#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vb7 s SER 2 N 0.00 4.04 -0.10 1.61 0.01 -1.26 -5.09 113.70 112.91 1vb7 s SER 2 Ca 0.00 0.77 -0.30 0.00 1.31 0.00 0.00 55.95 57.74 1vb7 s SER 2 Cb 0.00 -1.24 0.11 0.00 0.21 0.00 0.00 66.02 65.10 1vb7 s SER 2 CO 0.00 -2.20 0.91 -0.55 0.41 0.00 0.00 173.24 171.81 1vb7 s SER 3 N -4.45 -0.42 0.00 2.44 0.15 -1.26 -5.13 113.70 105.03 1vb7 s SER 3 Ca 0.64 0.36 0.00 0.00 0.70 0.00 0.00 55.95 57.65 1vb7 s SER 3 Cb -0.11 0.37 0.00 0.00 -1.71 0.00 0.00 66.02 64.57 1vb7 s SER 3 CO 0.51 -0.46 0.00 0.61 1.20 0.00 0.00 173.24 175.09 1vb7 n GLY 4 N 0.52 -0.21 5.00 9.45 0.00 -1.26 -4.94 105.19 113.75 1vb7 n GLY 4 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1vb7 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1vb7 n SER 5 N -0.60 0.00 -2.66 1.61 2.88 -1.26 -4.76 113.62 108.83 1vb7 n SER 5 Ca 0.00 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.50 1vb7 n SER 5 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 1vb7 n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1vb7 n SER 6 N 3.40 -2.57 0.00 -3.46 7.64 -1.26 -5.03 113.62 112.35 1vb7 n SER 6 Ca 0.00 1.35 0.00 0.00 1.01 0.00 0.00 58.87 61.23 1vb7 n SER 6 Cb 0.00 -5.10 0.00 0.00 -1.01 0.00 0.00 64.21 58.10 1vb7 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vb7 n GLY 7 N 1.51 3.75 3.50 0.23 0.00 -1.26 -4.87 105.19 108.05 1vb7 n GLY 7 Ca -0.30 -1.11 -0.25 0.00 0.00 0.00 0.00 46.02 44.35 1vb7 n GLY 7 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1vb7 s LEU 8 N 0.00 2.72 0.28 0.99 0.20 0.10 -4.92 118.68 118.05 1vb7 s LEU 8 Ca 0.00 -0.81 0.08 0.00 0.69 0.00 0.00 54.13 54.09 1vb7 s LEU 8 Cb 0.00 -1.34 -0.04 0.00 -0.43 0.00 0.00 46.19 44.38 1vb7 s LEU 8 CO 0.00 0.08 0.13 -0.89 -0.29 0.00 0.00 176.35 175.38 1vb7 s THR 9 N -2.01 3.73 0.07 3.68 2.01 -1.26 0.17 115.64 122.03 1vb7 s THR 9 Ca 0.26 -1.62 0.02 0.00 0.31 0.00 0.00 61.69 60.66 1vb7 s THR 9 Cb -0.07 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 69.29 1vb7 s THR 9 CO 0.14 -0.30 -0.07 0.54 -0.69 0.00 0.00 174.62 174.24 1vb7 s VAL 10 N -2.27 0.61 -0.45 3.82 0.11 0.29 -4.89 120.40 117.61 1vb7 s VAL 10 Ca 0.34 -1.56 0.03 0.00 -2.93 0.00 0.00 61.98 57.86 1vb7 s VAL 10 Cb -0.06 -1.21 0.13 0.00 -1.53 0.00 0.00 36.38 33.70 1vb7 s VAL 10 CO 0.23 -0.67 0.22 -1.81 -3.33 0.00 0.00 175.10 169.74 1vb7 s ASP 11 N -2.41 4.07 0.63 3.54 1.01 -1.26 -1.37 116.67 120.88 1vb7 s ASP 11 Ca 0.02 -2.67 -0.15 0.00 0.71 0.00 0.00 52.55 50.47 1vb7 s ASP 11 Cb -0.01 -1.34 -0.02 0.00 1.01 0.00 0.00 42.92 42.56 1vb7 s ASP 11 CO -0.03 -0.27 1.07 -0.69 0.21 0.00 0.00 175.17 175.46 1vb7 s VAL 12 N 0.23 3.71 0.49 -1.27 1.01 -0.67 -4.53 120.40 119.37 1vb7 s VAL 12 Ca 0.16 0.76 0.00 0.00 0.00 0.00 0.00 61.98 62.90 1vb7 s VAL 12 Cb -0.24 -3.31 0.01 0.00 0.00 0.00 0.00 36.38 32.84 1vb7 s VAL 12 CO -0.02 -0.53 0.72 0.00 0.00 0.00 0.00 175.10 175.27 1vb7 s ALA 13 N -2.53 3.79 0.15 5.51 0.00 -1.26 -1.43 121.76 125.99 1vb7 s ALA 13 Ca 0.63 -1.14 -0.01 0.00 0.00 0.00 0.00 51.96 51.44 1vb7 s ALA 13 Cb -0.17 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 