#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 4.81 -0.22 9.51 0.01 -1.26 -5.00 114.94 122.79 1vig s ASN 7 Ca 0.00 -0.16 -0.16 0.00 -0.71 0.00 0.00 52.86 51.82 1vig s ASN 7 Cb 0.00 -1.80 -0.12 0.00 0.41 0.00 0.00 41.25 39.74 1vig s ASN 7 CO 0.00 0.12 -0.15 -1.14 -1.51 0.00 0.00 177.10 174.42 1vig n ARG 8 N 3.86 0.55 -3.65 -0.60 0.63 -1.26 -5.09 116.66 111.10 1vig n ARG 8 Ca -0.17 0.39 0.02 0.00 -0.92 0.00 0.00 57.85 57.17 1vig n ARG 8 Cb 0.52 -1.59 -0.00 0.00 0.45 0.00 0.00 32.46 31.84 1vig n ARG 8 CO 0.00 0.00 0.00 1.41 -2.51 0.00 0.00 177.63 176.53 1vig s MET 9 N -2.49 0.38 -0.17 -0.14 1.75 -1.26 -5.11 119.30 112.26 1vig s MET 9 Ca -0.31 -0.21 0.01 0.00 -1.25 0.00 0.00 55.69 53.93 1vig s MET 9 Cb 0.09 0.13 0.02 0.00 2.84 0.00 0.00 34.83 37.90 1vig s MET 9 CO 0.48 -0.17 -0.20 -0.51 -0.65 0.00 0.00 175.02 173.97 1vig s ASP 10 N -3.05 3.08 0.11 1.11 1.01 -1.01 -5.02 116.67 112.90 1vig s ASP 10 Ca 0.15 -0.63 0.08 0.00 0.71 0.00 0.00 52.55 52.87 1vig s ASP 10 Cb 0.05 -1.45 -0.04 0.00 1.01 0.00 0.00 42.92 42.49 1vig s ASP 10 CO -0.04 0.01 -0.21 -0.72 0.21 0.00 0.00 175.17 174.42 1vig s TYR 11 N 1.24 1.83 0.31 4.23 -0.85 -1.26 -0.44 117.35 122.41 1vig s TYR 11 Ca 0.03 -0.42 -0.17 0.00 -0.52 0.00 0.00 57.07 55.99 1vig s TYR 11 Cb -0.13 -0.99 0.02 0.00 0.38 0.00 0.00 41.96 41.24 1vig s TYR 11 CO -0.11 0.23 0.68 0.14 -1.52 0.00 0.00 175.55 174.97 1vig s VAL 12 N -1.27 0.00 -0.09 -3.49 -7.23 0.82 -4.97 120.40 104.17 1vig s VAL 12 Ca 0.08 -1.12 -0.17 0.00 -1.81 0.00 0.00 61.98 58.97 1vig s VAL 12 Cb -0.09 -2.34 0.04 0.00 0.56 0.00 0.00 36.38 34.54 1vig s VAL 12 CO 0.05 0.00 0.41 -1.83 -0.31 0.00 0.00 175.10 173.42 1vig s GLU 13 N -3.39 0.65 -0.13 4.82 -1.05 -1.26 0.68 118.70 119.01 1vig s GLU 13 Ca 0.16 0.23 -0.00 0.00 -0.15 0.00 0.00 54.97 55.20 1vig s GLU 13 Cb -0.04 0.30 -0.02 0.00 -0.44 0.00 0.00 34.13 33.93 1vig s GLU 13 CO 0.10 -0.15 -0.12 0.96 0.95 0.00 0.00 175.26 177.00 1vig s ILE 14 N -0.60 3.20 0.07 1.83 -4.36 -0.20 -4.95 121.20 116.18 1vig s ILE 14 Ca -0.07 -0.61 -0.31 0.00 -0.26 0.00 0.00 60.65 59.40 1vig s ILE 14 Cb -0.04 -2.35 -0.06 0.00 1.25 0.00 0.00 42.46 41.27 1vig s ILE 14 CO 0.03 0.53 1.25 0.20 0.24 0.00 0.00 174.94 177.19 1vig s ASN 15 N 0.23 7.01 0.08 4.36 -0.87 -1.26 -1.20 114.94 123.28 1vig s ASN 15 Ca -0.07 2.08 0.03 0.00 -1.57 0.00 0.00 52.86 53.33 1vig s ASN 15 Cb -0.15 -2.58 -0.03 0.00 -0.02 0.00 0.00 41.25 38.47 1vig s ASN 15 CO 0.05 -0.53 -0.09 -0.63 -2.57 0.00 0.00 177.10 173.33 1vig s ILE 16 N 1.17 0.73 0.14 0.60 -1.09 -0.87 -4.94 121.20 116.95 1vig s ILE 16 Ca 0.60 -1.49 0.00 0.00 -2.23 0.00 0.00 