.14 -2.12 1.06 -1.64 -0.81 0.00 0.00 175.30 171.93 1vig s MET 9 N 5.73 4.62 -0.40 5.12 -1.94 -1.26 -4.91 119.30 126.26 1vig s MET 9 Ca 0.40 1.63 -0.20 0.00 -1.71 0.00 0.00 55.69 55.82 1vig s MET 9 Cb -0.08 -3.32 0.01 0.00 2.01 0.00 0.00 34.83 33.45 1vig s MET 9 CO 0.17 0.09 0.58 -0.51 -0.01 0.00 0.00 175.02 175.35 1vig s ASP 10 N 0.02 6.32 0.40 3.03 1.01 -0.92 -4.92 116.67 121.61 1vig s ASP 10 Ca 0.49 -0.21 0.08 0.00 0.71 0.00 0.00 52.55 53.62 1vig s ASP 10 Cb -0.27 -2.30 -0.02 0.00 1.01 0.00 0.00 42.92 41.34 1vig s ASP 10 CO 0.33 -0.64 0.40 -0.72 0.21 0.00 0.00 175.17 174.74 1vig s TYR 11 N 2.61 2.78 -0.29 4.23 -0.85 -1.26 -0.45 117.35 124.11 1vig s TYR 11 Ca 0.21 -0.43 -0.19 0.00 -0.52 0.00 0.00 57.07 56.14 1vig s TYR 11 Cb -0.15 -2.14 0.16 0.00 0.38 0.00 0.00 41.96 40.21 1vig s TYR 11 CO 0.16 -0.12 1.09 0.54 -1.52 0.00 0.00 175.55 175.70 1vig s VAL 12 N -2.41 0.00 -0.16 -3.49 0.11 0.16 -4.92 120.40 109.69 1vig s VAL 12 Ca 0.48 0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 59.48 1vig s VAL 12 Cb -0.05 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.76 1vig s VAL 12 CO 0.29 0.00 0.02 -1.83 -3.33 0.00 0.00 175.10 170.25 1vig s GLU 13 N 0.90 3.75 -0.06 1.54 -1.05 -1.26 -1.59 118.70 120.93 1vig s GLU 13 Ca -0.04 -0.41 0.04 0.00 -0.15 0.00 0.00 54.97 54.41 1vig s GLU 13 Cb -0.04 -3.06 -0.02 0.00 -0.44 0.00 0.00 34.13 30.58 1vig s GLU 13 CO -0.12 0.32 -0.19 0.96 0.95 0.00 0.00 175.26 177.18 1vig s ILE 14 N 0.20 2.65 -0.33 1.83 -4.36 -0.99 -4.99 121.20 115.22 1vig s ILE 14 Ca 0.02 -0.86 -0.25 0.00 -0.26 0.00 0.00 60.65 59.29 1vig s ILE 14 Cb -0.13 -2.02 0.01 0.00 1.25 0.00 0.00 42.46 41.57 1vig s ILE 14 CO 0.01 0.57 0.89 0.21 0.24 0.00 0.00 174.94 176.87 1vig s ASN 15 N -0.39 6.73 0.15 4.36 3.04 -1.26 -1.66 114.94 125.91 1vig s ASN 15 Ca 0.04 0.72 0.10 0.00 0.04 0.00 0.00 52.86 53.75 1vig s ASN 15 Cb -0.12 -2.45 -0.04 0.00 -1.54 0.00 0.00 41.25 37.09 1vig s ASN 15 CO 0.02 -0.75 -0.23 -0.63 -3.04 0.00 0.00 177.10 172.47 1vig s ILE 16 N 3.26 2.12 -0.37 -5.21 -1.09 0.12 -5.00 121.20 115.03 1vig s ILE 16 Ca 0.37 -1.85 -0.04 0.00 -2.23 0.00 0.00 60.65 56.90 1vig s ILE 16 Cb -0.13 -1.94 0.19 0.00 -1.58 0.00 0.00 42.46 39.01 1vig s ILE 16 CO 0.15 -0.08 0.96 1.51 -1.23 0.00 0.00 174.94 176.25 1vig s ASP 17 N -2.36 -0.64 0.00 3.58 1.47 -1.26 -1.72 116.67 115.74 1vig s ASP 17 Ca 0.15 -0.50 0.00 0.00 1.18 0.00 0.00 52.55 53.38 1vig s ASP 17 Cb -0.09 0.83 0.00 0.00 -0.34 0.00 0.00 42.92 43.32 1vig s ASP 17 CO 0.07 -0.05 0.00 1.57 0.68 0.00 0.00 175.17 177.44 1vig n HIS 18 N 3.39 