20.83 1vb7 s ALA 13 CO 0.41 -0.53 0.21 0.41 0.00 0.00 0.00 175.76 176.26 1vb7 n GLY 14 N -2.19 2.70 0.00 0.00 0.00 -1.26 -4.78 105.19 99.66 1vb7 n GLY 14 Ca 0.04 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1vb7 n GLY 14 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1vb7 n PRO 15 N -0.25 -0.18 -0.79 1.61 -0.04 -1.26 -5.01 135.00 129.09 1vb7 n PRO 15 Ca 0.00 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.16 1vb7 n PRO 15 Cb 0.25 0.00 0.18 0.00 -0.04 0.00 0.00 33.50 33.90 1vb7 n PRO 15 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1vb7 s ALA 16 N -3.50 0.88 1.07 0.55 0.00 -1.26 -4.67 121.76 114.82 1vb7 s ALA 16 Ca 0.00 0.19 -0.17 0.00 0.00 0.00 0.00 51.96 51.98 1vb7 s ALA 16 Cb 0.00 -3.32 0.24 0.00 0.00 0.00 0.00 23.12 20.04 1vb7 s ALA 16 CO 0.00 -2.98 1.21 -1.25 0.00 0.00 0.00 175.76 172.74 1vb7 s PRO 17 N -4.66 -0.19 -0.21 0.00 0.04 -1.26 -5.12 135.00 123.60 1vb7 s PRO 17 Ca 0.66 -0.21 -0.19 0.00 0.04 0.00 0.00 61.00 61.31 1vb7 s PRO 17 Cb -0.22 -1.73 -0.16 0.00 0.04 0.00 0.00 34.50 32.43 1vb7 s PRO 17 CO 0.60 -3.00 0.09 0.91 0.04 0.00 0.00 177.00 175.63 1vb7 n TRP 18 N -4.23 0.89 0.00 0.56 7.02 -1.26 -4.89 117.44 115.53 1vb7 n TRP 18 Ca 0.14 0.39 0.00 0.00 -1.02 0.00 0.00 57.50 57.00 1vb7 n TRP 18 Cb 0.59 -1.03 0.00 0.00 -2.42 0.00 0.00 31.31 28.45 1vb7 n TRP 18 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1vb7 n GLY 19 N 1.44 1.89 3.13 6.99 0.00 -1.26 -2.85 105.19 114.53 1vb7 n GLY 19 Ca -0.30 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.62 1vb7 n GLY 19 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1vb7 s PHE 20 N -2.00 0.13 0.45 1.61 -0.12 -1.26 0.19 117.98 116.98 1vb7 s PHE 20 Ca 0.00 -0.35 0.06 0.00 -0.05 0.00 0.00 56.93 56.59 1vb7 s PHE 20 Cb 0.00 -0.09 -0.03 0.00 -0.63 0.00 0.00 43.02 42.27 1vb7 s PHE 20 CO 0.00 -0.36 0.21 1.03 -0.05 0.00 0.00 175.22 176.05 1vb7 s ARG 21 N -2.25 2.24 0.25 1.99 0.52 -0.72 -4.99 118.95 115.99 1vb7 s ARG 21 Ca -0.08 -1.94 -0.03 0.00 -0.52 0.00 0.00 55.73 53.17 1vb7 s ARG 21 Cb -0.03 -1.96 -0.02 0.00 0.52 0.00 0.00 34.95 33.46 1vb7 s ARG 21 CO -0.03 -0.25 0.28 0.96 0.02 0.00 0.00 175.30 176.28 1vb7 s ILE 22 N -2.67 0.00 0.33 1.52 -4.36 -1.26 -2.77 121.20 111.99 1vb7 s ILE 22 Ca 0.35 -1.82 -0.07 0.00 -0.26 0.00 0.00 60.65 58.86 1vb7 s ILE 22 Cb 0.02 -2.45 0.01 0.00 1.25 0.00 0.00 42.46 41.29 1vb7 s ILE 22 CO 0.20 0.00 0.53 -0.55 0.24 0.00 0.00 174.94 175.35 1vb7 s SER 23 N -3.17 0.51 0.76 4.36 0.15 0.28 -4.62 113.70 111.97 1vb7 s SER 23 Ca 0.34 -1.29 0.00 0.00 0.70 0.00 0.00 55.95 55.70 1vb7 s SER 23 Cb 0.04 0.67 0.00 0.00 -1.71 0.00 0.00 66.02 65.02 1vb7 s SER 23 CO 0.15 -1.32 0.00 0.61 1.20 0.00 0.00 173.24 173.88 1vb7 n GLY 24 N -0.51 2.03 0.00 9.45 0.00 -1.26 -2.46 105.19 112.43 1vb7 n GLY 24 Ca -0.01 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1vb7 n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vb7 n GLY 25 N 0.00 2.53 0.50 -0.02 0.00 0.43 -4.11 105.19 104.53 1vb7 n GLY 25 Ca 0.00 -1.98 0.35 0.00 0.00 0.00 0.00 46.02 44.38 1vb7 n GLY 25 