60.65 57.53 1vig s ILE 16 Cb -0.31 -1.15 0.00 0.00 -1.58 0.00 0.00 42.46 39.42 1vig s ILE 16 CO 0.29 -0.56 0.00 -0.67 -1.23 0.00 0.00 174.94 172.77 1vig n ASP 17 N 0.77 0.68 -3.03 3.58 2.03 -1.26 0.38 116.55 119.70 1vig n ASP 17 Ca -0.18 0.21 -0.02 0.00 0.52 0.00 0.00 54.79 55.33 1vig n ASP 17 Cb 0.57 -0.12 0.02 0.00 -0.72 0.00 0.00 41.12 40.87 1vig n ASP 17 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1vig n HIS 18 N -3.43 -1.54 -1.32 -0.67 8.25 -1.26 -4.61 115.22 110.64 1vig n HIS 18 Ca 0.00 -0.03 -0.23 0.00 -0.26 0.00 0.00 57.72 57.20 1vig n HIS 18 Cb 0.04 -0.10 -0.07 0.00 1.12 0.00 0.00 29.99 30.98 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 -1.56 2.24 -0.11 -0.41 5.02 -1.26 -4.59 118.16 117.50 1vig n LYS 19 Ca 0.01 -1.99 -0.09 0.00 -2.02 0.00 0.00 58.31 54.23 1vig n LYS 19 Cb 0.03 -2.04 -0.01 0.00 -0.02 0.00 0.00 35.03 32.99 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 2.80 0.45 0.00 2.13 -1.00 -1.98 -2.15 116.94 117.19 1vig h PHE 20 Ca 0.34 0.01 0.00 0.00 2.81 0.00 0.00 57.97 61.13 1vig h PHE 20 Cb 0.89 -0.15 0.00 0.00 3.61 0.00 0.00 35.95 40.30 1vig h PHE 20 CO 1.43 0.30 0.00 0.72 -1.61 0.00 0.00 178.31 179.15 1vig n HIS 21 N -4.83 0.00 -0.31 -0.55 8.25 -1.26 0.11 115.22 116.63 1vig n HIS 21 Ca -0.00 0.00 0.22 0.00 -0.26 0.00 0.00 57.72 57.67 1vig n HIS 21 Cb 0.03 -0.36 0.50 0.00 1.12 0.00 0.00 29.99 31.29 1vig n HIS 21 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1vig h ARG 22 N 0.00 0.40 -0.46 -0.41 2.43 -1.89 0.31 114.38 114.76 1vig h ARG 22 Ca 0.00 -0.02 -0.13 0.00 -0.81 0.00 0.00 59.98 59.02 1vig h ARG 22 Cb 0.00 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 1vig h ARG 22 CO 0.00 0.26 -0.21 0.45 -1.51 0.00 0.00 179.97 178.96 1vig h HIS 23 N 0.41 1.07 0.30 2.20 3.86 -0.61 0.61 115.15 122.98 1vig h HIS 23 Ca 0.58 -0.25 -0.01 0.00 -1.16 0.00 0.00 60.37 59.52 1vig h HIS 23 Cb 1.44 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 29.66 1vig h HIS 23 CO -0.00 1.05 -0.14 -0.07 0.86 0.00 0.00 177.93 179.63 1vig h LEU 24 N 0.81 -0.34 -1.76 2.43 4.07 0.43 -3.29 115.31 117.66 1vig h LEU 24 Ca 0.11 0.01 -0.03 0.00 0.08 0.00 0.00 57.88 58.05 1vig h LEU 24 Cb 0.77 0.09 -0.00 0.00 1.08 0.00 0.00 40.66 42.60 1vig h LEU 24 CO 0.06 0.10 -0.16 0.16 -1.08 0.00 0.00 178.44 177.53 1vig h ILE 25 N -1.08 0.68 0.00 1.22 3.07 -0.83 -3.34 117.51 117.23 1vig h ILE 25 Ca -0.04 -0.65 0.00 0.00 1.55 0.00 0.00 64.86 65.72 1vig h ILE 25 Cb 0.30 1.41 0.00 0.00 -0.27 0.00 0.00 36.82 38.26 1vig h ILE 25 CO 0.07 0.15 0.00 0.61 -1.05 0.00 0.00 178.15 177.93 1vig n GLY 26 N -0.63 1.87 1.79 0.16 0.00 0.21 -0.35 