0.00 -2.21 2.11 -0.00 -1.26 -4.94 115.22 112.31 1vig n HIS 18 Ca 0.10 0.00 -0.14 0.00 0.46 0.00 0.00 57.72 58.14 1vig n HIS 18 Cb 0.62 0.00 -0.02 0.00 -0.12 0.00 0.00 29.99 30.47 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 0.00 -1.94 0.06 1.57 4.01 -1.26 -4.85 118.16 115.75 1vig n LYS 19 Ca 0.00 0.71 -0.13 0.00 -0.51 0.00 0.00 58.31 58.38 1vig n LYS 19 Cb 0.00 -5.25 -0.09 0.00 -0.51 0.00 0.00 35.03 29.18 1vig n LYS 19 CO 0.00 0.00 0.00 0.74 -1.11 0.00 0.00 177.40 177.03 1vig h PHE 20 N 0.00 -0.15 -0.14 2.13 -1.00 -1.96 -2.13 116.94 113.69 1vig h PHE 20 Ca -0.32 -0.00 0.02 0.00 2.81 0.00 0.00 57.97 60.47 1vig h PHE 20 Cb 1.17 0.05 -0.03 0.00 3.61 0.00 0.00 35.95 40.75 1vig h PHE 20 CO 0.61 0.18 -0.22 0.45 -1.61 0.00 0.00 178.31 177.72 1vig h HIS 21 N -0.48 -0.66 -0.99 -0.55 3.86 -1.98 0.97 115.15 115.32 1vig h HIS 21 Ca -0.02 0.03 0.15 0.00 -1.16 0.00 0.00 60.37 59.38 1vig h HIS 21 Cb 0.39 0.31 -0.10 0.00 1.06 0.00 0.00 27.41 29.07 1vig h HIS 21 CO 0.03 -0.20 0.60 -0.09 0.86 0.00 0.00 177.93 179.14 1vig h ARG 22 N -0.17 0.84 -0.07 2.45 9.65 -1.97 0.46 114.38 125.56 1vig h ARG 22 Ca 0.02 -0.05 -0.07 0.00 -1.10 0.00 0.00 59.98 58.79 1vig h ARG 22 Cb 0.24 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 28.62 1vig h ARG 22 CO -0.22 0.55 -0.27 0.45 2.80 0.00 0.00 179.97 183.28 1vig h HIS 23 N 0.86 0.14 0.00 2.20 3.86 -0.44 -0.91 115.15 120.85 1vig h HIS 23 Ca 0.53 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.71 1vig h HIS 23 Cb 0.68 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 29.11 1vig h HIS 23 CO -0.01 0.39 -0.11 -0.07 0.86 0.00 0.00 177.93 178.99 1vig h LEU 24 N 0.12 0.00 -2.21 2.43 3.38 0.41 -3.33 115.31 116.11 1vig h LEU 24 Ca 0.02 -0.07 0.06 0.00 0.09 0.00 0.00 57.88 57.98 1vig h LEU 24 Cb 0.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1vig h LEU 24 CO 0.04 0.59 0.24 0.16 0.09 0.00 0.00 178.44 179.56 1vig h ILE 25 N -1.00 0.38 -5.60 1.22 3.07 -0.32 -3.39 117.51 111.87 1vig h ILE 25 Ca -0.01 0.00 -0.16 0.00 1.55 0.00 0.00 64.86 66.25 1vig h ILE 25 Cb 0.17 0.80 0.07 0.00 -0.27 0.00 0.00 36.82 37.59 1vig h ILE 25 CO -0.00 0.00 -0.44 0.61 -1.05 0.00 0.00 178.15 177.27 1vig n GLY 26 N -1.38 -1.20 5.00 0.16 0.00 -0.35 0.62 105.19 108.04 1vig n GLY 26 Ca 0.02 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.55 1vig n GLY 26 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1vig n LYS 27 N -2.52 0.00 0.00 1.61 0.00 -1.23 -4.15 118.16 111.88 1vig n LYS 27 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.25 1vig n LYS 27 