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1vb7 h ARG 26 N 0.00 0.13 0.07 1.61 9.65 0.95 0.83 114.38 127.62 1vb7 h ARG 26 Ca 0.00 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1vb7 h ARG 26 Cb 0.00 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 28.55 1vb7 h ARG 26 CO 0.00 0.08 -0.05 0.22 2.80 0.00 0.00 179.97 183.02 1vb7 h ASP 27 N 0.13 -0.13 -0.23 -3.80 1.82 -1.84 -1.80 116.42 110.58 1vb7 h ASP 27 Ca 0.69 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 57.34 1vb7 h ASP 27 Cb 2.34 0.04 0.00 0.00 0.68 0.00 0.00 39.33 42.39 1vb7 h ASP 27 CO -0.20 -0.08 0.00 0.49 -1.61 0.00 0.00 179.24 177.84 1vb7 n PHE 28 N -5.15 0.30 -2.41 0.28 3.72 0.21 -4.89 117.46 109.52 1vb7 n PHE 28 Ca -0.07 -0.15 -0.19 0.00 -0.05 0.00 0.00 57.45 56.98 1vb7 n PHE 28 Cb 0.08 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.62 1vb7 n PHE 28 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1vb7 n HIS 29 N 0.39 -1.09 -4.35 1.38 8.25 0.23 -4.81 115.22 115.22 1vb7 n HIS 29 Ca 0.15 0.01 -0.18 0.00 -0.26 0.00 0.00 57.72 57.43 1vb7 n HIS 29 Cb 0.32 -3.78 -0.10 0.00 1.12 0.00 0.00 29.99 27.55 1vb7 n HIS 29 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1vb7 s THR 30 N -2.97 1.63 0.35 1.59 -4.23 -0.45 -4.92 115.64 106.64 1vb7 s THR 30 Ca 0.00 -2.17 -0.26 0.00 -1.18 0.00 0.00 61.69 58.08 1vb7 s THR 30 Cb -0.00 -2.09 -0.09 0.00 1.34 0.00 0.00 72.50 71.65 1vb7 s THR 30 CO 0.00 -0.56 1.06 -2.16 -0.54 0.00 0.00 174.62 172.43 1vb7 s PRO 31 N -3.68 4.35 -0.59 3.99 0.04 -1.26 0.16 135.00 138.02 1vb7 s PRO 31 Ca 0.23 1.61 -0.26 0.00 0.04 0.00 0.00 61.00 62.62 1vb7 s PRO 31 Cb 0.01 -2.79 -0.04 0.00 0.04 0.00 0.00 34.50 31.72 1vb7 s PRO 31 CO 0.07 -0.00 2.05 0.42 0.04 0.00 0.00 177.00 179.58 1vb7 s ILE 32 N -1.47 3.24 0.04 0.56 -1.09 -1.25 -4.08 121.20 117.14 1vb7 s ILE 32 Ca 0.53 0.12 0.03 0.00 -2.23 0.00 0.00 60.65 59.10 1vb7 s ILE 32 Cb -0.26 -3.63 -0.04 0.00 -1.58 0.00 0.00 42.46 36.96 1vb7 s ILE 32 CO 0.32 -0.61 -0.02 -0.63 -1.23 0.00 0.00 174.94 172.77 1vb7 s ILE 33 N 10.24 3.92 0.10 2.92 1.01 -1.03 -0.33 121.20 138.03 1vb7 s ILE 33 Ca 0.78 -0.82 -0.29 0.00 0.00 0.00 0.00 60.65 60.31 1vb7 s ILE 33 Cb -0.14 -2.79 -0.06 0.00 0.01 0.00 0.00 42.46 39.49 1vb7 s ILE 33 CO 0.21 0.27 0.92 -0.69 0.00 0.00 0.00 174.94 175.66 1vb7 s VAL 34 N -1.15 4.53 -0.24 2.92 1.01 -1.16 0.10 120.40 126.42 1vb7 s VAL 34 Ca 0.21 1.98 -0.16 0.00 0.00 0.00 0.00 61.98 64.01 1vb7 s VAL 34 Cb -0.11 -4.28 -0.13 0.00 0.00 0.00 0.00 36.38 31.86 1vb7 s VAL 34 CO 0.13 0.34 -0.17 0.35 0.00 0.00 0.00 175.10 175.74 1vb7 n THR 35 N 2.73 1.52 -4.35 3.92 -2.24 -1.11 0.11 114.28 114.86 1vb7 n THR 35 Ca 0.01 -0.18 -0.18 0.00 -2.27 0.00 0.00 64.05 61.42 1vb7 n THR 35 Cb 0.49 -2.01 -0.10 0.00 -2.10 0.00 0.00 70.33 66.61 1vb7 n THR 35 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1vb7 s LYS 36 N -2.49 1.35 -0.31 -0.78 2.36 -1.26 -4.79 119.74 113.81 1vb7 s LYS 36 Ca -0.33 -1.62 -0.01 0.00 -2.55 0.00 0.00 55.97 51.45 1vb7 s LYS 36 Cb 0.10 -1.04 0.13 0.00 -1.05 0.00 0.00 37.83 35.97 1vb7 s LYS 36 CO 0.50 0.12 0.23 0.08 1.55 0.00 0.00 175.35 