105.19 108.24 1vig n GLY 26 Ca -0.02 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 0.00 -0.43 1.61 5.02 -1.26 -4.72 118.16 118.38 1vig n LYS 27 Ca 0.00 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.37 1vig n LYS 27 Cb 0.00 -0.11 0.25 0.00 -0.02 0.00 0.00 35.03 35.16 1vig n LYS 27 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1vig n SER 28 N -2.73 3.86 -2.39 4.39 3.41 -1.24 -5.05 113.62 113.87 1vig n SER 28 Ca 0.00 -2.75 -0.01 0.00 -0.26 0.00 0.00 58.87 55.84 1vig n SER 28 Cb 0.09 -0.49 -0.01 0.00 -0.26 0.00 0.00 64.21 63.54 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 -0.11 -4.36 0.70 5.00 0.00 0.53 -5.02 105.19 101.94 1vig n GLY 29 Ca 0.20 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.63 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 1.90 2.41 -0.34 4.61 0.00 -1.19 -4.83 120.51 123.08 1vig n ALA 30 Ca -0.08 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.50 1vig n ALA 30 Cb 0.13 0.14 0.36 0.00 0.00 0.00 0.00 19.45 20.08 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 0.72 -0.89 0.00 4.21 -1.82 0.23 115.58 118.02 1vig h ASN 31 Ca 0.00 0.09 0.18 0.00 1.21 0.00 0.00 56.30 57.78 1vig h ASN 31 Cb 0.28 -0.04 -0.07 0.00 -1.12 0.00 0.00 38.32 37.38 1vig h ASN 31 CO 0.00 0.25 0.58 0.16 -1.29 0.00 0.00 177.43 177.13 1vig h ILE 32 N 0.69 0.73 0.01 2.81 3.07 -1.88 0.25 117.51 123.20 1vig h ILE 32 Ca 0.57 -0.18 -0.20 0.00 1.55 0.00 0.00 64.86 66.60 1vig h ILE 32 Cb 0.98 0.18 -0.01 0.00 -0.27 0.00 0.00 36.82 37.69 1vig h ILE 32 CO -0.35 0.09 -0.90 -1.13 -1.05 0.00 0.00 178.15 174.81 1vig h ASN 33 N 0.51 0.21 0.27 2.16 -0.73 -0.89 -2.62 115.58 114.51 1vig h ASN 33 Ca 0.46 -0.18 0.01 0.00 1.87 0.00 0.00 56.30 58.46 1vig h ASN 33 Cb 0.99 -0.07 -0.03 0.00 0.27 0.00 0.00 38.32 39.49 1vig h ASN 33 CO -0.20 1.01 -0.37 0.03 -0.37 0.00 0.00 177.43 177.53 1vig h ARG 34 N 0.08 -0.67 0.31 6.67 -0.00 -0.06 0.15 114.38 120.86 1vig h ARG 34 Ca -0.04 0.05 -0.02 0.00 -0.50 0.00 0.00 59.98 59.47 1vig h ARG 34 Cb 1.55 0.15 0.00 0.00 0.00 0.00 0.00 29.97 31.67 1vig h ARG 34 CO 0.13 -0.45 -0.15 0.82 0.00 0.00 0.00 179.97 180.33 1vig h ILE 35 N -0.70 0.72 -1.05 2.04 1.08 -1.53 0.43 117.51 118.51 1vig h ILE 35 Ca -0.01 -0.27 0.37 0.00 -0.39 0.00 0.00 64.86 64.56 1vig h ILE 35 Cb 0.66 0.87 -0.15 0.00 -3.07 0.00 0.00 36.82 35.13 1vig h ILE 35 CO -0.12 0.06 0.61 0.50 -0.69 0.00 0.00 178.15 178.50 1vig h LYS 36 N -0.56 0.19 0.00 2.37 3.11 -1.31 1.35 116.57 121.72 1vig h LYS 36 Ca -0.04 -0.01 -0.23 0.00 -2.81 0.00 0.00 60.65 57.55 1vig h LYS 36 Cb 0.41 -0.04 -0.04 0.00 -1.00 0.00 0.00 32.23 31.56 1vig h LYS 36 CO 