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.59 1vig n LYS 27 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1vig n SER 28 N 1.98 0.00 0.00 3.14 3.41 -1.22 -5.07 113.62 115.86 1vig n SER 28 Ca 0.00 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 1vig n SER 28 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 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 2.45 -0.11 0.02 5.00 0.00 0.20 -4.92 105.19 107.83 1vig n GLY 29 Ca 0.00 -0.26 0.02 0.00 0.00 0.00 0.00 46.02 45.79 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 2.21 -0.24 4.61 0.00 -1.21 -4.51 120.51 121.36 1vig n ALA 30 Ca 0.00 -0.43 0.25 0.00 0.00 0.00 0.00 53.44 53.26 1vig n ALA 30 Cb 0.00 -0.27 0.62 0.00 0.00 0.00 0.00 19.45 19.80 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 0.21 -0.84 0.00 2.35 -1.79 0.36 115.58 115.88 1vig h ASN 31 Ca -0.10 0.03 0.19 0.00 -0.55 0.00 0.00 56.30 55.87 1vig h ASN 31 Cb 0.92 -0.01 -0.06 0.00 0.05 0.00 0.00 38.32 39.23 1vig h ASN 31 CO 0.01 0.07 0.56 0.16 -1.65 0.00 0.00 177.43 176.57 1vig h ILE 32 N 0.20 0.71 0.08 2.81 3.07 -1.87 0.24 117.51 122.75 1vig h ILE 32 Ca 0.49 -0.13 -0.26 0.00 1.55 0.00 0.00 64.86 66.52 1vig h ILE 32 Cb 1.56 0.31 -0.01 0.00 -0.27 0.00 0.00 36.82 38.42 1vig h ILE 32 CO -0.12 0.07 -1.20 -1.13 -1.05 0.00 0.00 178.15 174.72 1vig h ASN 33 N 0.37 0.27 -0.20 2.16 -0.00 -0.60 -2.47 115.58 115.10 1vig h ASN 33 Ca 0.42 -0.30 0.06 0.00 -0.00 0.00 0.00 56.30 56.48 1vig h ASN 33 Cb 1.09 -0.09 -0.06 0.00 -0.00 0.00 0.00 38.32 39.26 1vig h ASN 33 CO -0.14 1.23 -0.21 -0.09 -0.00 0.00 0.00 177.43 178.22 1vig h ARG 34 N 0.05 -0.22 0.03 6.67 2.43 -0.31 0.16 114.38 123.19 1vig h ARG 34 Ca -0.11 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1vig h ARG 34 Cb 1.91 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 31.51 1vig h ARG 34 CO 0.17 -0.15 -0.01 0.82 -1.51 0.00 0.00 179.97 179.29 1vig h ILE 35 N -0.23 1.39 -1.34 1.20 5.03 -1.53 -0.13 117.51 121.90 1vig h ILE 35 Ca 0.12 -1.41 0.39 0.00 -0.12 0.00 0.00 64.86 63.84 1vig h ILE 35 Cb 0.42 2.33 -0.05 0.00 -3.03 0.00 0.00 36.82 36.48 1vig h ILE 35 CO -0.34 0.35 0.98 0.50 -0.68 0.00 0.00 178.15 178.97 1vig h LYS 36 N -0.66 0.00 0.00 2.37 3.11 -1.20 1.44 116.57 121.63 1vig h LYS 36 Ca -0.00 0.00 -0.30 0.00 -2.81 0.00 0.00 60.65 57.54 1vig h LYS 36 Cb 0.61 0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 31.79 1vig h LYS 36 CO 0.01 0.00 -1.92 -3.47 -2.81 0.00 0.00 179.45 171.25 1vig n ASP 37 N -4.08 0.54 -0.01 4.20 2.03 0.55 -2.52 116.55 117.26 1vig n ASP 37 Ca 0.29 0.25 -0.00 0.00 