177.83 1vb7 s VAL 37 N -3.05 -0.19 -0.21 4.02 1.01 -1.26 -1.76 120.40 118.96 1vb7 s VAL 37 Ca 0.24 -0.84 -0.39 0.00 0.00 0.00 0.00 61.98 60.99 1vb7 s VAL 37 Cb 0.01 -0.97 -0.15 0.00 0.00 0.00 0.00 36.38 35.27 1vb7 s VAL 37 CO 0.07 -0.66 1.70 0.41 0.00 0.00 0.00 175.10 176.62 1vb7 n THR 38 N 4.97 0.28 -1.16 3.92 -1.04 0.50 -4.91 114.28 116.85 1vb7 n THR 38 Ca 0.00 -0.05 -0.31 0.00 -2.04 0.00 0.00 64.05 61.66 1vb7 n THR 38 Cb 0.43 -1.23 0.12 0.00 -1.82 0.00 0.00 70.33 67.83 1vb7 n THR 38 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1vb7 s GLU 39 N 3.14 1.73 -0.37 -2.82 2.12 -1.26 -2.98 118.70 118.26 1vb7 s GLU 39 Ca 0.96 1.10 -0.04 0.00 0.36 0.00 0.00 54.97 57.35 1vb7 s GLU 39 Cb -1.02 -1.84 0.04 0.00 0.26 0.00 0.00 34.13 31.56 1vb7 s GLU 39 CO 0.62 -1.99 0.10 0.54 -0.54 0.00 0.00 175.26 173.99 1vb7 n ARG 40 N -3.75 -2.64 0.00 4.30 1.74 -1.26 -4.85 116.66 110.20 1vb7 n ARG 40 Ca 0.09 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 1vb7 n ARG 40 Cb 0.54 -4.59 0.00 0.00 -1.02 0.00 0.00 32.46 27.38 1vb7 n ARG 40 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vb7 n GLY 41 N -0.62 2.23 0.07 -0.13 0.00 -1.16 -5.00 105.19 100.58 1vb7 n GLY 41 Ca 0.01 -1.91 -0.06 0.00 0.00 0.00 0.00 46.02 44.06 1vb7 n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vb7 h LYS 42 N 0.00 0.00 0.00 1.61 1.79 -1.78 -3.26 116.57 114.93 1vb7 h LYS 42 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1vb7 h LYS 42 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1vb7 h LYS 42 CO 0.00 0.11 0.00 0.00 -1.08 0.00 0.00 179.45 178.48 1vb7 n ALA 43 N -3.48 -0.08 -0.33 3.86 0.00 -1.18 -0.09 120.51 119.22 1vb7 n ALA 43 Ca -0.09 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.57 1vb7 n ALA 43 Cb 0.27 0.41 0.42 0.00 0.00 0.00 0.00 19.45 20.55 1vb7 n ALA 43 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1vb7 h GLU 44 N 0.00 0.05 -0.50 0.00 4.81 -1.77 0.86 114.58 118.03 1vb7 h GLU 44 Ca 0.00 -0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.33 1vb7 h GLU 44 Cb 0.00 -0.01 -0.10 0.00 0.63 0.00 0.00 28.75 29.27 1vb7 h GLU 44 CO 0.00 0.04 -0.22 0.00 -0.73 0.00 0.00 179.01 178.09 1vb7 h ALA 45 N 1.96 0.13 -3.00 2.92 0.00 -0.54 -3.22 119.26 117.50 1vb7 h ALA 45 Ca 0.70 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.78 1vb7 h ALA 45 Cb 1.65 0.55 0.00 0.00 0.00 0.00 0.00 17.79 19.99 1vb7 h ALA 45 CO -0.81 -0.56 0.00 0.00 0.00 0.00 0.00 179.25 177.88 1vb7 n ALA 46 N -2.99 0.00 0.00 0.00 0.00 0.29 -4.95 120.51 112.86 1vb7 n ALA 46 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1vb7 n ALA 46 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.77 1vb7 n ALA 46 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1vb7 n ASP 47 N -0.42 0.00 -4.74 0.00 -0.08 -0.76 -4.93 116.55 105.63 1vb7 n ASP 47 Ca 0.00 0.00 -0.36 0.00 -1.51 0.00 0.00 54.79 52.92 1vb7 n ASP 47 Cb 0.00 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.38 1vb7 n ASP 47 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 1vb7 s LEU 48 N 0.00 4.23 0.17 -2.67 2.96 -1.15 -4.97 118.68 117.25 1vb7 s LEU 48 Ca 0.00 