0.07 0.12 -1.41 0.22 -2.81 0.00 0.00 179.45 175.65 1vig h ASP 37 N 0.19 0.00 0.08 4.20 3.58 -0.67 -1.04 116.42 122.77 1vig h ASP 37 Ca 0.78 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 58.23 1vig h ASP 37 Cb 1.98 0.00 0.00 0.00 1.72 0.00 0.00 39.33 43.03 1vig h ASP 37 CO -0.62 0.86 -0.04 -0.61 -2.88 0.00 0.00 179.24 175.95 1vig h GLN 38 N 0.00 -0.10 -0.19 0.28 5.75 0.58 -3.33 115.11 118.11 1vig h GLN 38 Ca -0.18 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.33 1vig h GLN 38 Cb 1.82 0.02 0.00 0.00 1.07 0.00 0.00 27.48 30.39 1vig h GLN 38 CO 0.08 -0.07 0.00 0.66 -2.65 0.00 0.00 178.83 176.85 1vig n TYR 39 N -2.76 0.25 -3.91 3.99 4.02 0.37 -4.90 117.16 114.23 1vig n TYR 39 Ca -0.01 -0.12 -0.25 0.00 -0.01 0.00 0.00 57.90 57.50 1vig n TYR 39 Cb 0.04 -0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.35 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 0.03 -3.87 -2.75 -0.72 4.81 -0.85 -4.45 118.16 110.36 1vig n LYS 40 Ca 0.06 0.47 -0.09 0.00 -0.87 0.00 0.00 58.31 57.89 1vig n LYS 40 Cb 0.15 -4.81 -0.02 0.00 0.02 0.00 0.00 35.03 30.37 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 -4.39 0.00 -3.60 3.15 0.24 -0.45 -4.77 118.33 108.52 1vig n VAL 41 Ca -0.25 -0.70 -0.29 0.00 -2.04 0.00 0.00 64.34 61.05 1vig n VAL 41 Cb 0.66 0.19 -0.14 0.00 -1.47 0.00 0.00 33.84 33.08 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 -1.78 3.48 0.17 -1.34 0.15 0.16 -4.13 113.70 110.40 1vig s SER 42 Ca 0.03 -1.96 -0.15 0.00 0.70 0.00 0.00 55.95 54.56 1vig s SER 42 Cb 0.00 -0.63 -0.07 0.00 -1.71 0.00 0.00 66.02 63.61 1vig s SER 42 CO 0.02 -0.35 0.59 0.54 1.20 0.00 0.00 173.24 175.23 1vig s VAL 43 N 1.26 4.79 -0.17 4.45 0.11 -1.26 -1.42 120.40 128.17 1vig s VAL 43 Ca 0.14 0.92 -0.03 0.00 -2.93 0.00 0.00 61.98 60.08 1vig s VAL 43 Cb -0.21 -3.76 0.05 0.00 -1.53 0.00 0.00 36.38 30.94 1vig s VAL 43 CO -0.13 0.23 0.05 -0.13 -3.33 0.00 0.00 175.10 171.78 1vig s ARG 44 N -1.98 0.44 -0.46 1.54 1.81 0.15 -4.96 118.95 115.48 1vig s ARG 44 Ca 0.39 -0.22 -0.24 0.00 -1.72 0.00 0.00 55.73 53.94 1vig s ARG 44 Cb -0.15 -1.82 0.03 0.00 -0.45 0.00 0.00 34.95 32.55 1vig s ARG 44 CO 0.19 -0.60 0.87 0.42 -0.68 0.00 0.00 175.30 175.51 1vig s ILE 45 N 1.97 4.54 -0.38 1.52 -1.09 -1.26 -1.59 121.20 124.91 1vig s ILE 45 Ca 0.01 0.60 -0.29 0.00 -2.23 0.00 0.00 60.65 58.74 1vig s ILE 45 Cb -0.16 -4.39 0.02 0.00 -1.58 0.00 0.00 42.46 36.35 1vig s ILE 45 CO -0.08 -0.79 1.20 -2.16 -1.23 0.00 0.00 174.94 171.88 1vig s PRO 46 N 3.56 3.84 -1.10 2.79 0.04 -1.26 -4.94 135.00 137.93 1vig s PRO 46 Ca 0.34 0.93 -0.20 0.00 0.04 0.00 0.00 61.00 62.11 1vig s PRO 46 