0.52 0.00 0.00 54.79 55.85 1vig n ASP 37 Cb 1.41 0.40 -0.00 0.00 -0.72 0.00 0.00 41.12 42.21 1vig n ASP 37 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 1vig h GLN 38 N 0.00 -0.03 -0.03 -0.67 5.75 0.30 -3.35 115.11 117.08 1vig h GLN 38 Ca -0.36 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.15 1vig h GLN 38 Cb 2.02 0.01 0.00 0.00 1.07 0.00 0.00 27.48 30.57 1vig h GLN 38 CO 0.06 -0.02 0.00 0.66 -2.65 0.00 0.00 178.83 176.88 1vig n TYR 39 N -3.02 0.04 -3.83 3.99 4.02 0.41 -4.91 117.16 113.86 1vig n TYR 39 Ca -0.00 -0.02 -0.23 0.00 -0.01 0.00 0.00 57.90 57.63 1vig n TYR 39 Cb 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.33 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 -0.57 -4.02 -2.56 -0.72 0.00 -1.09 -4.36 118.16 104.84 1vig n LYS 40 Ca 0.15 0.51 -0.06 0.00 0.00 0.00 0.00 58.31 58.91 1vig n LYS 40 Cb 0.13 -4.83 -0.02 0.00 0.00 0.00 0.00 35.03 30.32 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 -4.34 0.00 -3.74 3.15 0.24 -1.05 -4.75 118.33 107.85 1vig n VAL 41 Ca -0.31 -0.54 -0.30 0.00 -2.04 0.00 0.00 64.34 61.15 1vig n VAL 41 Cb 0.68 0.18 -0.13 0.00 -1.47 0.00 0.00 33.84 33.10 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 -1.59 3.74 -0.05 -1.34 0.15 0.11 -4.07 113.70 110.66 1vig s SER 42 Ca 0.04 -2.65 -0.15 0.00 0.70 0.00 0.00 55.95 53.88 1vig s SER 42 Cb 0.00 -1.11 -0.05 0.00 -1.71 0.00 0.00 66.02 63.15 1vig s SER 42 CO 0.03 -0.27 0.41 -0.69 1.20 0.00 0.00 173.24 173.92 1vig s VAL 43 N 0.30 5.10 -0.04 4.45 1.01 -1.26 -1.94 120.40 128.03 1vig s VAL 43 Ca 0.17 0.82 0.01 0.00 0.00 0.00 0.00 61.98 62.99 1vig s VAL 43 Cb -0.25 -3.72 0.02 0.00 0.00 0.00 0.00 36.38 32.43 1vig s VAL 43 CO 0.00 0.50 -0.05 -0.13 0.00 0.00 0.00 175.10 175.42 1vig s ARG 44 N -0.50 0.75 -0.48 2.72 0.52 0.09 -4.81 118.95 117.24 1vig s ARG 44 Ca 0.23 -0.12 -0.14 0.00 -0.52 0.00 0.00 55.73 55.18 1vig s ARG 44 Cb -0.16 -0.76 0.09 0.00 0.52 0.00 0.00 34.95 34.65 1vig s ARG 44 CO 0.11 -0.04 0.40 0.42 0.02 0.00 0.00 175.30 176.21 1vig s ILE 45 N 0.73 4.99 -0.40 1.52 -1.09 -1.26 -2.01 121.20 123.67 1vig s ILE 45 Ca -0.10 -1.31 -0.29 0.00 -2.23 0.00 0.00 60.65 56.73 1vig s ILE 45 Cb -0.13 -4.08 0.01 0.00 -1.58 0.00 0.00 42.46 36.68 1vig s ILE 45 CO 0.00 -0.67 1.36 -2.16 -1.23 0.00 0.00 174.94 172.24 1vig s PRO 46 N 1.57 3.64 0.37 2.79 0.04 -1.26 -5.01 135.00 137.15 1vig s PRO 46 Ca 0.04 0.93 -0.25 0.00 0.04 0.00 0.00 61.00 61.76 1vig s PRO 46 Cb -0.26 -3.99 -0.09 0.00 0.04 0.00 0.00 34.50 30.20 1vig s PRO 46 CO 0.04 -1.48 1.07 -1.25 0.04 0.00 0.00 177.00 175.42 1vig s