0.34 0.05 0.00 -0.22 0.00 0.00 54.13 54.30 1vb7 s LEU 48 Cb 0.00 -2.19 -0.05 0.00 0.50 0.00 0.00 46.19 44.45 1vb7 s LEU 48 CO 0.00 0.16 -0.08 -0.13 -1.32 0.00 0.00 176.35 174.98 1vb7 s ARG 49 N 0.33 1.14 -0.05 1.98 0.52 -1.26 -3.94 118.95 117.67 1vb7 s ARG 49 Ca 0.11 -1.51 -0.30 0.00 -0.52 0.00 0.00 55.73 53.51 1vb7 s ARG 49 Cb -0.12 -0.67 -0.03 0.00 0.52 0.00 0.00 34.95 34.65 1vb7 s ARG 49 CO 0.00 0.05 1.22 -1.25 0.02 0.00 0.00 175.30 175.34 1vb7 s PRO 50 N -3.76 4.35 0.00 3.54 0.04 -1.26 -3.04 135.00 134.87 1vb7 s PRO 50 Ca 0.20 1.70 0.00 0.00 0.04 0.00 0.00 61.00 62.94 1vb7 s PRO 50 Cb 0.03 -3.56 0.00 0.00 0.04 0.00 0.00 34.50 31.01 1vb7 s PRO 50 CO 0.03 -0.46 0.00 0.41 0.04 0.00 0.00 177.00 177.02 1vb7 n GLY 51 N 3.39 0.99 3.63 0.56 0.00 0.12 -4.90 105.19 108.97 1vb7 n GLY 51 Ca 0.11 -0.01 -0.52 0.00 0.00 0.00 0.00 46.02 45.60 1vb7 n GLY 51 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vb7 n ASP 52 N 0.00 2.12 -4.57 1.61 8.00 -1.17 -4.45 116.55 118.10 1vb7 n ASP 52 Ca 0.00 1.10 -0.43 0.00 0.71 0.00 0.00 54.79 56.17 1vb7 n ASP 52 Cb 0.00 -1.23 -0.05 0.00 -0.02 0.00 0.00 41.12 39.82 1vb7 n ASP 52 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1vb7 s ILE 53 N 1.41 4.66 -0.35 0.53 1.01 -1.26 -2.98 121.20 124.23 1vb7 s ILE 53 Ca 0.87 0.73 -0.29 0.00 0.00 0.00 0.00 60.65 61.96 1vb7 s ILE 53 Cb -0.92 -4.28 -0.01 0.00 0.01 0.00 0.00 42.46 37.26 1vb7 s ILE 53 CO 0.50 -0.58 1.62 -0.63 0.00 0.00 0.00 174.94 175.84 1vb7 s ILE 54 N 3.26 3.68 -0.08 2.92 1.01 0.55 0.58 121.20 133.11 1vb7 s ILE 54 Ca 0.32 0.70 -0.26 0.00 0.00 0.00 0.00 60.65 61.41 1vb7 s ILE 54 Cb -0.12 -3.88 -0.26 0.00 0.01 0.00 0.00 42.46 38.21 1vb7 s ILE 54 CO 0.20 -0.54 0.91 0.58 0.00 0.00 0.00 174.94 176.10 1vb7 h VAL 55 N 6.60 1.63 -4.30 2.92 2.07 0.20 -3.40 116.25 121.98 1vb7 h VAL 55 Ca -0.31 -2.17 -0.46 0.00 0.82 0.00 0.00 66.70 64.58 1vb7 h VAL 55 Cb 1.14 3.07 -0.13 0.00 -1.52 0.00 0.00 31.29 33.84 1vb7 h VAL 55 CO 1.05 0.58 -0.52 0.00 0.02 0.00 0.00 177.57 178.71 1vb7 s ALA 56 N -2.70 2.02 -0.29 1.67 0.00 -1.12 0.17 121.76 121.51 1vb7 s ALA 56 Ca -0.17 -1.83 -0.01 0.00 0.00 0.00 0.00 51.96 49.95 1vb7 s ALA 56 Cb -0.01 1.29 0.09 0.00 0.00 0.00 0.00 23.12 24.49 1vb7 s ALA 56 CO 0.73 -0.57 0.09 0.42 0.00 0.00 0.00 175.76 176.43 1vb7 s ILE 57 N -3.49 0.75 0.00 0.00 1.01 0.52 -3.02 121.20 116.97 1vb7 s ILE 57 Ca 0.36 -1.22 0.00 0.00 0.00 0.00 0.00 60.65 59.80 1vb7 s ILE 57 Cb 0.03 -1.52 0.00 0.00 0.01 0.00 0.00 42.46 40.98 1vb7 s ILE 57 CO 0.22 -0.61 0.00 -3.20 0.00 0.00 0.00 174.94 171.36 1vb7 n ASN 58 N 4.91 -2.75 0.00 3.58 2.85 0.48 -1.89 115.26 122.44 1vb7 n ASN 58 Ca -0.04 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.43 1vb7 n ASN 58 Cb 0.43 -1.48 0.00 0.00 1.24 0.00 0.00 39.78 39.97 1vb7 n ASN 58 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1vb7 n GLY 59 N -1.59 1.22 3.34 8.20 0.00 -1.26 -4.88 105.19 110.22 1vb7 n GLY 59 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1vb7 n GLY 59 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1vb7 s GLN 60 N -0.12 3.27 0.19 1.61 0.74 -0.79 -5.03 119.66 119.53 1vb7 s GLN 60 Ca 0.00 -0.72 -0.26 0.00 0.05 0.00 0.00 55.36 54.43 1vb7 s GLN 60 Cb 0.00 -3.20 -0.16 0.00 1.10 0.00 0.00 33.01 30.75 1vb7 s GLN 60 CO 0.00 -0.31 0.48 0.43 -0.55 0.00 0.00 175.29 175.34 1vb7 n SER 61 N 4.83 -1.22 -0.05 6.67 7.64 -1.26 0.20 113.62 130.43 1vb7 n SER 61 Ca -0.16 1.05 0.01 0.00 1.01 0.00 0.00 58.87 60.78 1vb7 n SER 61 Cb 0.49 -0.89 0.01 0.00 -1.01 0.00 0.00 64.21 62.82 1vb7 n SER 61 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1vb7 n ALA 62 N -0.03 2.02 -0.37 -0.43 0.00 0.45 -4.58 120.51 117.57 1vb7 n ALA 62 Ca 0.17 -1.04 -0.00 0.00 0.00 0.00 0.00 53.44 52.57 1vb7 n ALA 62 Cb 0.24 -0.04 0.14 0.00 0.00 0.00 0.00 19.45 19.79 1vb7 n ALA 62 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1vb7 h GLU 63 N 0.16 1.25 -2.29 0.00 4.39 -1.81 -3.02 114.58 113.26 1vb7 h GLU 63 Ca 0.00 -0.08 -0.63 0.00 0.34 0.00 0.00 59.36 59.00 1vb7 h GLU 63 Cb 0.53 -0.28 -0.40 0.00 -0.10 0.00 0.00 28.75 28.50 1vb7 h GLU 63 CO 0.00 0.83 -0.38 0.27 -1.16 0.00 0.00 179.01 178.56 1vb7 n ASN 64 N -4.43 4.66 -4.08 1.42 0.23 -1.26 -4.53 115.26 107.27 1vb7 n ASN 64 Ca 0.13 -3.60 -0.31 0.00 -0.53 0.00 0.00 54.58 50.28 1vb7 n ASN 64 Cb 0.08 -0.69 -0.16 0.00 -2.08 0.00 0.00 39.78 36.92 1vb7 n ASN 64 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 1vb7 s MET 65 N -3.21 2.54 0.58 -3.83 -1.94 -1.14 -4.81 119.30 107.48 1vb7 s MET 65 Ca 0.44 -0.67 -0.18 0.00 -1.71 0.00 0.00 55.69 53.57 1vb7 s MET 65 Cb 0.22 -2.17 -0.04 0.00 2.01 0.00 0.00 34.83 34.84 1vb7 s MET 65 CO -0.08 -0.12 1.15 -0.51 -0.01 0.00 0.00 175.02 175.44 1vb7 s LEU 66 N 1.13 3.66 0.63 -0.03 1.43 -1.26 0.13 118.68 124.36 1vb7 s LEU 66 Ca -0.02 2.20 0.29 0.00 -1.03 0.00 0.00 54.13 55.57 1vb7 s LEU 66 Cb -0.14 -4.58 1.51 0.00 0.03 0.00 0.00 46.19 43.01 1vb7 s LEU 66 CO -0.06 -1.39 1.89 -0.74 0.23 0.00 0.00 176.35 176.28 1vb7 h HIS 67 N 0.90 0.00 0.00 0.29 -0.00 -1.86 1.15 115.15 115.63 1vb7 h HIS 67 Ca -0.50 0.00 -0.22 0.00 -0.00 0.00 0.00 60.37 59.65 1vb7 h HIS 67 Cb 1.27 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 28.64 1vb7 h HIS 67 CO 0.51 0.00 -1.68 0.00 -0.00 0.00 0.00 177.93 176.75 1vb7 n ALA 68 N -2.12 1.81 0.23 5.26 0.00 -1.26 -3.30 120.51 121.13 1vb7 n ALA 68 Ca 0.03 -0.73 -0.11 0.00 0.00 0.00 0.00 53.44 52.63 1vb7 n ALA 68 Cb 0.54 -0.79 -0.06 0.00 0.00 0.00 0.00 19.45 19.14 1vb7 n ALA 68 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1vb7 h GLU 69 N 0.00 -0.61 -0.97 0.00 4.39 0.92 -0.41 114.58 117.91 1vb7 h GLU 69 Ca -0.25 0.04 0.07 0.00 0.34 0.00 0.00 59.36 59.57 1vb7 h GLU 69 Cb 1.76 0.14 -0.07 0.00 -0.10 0.00 0.00 28.75 30.48 1vb7 h GLU 69 CO 0.05 -0.34 0.62 0.00 -1.16 0.00 0.00 179.01 178.18 1vb7 h ALA 70 N -0.97 1.46 -0.17 3.43 0.00 -1.10 0.43 119.26 122.35 1vb7 h ALA 70 Ca -0.06 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1vb7 h ALA 70 Cb 0.54 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1vb7 h ALA 70 CO 0.11 0.38 0.10 1.96 0.00 0.00 0.00 179.25 181.80 1vb7 h GLN 71 N 1.10 0.22 0.54 0.00 1.08 -1.56 0.18 115.11 116.68 1vb7 h GLN 71 Ca 0.42 