Cb -0.11 -3.87 -0.06 0.00 0.04 0.00 0.00 34.50 30.49 1vig s PRO 46 CO 0.25 -1.22 1.96 -0.35 0.04 0.00 0.00 177.00 177.68 1vig n PRO 47 N 7.48 2.07 -0.04 0.56 -0.04 -1.26 -4.60 135.00 139.17 1vig n PRO 47 Ca 0.13 -2.40 -0.03 0.00 -0.04 0.00 0.00 63.50 61.16 1vig n PRO 47 Cb 0.48 -3.30 -0.01 0.00 -0.04 0.00 0.00 33.50 30.62 1vig n PRO 47 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1vig n ASP 48 N 9.21 1.09 -3.68 3.54 2.03 -1.26 -5.01 116.55 122.48 1vig n ASP 48 Ca 0.49 0.41 -0.22 0.00 0.52 0.00 0.00 54.79 55.99 1vig n ASP 48 Cb 0.43 -0.70 0.03 0.00 -0.72 0.00 0.00 41.12 40.16 1vig n ASP 48 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1vig n SER 49 N -3.66 -2.00 -0.05 1.67 2.88 -1.26 -4.92 113.62 106.27 1vig n SER 49 Ca -0.05 -0.85 -0.11 0.00 -1.33 0.00 0.00 58.87 56.54 1vig n SER 49 Cb 0.19 -3.99 -0.04 0.00 -0.75 0.00 0.00 64.21 59.62 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 -4.19 0.33 0.07 -1.46 2.13 -1.26 -5.06 120.64 111.20 1vig n GLU 50 Ca -0.26 0.14 0.00 0.00 0.66 0.00 0.00 57.16 57.70 1vig n GLU 50 Cb 0.66 -1.07 0.00 0.00 0.27 0.00 0.00 31.44 31.30 1vig n GLU 50 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1vig n LYS 51 N -3.94 0.00 -4.05 5.31 3.00 -1.26 -5.08 118.16 112.14 1vig n LYS 51 Ca -0.18 0.00 -0.32 0.00 -0.00 0.00 0.00 58.31 57.81 1vig n LYS 51 Cb 0.48 0.00 -0.15 0.00 0.00 0.00 0.00 35.03 35.36 1vig n LYS 51 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1vig s SER 52 N -2.08 4.58 1.11 3.14 0.15 -1.26 -4.88 113.70 114.46 1vig s SER 52 Ca 0.00 -1.68 -0.13 0.00 0.70 0.00 0.00 55.95 54.85 1vig s SER 52 Cb 0.00 -1.58 0.26 0.00 -1.71 0.00 0.00 66.02 62.98 1vig s SER 52 CO 0.00 -0.26 1.05 0.20 1.20 0.00 0.00 173.24 175.43 1vig s ASN 53 N 1.04 1.47 -0.45 5.45 0.01 0.16 -4.88 114.94 117.74 1vig s ASN 53 Ca -0.02 1.43 0.07 0.00 -0.71 0.00 0.00 52.86 53.63 1vig s ASN 53 Cb -0.20 -2.17 0.18 0.00 0.41 0.00 0.00 41.25 39.48 1vig s ASN 53 CO -0.06 -3.88 0.68 -0.76 -1.51 0.00 0.00 177.10 171.57 1vig s LEU 54 N -6.99 -1.46 0.62 0.60 1.02 -1.26 -2.04 118.68 109.16 1vig s LEU 54 Ca 0.67 -1.12 -0.19 0.00 0.02 0.00 0.00 54.13 53.51 1vig s LEU 54 Cb -0.23 1.89 -0.02 0.00 0.02 0.00 0.00 46.19 47.85 1vig s LEU 54 CO 0.62 -0.12 1.32 -0.63 0.02 0.00 0.00 176.35 177.56 1vig s ILE 55 N 1.47 2.04 -0.19 -0.59 1.01 -0.34 -4.68 121.20 119.92 1vig s ILE 55 Ca 0.21 0.03 0.01 0.00 0.00 0.00 0.00 60.65 60.90 1vig s ILE 55 Cb -0.02 -3.01 0.03 0.00 0.01 0.00 0.00 42.46 39.47 1vig s ILE 55 CO -0.06 -0.00 -0.17 -0.13 0.00 0.00 0.00 174.94 174.58 1vig s ARG 56 N -3.24 2.66 0.20 2.79 0.52 -0.62 -1.04 118.95 120.23 