PRO 47 N 4.76 4.27 0.50 0.56 0.04 -1.26 -4.79 135.00 139.07 1vig s PRO 47 Ca 0.59 1.60 0.00 0.00 0.04 0.00 0.00 61.00 63.22 1vig s PRO 47 Cb -0.13 -2.70 0.00 0.00 0.04 0.00 0.00 34.50 31.71 1vig s PRO 47 CO 0.31 -0.07 0.00 -0.40 0.04 0.00 0.00 177.00 176.88 1vig n ASP 48 N 0.23 -8.58 -3.52 6.66 5.75 -1.26 -5.08 116.55 110.74 1vig n ASP 48 Ca 0.04 1.23 -0.11 0.00 -0.01 0.00 0.00 54.79 55.94 1vig n ASP 48 Cb 0.48 -4.72 -0.03 0.00 -1.03 0.00 0.00 41.12 35.83 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 -3.20 -0.46 -0.16 -1.12 0.01 -1.26 -5.05 113.70 102.45 1vig s SER 49 Ca 0.00 -0.15 -0.13 0.00 1.31 0.00 0.00 55.95 56.98 1vig s SER 49 Cb 0.00 0.59 -0.08 0.00 0.21 0.00 0.00 66.02 66.74 1vig s SER 49 CO 0.00 -1.00 -0.06 1.21 0.41 0.00 0.00 173.24 173.80 1vig n GLU 50 N -0.36 0.49 -3.99 12.44 2.13 -1.26 -4.84 120.64 125.24 1vig n GLU 50 Ca -0.15 0.54 -0.33 0.00 0.66 0.00 0.00 57.16 57.89 1vig n GLU 50 Cb 0.64 -1.71 -0.14 0.00 0.27 0.00 0.00 31.44 30.50 1vig n GLU 50 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1vig s LYS 51 N -2.28 1.97 0.37 5.31 1.02 -1.26 -5.05 119.74 119.82 1vig s LYS 51 Ca -0.19 -1.58 0.00 0.00 0.02 0.00 0.00 55.97 54.22 1vig s LYS 51 Cb 0.03 -3.13 0.00 0.00 -0.52 0.00 0.00 37.83 34.22 1vig s LYS 51 CO 0.34 -0.76 0.00 0.43 -0.92 0.00 0.00 175.35 174.43 1vig n SER 52 N 4.41 -6.41 -4.88 2.83 7.64 -1.26 -4.82 113.62 111.14 1vig n SER 52 Ca -0.06 0.78 -0.37 0.00 1.01 0.00 0.00 58.87 60.23 1vig n SER 52 Cb 0.42 -3.89 -0.06 0.00 -1.01 0.00 0.00 64.21 59.68 1vig n SER 52 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1vig s ASN 53 N -6.13 6.44 -0.30 6.43 0.01 -0.70 -4.82 114.94 115.88 1vig s ASN 53 Ca 0.00 0.52 -0.01 0.00 -0.71 0.00 0.00 52.86 52.66 1vig s ASN 53 Cb 0.00 -2.09 0.10 0.00 0.41 0.00 0.00 41.25 39.67 1vig s ASN 53 CO 0.00 0.38 0.10 -0.76 -1.51 0.00 0.00 177.10 175.30 1vig s LEU 54 N -1.16 1.90 0.31 0.60 1.02 -1.26 0.13 118.68 120.21 1vig s LEU 54 Ca 0.18 -1.51 -0.29 0.00 0.02 0.00 0.00 54.13 52.53 1vig s LEU 54 Cb -0.13 -0.77 -0.10 0.00 0.02 0.00 0.00 46.19 45.22 1vig s LEU 54 CO 0.07 -0.41 1.17 -0.63 0.02 0.00 0.00 176.35 176.58 1vig s ILE 55 N 1.71 3.20 -0.34 -0.59 1.01 -0.66 -4.65 121.20 120.87 1vig s ILE 55 Ca 0.09 1.20 -0.13 0.00 0.00 0.00 0.00 60.65 61.81 1vig s ILE 55 Cb -0.17 -3.76 -0.01 0.00 0.01 0.00 0.00 42.46 38.53 1vig s ILE 55 CO -0.25 0.28 0.24 -0.13 0.00 0.00 0.00 174.94 175.07 1vig s ARG 56 N -1.62 3.42 0.00 2.79 0.52 -0.85 -2.33 118.95 120.87 1vig s ARG 56 Ca 0.47 -0.70 0.07 0.00 -0.52 0.00 0.00 55.73 55.06 1vig s