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.58 1vb7 h GLN 71 Cb 0.22 -0.05 0.01 0.00 -0.05 0.00 0.00 27.48 27.60 1vb7 h GLN 71 CO -0.17 0.19 -0.26 1.03 -0.95 0.00 0.00 178.83 178.67 1vb7 h SER 72 N 0.19 -0.61 -0.94 1.46 0.87 -0.09 0.31 113.55 114.74 1vb7 h SER 72 Ca 0.06 0.02 0.14 0.00 -1.23 0.00 0.00 61.79 60.78 1vb7 h SER 72 Cb 0.02 0.16 -0.15 0.00 -0.44 0.00 0.00 62.40 61.99 1vb7 h SER 72 CO -0.01 -0.32 -0.42 0.11 -0.53 0.00 0.00 176.83 175.66 1vb7 h LYS 73 N -0.95 -0.03 0.40 2.24 1.57 -0.20 0.89 116.57 120.48 1vb7 h LYS 73 Ca -0.07 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1vb7 h LYS 73 Cb 0.55 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 1vb7 h LYS 73 CO 0.12 -0.02 -0.39 0.82 -0.57 0.00 0.00 179.45 179.42 1vb7 h ILE 74 N -0.03 0.00 -0.93 1.86 2.04 -0.97 -1.87 117.51 117.61 1vb7 h ILE 74 Ca 0.30 0.00 0.28 0.00 1.00 0.00 0.00 64.86 66.44 1vb7 h ILE 74 Cb 0.56 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.49 1vb7 h ILE 74 CO -0.94 0.00 0.30 -0.09 0.00 0.00 0.00 178.15 177.42 1vb7 h ARG 75 N -0.78 0.17 -1.34 2.37 2.43 0.12 1.47 114.38 118.82 1vb7 h ARG 75 Ca -0.05 -0.01 -0.30 0.00 -0.81 0.00 0.00 59.98 58.81 1vb7 h ARG 75 Cb 0.67 -0.04 -0.14 0.00 -0.42 0.00 0.00 29.97 30.04 1vb7 h ARG 75 CO -0.04 0.11 0.39 1.04 -1.51 0.00 0.00 179.97 179.96 1vb7 n GLN 76 N -5.24 1.74 -3.98 0.20 6.02 0.29 -4.82 117.38 111.60 1vb7 n GLN 76 Ca 0.26 -1.55 -0.34 0.00 -0.01 0.00 0.00 57.00 55.36 1vb7 n GLN 76 Cb 0.82 -1.61 -0.15 0.00 1.02 0.00 0.00 30.24 30.33 1vb7 n GLN 76 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1vb7 s SER 77 N 0.06 4.06 1.03 1.08 0.15 0.50 -4.92 113.70 115.65 1vb7 s SER 77 Ca 0.30 -0.68 -0.12 0.00 0.70 0.00 0.00 55.95 56.15 1vb7 s SER 77 Cb 0.24 -1.65 0.20 0.00 -1.71 0.00 0.00 66.02 63.11 1vb7 s SER 77 CO 0.02 -0.07 1.08 0.00 1.20 0.00 0.00 173.24 175.46 1vb7 s ALA 78 N 1.36 0.67 -0.08 5.45 0.00 -1.26 -4.83 121.76 123.07 1vb7 s ALA 78 Ca 0.03 -0.22 -0.05 0.00 0.00 0.00 0.00 51.96 51.72 1vb7 s ALA 78 Cb -0.15 -3.17 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 1vb7 s ALA 78 CO -0.06 -3.04 0.13 -1.54 0.00 0.00 0.00 175.76 171.25 1vb7 s SER 79 N -3.17 6.18 0.73 0.00 1.04 -1.26 -3.08 113.70 114.14 1vb7 s SER 79 Ca 0.66 0.38 -0.11 0.00 0.48 0.00 0.00 55.95 57.36 1vb7 s SER 79 Cb -0.20 -1.95 0.03 0.00 0.10 0.00 0.00 66.02 64.00 1vb7 s SER 79 CO 0.59 0.37 1.07 -2.16 0.98 0.00 0.00 173.24 174.09 1vb7 s PRO 80 N -1.25 2.65 -0.39 4.02 0.04 -1.26 -4.97 135.00 133.85 1vb7 s PRO 80 Ca 0.18 0.85 -0.10 0.00 0.04 0.00 0.00 61.00 61.97 1vb7 s PRO 80 Cb -0.12 -1.97 0.05 0.00 0.04 0.00 0.00 34.50 32.50 1vb7 s PRO 80 CO 0.07 -1.27 0.22 -1.17 0.04 0.00 0.00 177.00 174.89 1vb7 s LEU 81 N -5.62 4.86 0.10 -3.56 2.96 -0.52 -4.90 118.68 112.00 1vb7 s LEU 81 Ca 0.59 -1.21 -0.30 0.00 -0.22 0.00 0.00 54.13 52.99 1vb7 s LEU 81 Cb -0.14 -2.00 -0.06 0.00 0.50 0.00 0.00 46.19 44.49 1vb7 s LEU 81 CO 0.55 -0.44 1.06 -0.13 -1.32 0.00 0.00 176.35 176.07 1vb7 s ARG 82 N 1.49 4.58 -0.06 1.98 0.52 -1.26 -1.67 118.95 124.53 1vb7 s ARG 82 Ca 0.02 1.60 -0.02 0.00 -0.52 0.00 