1vig s ARG 56 Ca 0.79 -0.90 0.08 0.00 -0.52 0.00 0.00 55.73 55.18 1vig s ARG 56 Cb -0.38 -2.56 -0.04 0.00 0.52 0.00 0.00 34.95 32.49 1vig s ARG 56 CO 0.42 -0.30 0.03 0.42 0.02 0.00 0.00 175.30 175.89 1vig s ILE 57 N 1.29 3.80 -0.28 1.52 1.09 0.21 0.32 121.20 129.15 1vig s ILE 57 Ca 0.02 -1.50 -0.22 0.00 -1.10 0.00 0.00 60.65 57.84 1vig s ILE 57 Cb -0.15 -2.96 0.12 0.00 -1.06 0.00 0.00 42.46 38.41 1vig s ILE 57 CO -0.11 -0.20 0.95 -0.70 -0.10 0.00 0.00 174.94 174.79 1vig s GLU 58 N -3.22 0.54 0.00 2.79 2.12 -0.51 -0.12 118.70 120.30 1vig s GLU 58 Ca 0.29 0.71 0.00 0.00 0.36 0.00 0.00 54.97 56.34 1vig s GLU 58 Cb -0.09 0.22 0.00 0.00 0.26 0.00 0.00 34.13 34.53 1vig s GLU 58 CO 0.20 -0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.25 1vig n GLY 59 N 2.76 2.83 2.06 -1.50 0.00 0.41 0.36 105.19 112.12 1vig n GLY 59 Ca -0.15 0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.11 -2.58 1.61 9.92 -1.26 -2.40 116.55 120.73 1vig n ASP 60 Ca 0.00 0.26 -0.04 0.00 -0.53 0.00 0.00 54.79 54.48 1vig n ASP 60 Cb 0.00 1.34 0.03 0.00 -0.64 0.00 0.00 41.12 41.85 1vig n ASP 60 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 1vig n PRO 61 N -2.79 -1.09 0.33 -0.24 -0.04 -1.26 -4.74 135.00 125.16 1vig n PRO 61 Ca 0.00 -0.24 0.19 0.00 -0.04 0.00 0.00 63.50 63.41 1vig n PRO 61 Cb 0.00 -0.21 0.99 0.00 -0.04 0.00 0.00 33.50 34.24 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 -0.64 0.54 4.20 -2.00 -2.42 115.11 114.79 1vig h GLN 62 Ca -0.06 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.77 1vig h GLN 62 Cb 0.17 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 27.86 1vig h GLN 62 CO 0.04 0.00 0.20 0.78 -0.67 0.00 0.00 178.83 179.17 1vig h GLY 63 N 0.00 0.88 0.96 3.46 0.00 -1.89 0.47 103.07 106.95 1vig h GLY 63 Ca 0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 1vig h GLY 63 CO -0.00 -0.08 0.20 -0.24 0.00 0.00 0.00 176.54 176.42 1vig h VAL 64 N 0.34 1.18 0.00 4.60 3.04 -1.65 0.77 116.25 124.54 1vig h VAL 64 Ca 0.34 -0.53 -0.09 0.00 -1.01 0.00 0.00 66.70 65.41 1vig h VAL 64 Cb 0.48 0.73 -0.01 0.00 -2.01 0.00 0.00 31.29 30.48 1vig h VAL 64 CO -0.38 0.20 -0.41 0.06 -1.01 0.00 0.00 177.57 176.04 1vig h GLN 65 N 0.56 0.00 0.29 4.17 3.07 -1.55 -1.65 115.11 120.00 1vig h GLN 65 Ca 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.87 1vig h GLN 65 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.69 1vig h GLN 65 CO -0.02 0.41 -0.14 0.37 0.09 0.00 0.00 178.83 179.54 1vig h GLN 66 N 0.00 -0.38 -0.41 0.06 4.15 0.39 -2.55 115.11 116.38 1vig h GLN 66 Ca -0.00 0.03 0.10 0.00 0.77 0.00 0.00 58.65 59.54 1vig h GLN 66 Cb 0.93 0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.68 1vig h GLN 66 CO 0.05 -0.25 0.29 0.00 -1.93 0.00 0.00 178.83 176.99 1vig h ALA 67 N -1.39 2.26 -2.01 3.38 0.00 -0.94 0.14 119.26 120.69 1vig h ALA 67 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1vig h ALA 67 Cb 0.