ARG 56 Cb -0.34 -3.80 -0.03 0.00 0.52 0.00 0.00 34.95 31.30 1vig s ARG 56 CO 0.45 -0.48 -0.23 0.42 0.02 0.00 0.00 175.30 175.49 1vig s ILE 57 N 1.70 2.37 -0.28 1.52 -1.09 -0.62 -0.73 121.20 124.07 1vig s ILE 57 Ca 0.06 -1.13 -0.21 0.00 -2.23 0.00 0.00 60.65 57.14 1vig s ILE 57 Cb -0.18 -1.90 0.13 0.00 -1.58 0.00 0.00 42.46 38.93 1vig s ILE 57 CO 0.10 0.48 0.99 -0.70 -1.23 0.00 0.00 174.94 174.58 1vig s GLU 58 N -0.94 0.47 0.00 2.79 2.12 -0.82 0.37 118.70 122.69 1vig s GLU 58 Ca 0.11 0.67 0.00 0.00 0.36 0.00 0.00 54.97 56.11 1vig s GLU 58 Cb -0.10 0.17 0.00 0.00 0.26 0.00 0.00 34.13 34.46 1vig s GLU 58 CO 0.01 -0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.07 1vig n GLY 59 N 2.96 1.80 0.60 -1.50 0.00 0.40 0.07 105.19 109.53 1vig n GLY 59 Ca -0.15 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.52 -2.81 1.61 8.00 -1.26 -2.17 116.55 119.39 1vig n ASP 60 Ca 0.00 0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.76 1vig n ASP 60 Cb 0.00 0.71 0.00 0.00 -0.02 0.00 0.00 41.12 41.81 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 -2.34 -0.03 0.12 -0.24 -0.04 -1.26 -4.72 135.00 126.49 1vig n PRO 61 Ca 0.00 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.56 1vig n PRO 61 Cb 0.00 0.00 0.47 0.00 -0.04 0.00 0.00 33.50 33.93 1vig n PRO 61 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1vig n GLN 62 N -0.80 0.13 -0.25 0.54 6.02 -1.26 -2.55 117.38 119.21 1vig n GLN 62 Ca 0.00 0.53 -0.05 0.00 -0.01 0.00 0.00 57.00 57.46 1vig n GLN 62 Cb 0.00 -1.85 0.05 0.00 1.02 0.00 0.00 30.24 29.46 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 0.90 0.99 0.80 1.08 0.00 -1.89 0.36 103.07 105.31 1vig h GLY 63 Ca 0.00 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 1vig h GLY 63 CO 0.00 0.39 -0.01 -0.24 0.00 0.00 0.00 176.54 176.68 1vig h VAL 64 N 0.93 1.12 -0.02 4.60 3.04 -1.69 0.30 116.25 124.54 1vig h VAL 64 Ca 0.25 -0.46 -0.09 0.00 -1.01 0.00 0.00 66.70 65.38 1vig h VAL 64 Cb -0.05 1.44 -0.01 0.00 -2.01 0.00 0.00 31.29 30.66 1vig h VAL 64 CO -0.05 0.12 -0.42 0.06 -1.01 0.00 0.00 177.57 176.27 1vig h GLN 65 N -0.24 0.04 0.31 4.17 -0.00 -1.68 -0.30 115.11 117.42 1vig h GLN 65 Ca -0.00 -0.02 -0.02 0.00 -0.00 0.00 0.00 58.65 58.61 1vig h GLN 65 Cb 0.22 -0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.70 1vig h GLN 65 CO 0.01 0.46 -0.15 1.96 -0.00 0.00 0.00 178.83 181.10 1vig h GLN 66 N 0.03 -0.40 -0.50 0.06 1.08 -0.06 -2.55 115.11 112.78 1vig h GLN 66 Ca -0.00 0.03 0.13 0.00 -1.45 0.00 0.00 58.65 57.36 1vig h GLN 66 Cb 0.76 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.26 