0.00 55.73 56.81 1vb7 s ARG 82 Cb -0.21 -3.35 0.04 0.00 0.52 0.00 0.00 34.95 31.94 1vb7 s ARG 82 CO 0.05 0.01 0.08 -0.51 0.02 0.00 0.00 175.30 174.95 1vb7 s LEU 83 N 0.33 0.11 -0.35 2.53 1.43 -0.47 0.18 118.68 122.44 1vb7 s LEU 83 Ca 0.51 0.07 -0.24 0.00 -1.03 0.00 0.00 54.13 53.44 1vb7 s LEU 83 Cb -0.26 -0.07 0.01 0.00 0.03 0.00 0.00 46.19 45.90 1vb7 s LEU 83 CO 0.31 -0.26 0.83 -1.58 0.23 0.00 0.00 176.35 175.88 1vb7 s GLN 84 N 2.19 3.82 -0.08 1.70 0.74 -1.17 -0.55 119.66 126.32 1vb7 s GLN 84 Ca 0.04 0.45 -0.05 0.00 0.05 0.00 0.00 55.36 55.86 1vb7 s GLN 84 Cb -0.12 -3.79 -0.04 0.00 1.10 0.00 0.00 33.01 30.16 1vb7 s GLN 84 CO -0.04 -0.85 0.12 -0.51 -0.55 0.00 0.00 175.29 173.46 1vb7 s LEU 85 N 3.19 4.19 -0.55 3.68 1.43 0.46 0.20 118.68 131.28 1vb7 s LEU 85 Ca 0.34 0.35 -0.17 0.00 -1.03 0.00 0.00 54.13 53.62 1vb7 s LEU 85 Cb -0.13 -2.15 0.10 0.00 0.03 0.00 0.00 46.19 44.05 1vb7 s LEU 85 CO 0.16 0.36 0.57 -0.62 0.23 0.00 0.00 176.35 177.06 1vb7 s ASP 86 N -1.25 6.18 -0.40 2.29 2.15 0.19 0.00 116.67 125.84 1vb7 s ASP 86 Ca 0.18 -1.49 -0.07 0.00 0.43 0.00 0.00 52.55 51.60 1vb7 s ASP 86 Cb -0.12 -2.25 0.08 0.00 -0.30 0.00 0.00 42.92 40.33 1vb7 s ASP 86 CO 0.08 -0.93 0.21 -0.60 -0.17 0.00 0.00 175.17 173.76 1vb7 s ARG 87 N 2.12 2.46 -0.55 4.34 3.52 -1.26 -4.18 118.95 125.40 1vb7 s ARG 87 Ca 0.08 -1.50 0.05 0.00 -0.13 0.00 0.00 55.73 54.22 1vb7 s ARG 87 Cb -0.26 -3.66 0.17 0.00 -1.56 0.00 0.00 34.95 29.65 1vb7 s ARG 87 CO 0.06 -0.93 0.42 0.45 -0.81 0.00 0.00 175.30 174.49 1vb7 n SER 88 N 4.81 1.18 -4.63 -2.12 2.88 -1.26 -4.21 113.62 110.27 1vb7 n SER 88 Ca -0.09 -2.78 -0.27 0.00 -1.33 0.00 0.00 58.87 54.40 1vb7 n SER 88 Cb 0.43 -0.65 -0.08 0.00 -0.75 0.00 0.00 64.21 63.16 1vb7 n SER 88 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1vb7 s SER 89 N -0.71 4.60 0.20 -3.46 0.01 -1.26 -5.14 113.70 107.93 1vb7 s SER 89 Ca 0.30 -0.43 0.09 0.00 1.31 0.00 0.00 55.95 57.22 1vb7 s SER 89 Cb 0.01 -0.92 -0.04 0.00 0.21 0.00 0.00 66.02 65.27 1vb7 s SER 89 CO -0.18 0.11 -0.19 -0.83 0.41 0.00 0.00 173.24 172.56 1vb7 s GLY 90 N -2.79 1.53 0.38 3.44 0.00 -1.26 -5.13 107.32 103.50 1vb7 s GLY 90 Ca 0.26 -1.62 -0.25 0.00 0.00 0.00 0.00 44.72 43.12 1vb7 s GLY 90 CO 0.17 -1.68 1.06 2.56 0.00 0.00 0.00 173.10 175.21 1vb7 s PRO 91 N -3.07 4.23 0.05 2.90 0.04 -1.26 -5.06 135.00 132.83 1vb7 s PRO 91 Ca 0.20 1.56 -0.13 0.00 0.04 0.00 0.00 61.00 62.67 1vb7 s PRO 91 Cb -0.05 -2.64 0.02 0.00 0.04 0.00 0.00 34.50 31.87 1vb7 s PRO 91 CO 0.09 -0.09 0.29 0.45 0.04 0.00 0.00 177.00 177.77 1vb7 s SER 92 N -1.46 -0.10 -0.15 6.66 0.15 -1.26 -5.17 113.70 112.38 1vb7 s SER 92 Ca 0.56 -0.24 -0.24 0.00 0.70 0.00 0.00 55.95 56.73 1vb7 s SER 92 Cb -0.24 0.35 0.06 0.00 -1.71 0.00 0.00 66.02 64.49 1vb7 s SER 92 CO 0.30 -0.62 0.61 -0.44 1.20 0.00 0.00 173.24 174.29 1vb7 s SER 93 N -2.12 -0.61 0.00 5.45 0.01 -1.26 -5.36 113.70 109.82 1vb7 s SER 93 Ca -0.04 0.94 0.00 0.00 1.31 0.00 0.00 55.95 58.16 1vb7 s SER 93 Cb -0.01 0.91 0.00 0.00 0.21 0.00 0.00 66.02 67.14 1vb7 s SER 93 CO -0.04 -0.38 0.00 0.61 0.41 0.00 0.00 173.24 173.84