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1vig h ALA 67 CO 0.07 -0.36 0.00 1.17 0.00 0.00 0.00 179.25 180.12 1vig n LYS 68 N -4.44 0.00 -0.25 0.00 4.81 -0.62 -0.97 118.16 116.68 1vig n LYS 68 Ca 0.06 0.16 0.28 0.00 -0.87 0.00 0.00 58.31 57.94 1vig n LYS 68 Cb 0.41 -1.10 0.66 0.00 0.02 0.00 0.00 35.03 35.02 1vig n LYS 68 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1vig h ARG 69 N 0.00 0.14 -0.54 1.64 3.08 -1.38 0.47 114.38 117.79 1vig h ARG 69 Ca 0.00 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 59.99 1vig h ARG 69 Cb 0.00 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1vig h ARG 69 CO 0.00 0.09 0.12 1.49 -1.07 0.00 0.00 179.97 180.60 1vig h GLU 70 N 0.14 0.83 -0.06 0.04 4.57 -0.67 -0.65 114.58 118.78 1vig h GLU 70 Ca 0.50 -0.18 -0.11 0.00 -1.18 0.00 0.00 59.36 58.39 1vig h GLU 70 Cb 1.72 -0.12 0.01 0.00 -0.16 0.00 0.00 28.75 30.20 1vig h GLU 70 CO -0.09 0.76 -0.40 -0.07 -1.18 0.00 0.00 179.01 178.03 1vig h LEU 71 N 0.80 0.47 -1.88 1.64 3.38 0.17 -0.28 115.31 119.61 1vig h LEU 71 Ca 0.17 -0.67 -0.03 0.00 0.09 0.00 0.00 57.88 57.45 1vig h LEU 71 Cb 0.31 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 1vig h LEU 71 CO 0.00 1.06 -0.13 0.25 0.09 0.00 0.00 178.44 179.72 1vig h LEU 72 N -0.10 0.00 0.00 1.67 6.46 -1.23 0.35 115.31 122.47 1vig h LEU 72 Ca -0.03 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.73 1vig h LEU 72 Cb 1.07 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.00 1vig h LEU 72 CO 0.08 0.13 0.00 -0.62 -0.62 0.00 0.00 178.44 177.41 1vig n GLU 73 N -3.67 0.00 0.05 1.25 -0.58 -0.26 -4.73 120.64 112.70 1vig n GLU 73 Ca -0.02 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.60 1vig n GLU 73 Cb 0.24 -0.19 -0.01 0.00 -0.57 0.00 0.00 31.44 30.91 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 0.55 0.16 -4.62 3.38 -1.27 -3.48 115.31 110.04 1vig h LEU 74 Ca 0.00 -0.39 -0.38 0.00 0.09 0.00 0.00 57.88 57.20 1vig h LEU 74 Cb 0.00 -0.17 0.09 0.00 0.09 0.00 0.00 40.66 40.67 1vig h LEU 74 CO 0.00 1.16 -0.59 0.00 0.09 0.00 0.00 178.44 179.10 1vig n ALA 75 N -2.53 -1.03 1.39 1.53 0.00 0.11 -4.98 120.51 114.99 1vig n ALA 75 Ca -0.06 0.32 0.14 0.00 0.00 0.00 0.00 53.44 53.84 1vig n ALA 75 Cb 0.76 -4.31 0.43 0.00 0.00 0.00 0.00 19.45 16.34 1vig n ALA 75 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95