1vig h GLN 66 CO 0.06 -0.27 0.35 0.00 -0.95 0.00 0.00 178.83 178.02 1vig h ALA 67 N -1.47 2.37 -1.85 3.87 0.00 -0.44 -0.11 119.26 121.62 1vig h ALA 67 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1vig h ALA 67 Cb 0.32 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1vig h ALA 67 CO 0.07 -0.50 0.00 1.17 0.00 0.00 0.00 179.25 179.98 1vig n LYS 68 N -4.41 0.00 -0.00 0.00 4.81 -0.12 0.00 118.16 118.43 1vig n LYS 68 Ca 0.09 0.20 0.23 0.00 -0.87 0.00 0.00 58.31 57.96 1vig n LYS 68 Cb 0.52 -1.19 0.70 0.00 0.02 0.00 0.00 35.03 35.08 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 0.00 -0.18 1.64 2.43 -1.31 0.24 114.38 117.20 1vig h ARG 69 Ca 0.00 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 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 0.00 -0.27 1.49 -1.51 0.00 0.00 179.97 179.68 1vig h GLU 70 N 0.00 0.50 -0.21 0.20 4.57 -0.79 -3.19 114.58 115.66 1vig h GLU 70 Ca 0.28 -0.30 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1vig h GLU 70 Cb 1.48 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 30.09 1vig h GLU 70 CO -0.00 0.90 0.12 -0.07 -1.18 0.00 0.00 179.01 178.77 1vig h LEU 71 N 0.16 0.25 -1.82 1.64 3.38 0.30 0.50 115.31 119.73 1vig h LEU 71 Ca 0.02 -0.06 0.13 0.00 0.09 0.00 0.00 57.88 58.05 1vig h LEU 71 Cb 0.85 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 1vig h LEU 71 CO 0.06 0.24 0.55 -0.07 0.09 0.00 0.00 178.44 179.31 1vig h LEU 72 N 0.24 0.00 0.00 1.67 3.38 -1.46 0.13 115.31 119.28 1vig h LEU 72 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1vig h LEU 72 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1vig h LEU 72 CO -0.01 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.90 1vig n GLU 73 N -3.51 0.00 -0.12 1.13 4.71 -0.74 -4.76 120.64 117.35 1vig n GLU 73 Ca 0.08 0.00 0.16 0.00 -0.01 0.00 0.00 57.16 57.39 1vig n GLU 73 Cb 0.72 0.00 0.55 0.00 -1.01 0.00 0.00 31.44 31.70 1vig n GLU 73 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 1vig h LEU 74 N 0.00 0.30 -0.13 -4.62 3.38 -0.14 -3.45 115.31 110.64 1vig h LEU 74 Ca 0.00 0.02 -0.43 0.00 0.09 0.00 0.00 57.88 57.56 1vig h LEU 74 Cb 0.00 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 1vig h LEU 74 CO 0.00 0.16 -0.67 0.00 0.09 0.00 0.00 178.44 178.02 1vig n ALA 75 N -2.55 -1.16 -0.35 1.53 0.00 0.46 -4.96 120.51 113.47 1vig n ALA 75 Ca 0.13 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1vig n ALA 75 Cb 0.54 -4.09 0.00 0.00 0.00 0.00 0.00 19.45 15.90 1vig n ALA 75 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95