#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 -0.47 0.34 1.61 0.15 -1.26 -5.19 113.70 108.89 1vb7 s SER 2 Ca 0.00 -0.08 0.04 0.00 0.70 0.00 0.00 55.95 56.60 1vb7 s SER 2 Cb 0.00 0.55 -0.06 0.00 -1.71 0.00 0.00 66.02 64.81 1vb7 s SER 2 CO 0.00 -0.92 0.06 -0.44 1.20 0.00 0.00 173.24 173.14 1vb7 s SER 3 N -2.71 2.50 0.00 5.45 0.01 -1.26 -5.17 113.70 112.52 1vb7 s SER 3 Ca 0.04 -1.42 0.00 0.00 1.31 0.00 0.00 55.95 55.87 1vb7 s SER 3 Cb -0.02 -0.00 0.00 0.00 0.21 0.00 0.00 66.02 66.21 1vb7 s SER 3 CO -0.09 -0.65 0.00 0.61 0.41 0.00 0.00 173.24 173.52 1vb7 n GLY 4 N -0.74 3.37 3.76 3.44 0.00 -1.26 -5.16 105.19 108.61 1vb7 n GLY 4 Ca -0.03 -2.10 -0.32 0.00 0.00 0.00 0.00 46.02 43.58 1vb7 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1vb7 s SER 5 N -0.64 4.17 0.10 1.61 1.04 -1.26 -5.16 113.70 113.56 1vb7 s SER 5 Ca 0.00 -1.57 0.08 0.00 0.48 0.00 0.00 55.95 54.94 1vb7 s SER 5 Cb 0.00 0.39 -0.04 0.00 0.10 0.00 0.00 66.02 66.48 1vb7 s SER 5 CO 0.00 -0.83 -0.21 -0.94 0.98 0.00 0.00 173.24 172.24 1vb7 s SER 6 N -3.90 2.60 0.00 7.02 1.04 -1.26 -5.05 113.70 114.14 1vb7 s SER 6 Ca 0.12 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 55.86 1vb7 s SER 6 Cb 0.02 -0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.00 1vb7 s SER 6 CO 0.07 0.07 0.00 0.61 0.98 0.00 0.00 173.24 174.97 1vb7 n GLY 7 N 1.08 1.41 3.78 7.32 0.00 -1.26 -4.94 105.19 112.58 1vb7 n GLY 7 Ca -0.19 -1.18 -0.24 0.00 0.00 0.00 0.00 46.02 44.41 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 3.71 0.16 0.99 0.20 0.99 -4.90 118.68 119.83 1vb7 s LEU 8 Ca 0.00 -0.26 0.11 0.00 0.69 0.00 0.00 54.13 54.67 1vb7 s LEU 8 Cb 0.00 -2.28 -0.04 0.00 -0.43 0.00 0.00 46.19 43.44 1vb7 s LEU 8 CO 0.00 0.02 -0.23 -0.89 -0.29 0.00 0.00 176.35 174.96 1vb7 s THR 9 N -1.97 2.46 0.21 3.68 2.01 -1.26 0.20 115.64 120.96 1vb7 s THR 9 Ca 0.31 -1.82 0.10 0.00 0.31 0.00 0.00 61.69 60.59 1vb7 s THR 9 Cb -0.09 -2.14 -0.04 0.00 0.01 0.00 0.00 72.50 70.24 1vb7 s THR 9 CO 0.23 -0.01 -0.14 0.54 -0.69 0.00 0.00 174.62 174.56 1vb7 s VAL 10 N -1.37 2.88 -0.37 3.82 0.11 0.48 -4.93 120.40 121.02 1vb7 s VAL 10 Ca 0.18 -1.90 0.01 0.00 -2.93 0.00 0.00 61.98 57.34 1vb7 s VAL 10 Cb -0.09 -2.44 0.12 0.00 -1.53 0.00 0.00 36.38 32.44 1vb7 s VAL 10 CO 0.09 -0.18 0.16 1.51 -3.33 0.00 0.00 175.10 173.35 1vb7 s ASP 11 N -2.97 3.83 0.51 3.54 1.47 -1.26 -2.04 116.67 119.75 1vb7 s ASP 11 Ca 0.25 -2.13 -0.14 0.00 1.18 0.00 0.00 52.55 51.70 1vb7 s ASP 11 Cb -0.08 -0.95 -0.07 0.00 -0.34 0.00 0.00 42.92 41.49 1vb7 s ASP 11 CO 0.14 -0.34 0.94 -0.69 0.68 0.00 0.00 175.17 175.90 1vb7 s VAL 12 N 0.99 4.61 -0.40 2.11 1.01 -0.94 -4.75 120.40 123.04 1vb7 s VAL 12 Ca 0.14 1.03 0.00 0.00 0.00 0.00 0.00 61.98 63.15 1vb7 s VAL 12 Cb -0.21 -3.75 0.11 0.00 0.00 0.00 0.00 36.38 32.53 1vb7 s VAL 12 CO -0.11 -0.72 0.16 0.00 0.00 0.00 0.00 175.10 174.43 1vb7 s ALA 13 N -2.65 3.09 0.75 5.51 0.00 -1.26 -2.09 121.76 125.10 1vb7 s ALA 13 Ca 0.57 -2.62 0.00 0.00 0.00 0.00 0.00 51.96 49.91 1vb7 s ALA 13 Cb -0.10 -2.24 0.00 0.00 0.00 0.00 0.00 23.12 20.78 1vb7 s ALA 13 CO 0.35 -1.79 0.00 0.41 0.00 0.00 0.00 175.76 174.73 1vb7 n GLY 14 N 4.33 -2.68 0.00 0.00 0.00 -1.26 -4.95 105.19 100.62 1vb7 n GLY 14 Ca 0.01 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.13 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 -0.69 0.55 -2.88 1.61 -0.04 -1.26 -5.06 135.00 127.24 1vb7 n PRO 15 Ca 0.00 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.24 1vb7 n PRO 15 Cb 0.00 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.48 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 3.81 0.90 0.55 0.00 -1.26 -4.50 121.76 117.77 1vb7 s ALA 16 Ca 0.00 -1.15 -0.12 0.00 0.00 0.00 0.00 51.96 50.69 1vb7 s ALA 16 Cb 0.00 -2.11 0.13 0.00 0.00 0.00 0.00 23.12 21.14 1vb7 s ALA 16 CO 0.00 -0.49 1.14 -1.25 0.00 0.00 0.00 175.76 175.15 1vb7 s PRO 17 N -4.62 1.19 -0.05 0.00 0.04 -1.26 -5.13 135.00 125.18 1vb7 s PRO 17 Ca 0.51 0.31 -0.00 0.00 0.04 0.00 0.00 61.00 61.85 1vb7 s PRO 17 Cb -0.10 -1.84 -0.00 0.00 0.04 0.00 0.00 34.50 32.59 1vb7 s PRO 17 CO 0.38 -2.16 0.03 -1.49 0.04 0.00 0.00 177.00 173.79 1vb7 h TRP 18 N -1.47 -0.01 0.00 0.56 4.06 -1.96 -3.49 115.95 113.63 1vb7 h TRP 18 Ca -0.50 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.45 1vb7 h TRP 18 Cb 1.33 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.49 1vb7 h TRP 18 CO 0.30 -0.01 0.00 0.41 -3.56 0.00 0.00 178.44 175.58 1vb7 n GLY 19 N 1.82 0.90 3.10 1.49 0.00 -1.26 -3.83 105.19 107.41 1vb7 n GLY 19 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.54 -0.09 0.46 1.61 -0.12 -1.26 0.19 117.98 117.22 1vb7 s PHE 20 Ca 0.00 0.20 0.07 0.00 -0.05 0.00 0.00 56.93 57.15 1vb7 s PHE 20 Cb 0.00 0.02 0.07 0.00 -0.63 0.00 0.00 43.02 42.48 1vb7 s PHE 20 CO 0.00 -0.21 0.59 0.54 -0.05 0.00 0.00 175.22 176.10 1vb7 n ARG 21 N 2.16 0.71 -3.95 1.99 1.74 0.41 -5.00 116.66 114.72 1vb7 n ARG 21 Ca -0.18 -2.52 -0.10 0.00 -0.77 0.00 0.00 57.85 54.28 1vb7 n ARG 21 Cb 0.57 -0.12 -0.02 0.00 -1.02 0.00 0.00 32.46 31.87 1vb7 n ARG 21 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 1vb7 s ILE 22 N -1.91 0.00 0.34 0.55 -4.36 -1.26 -3.57 121.20 111.00 1vb7 s ILE 22 Ca 0.45 -1.28 -0.08 0.00 -0.26 0.00 0.00 60.65 59.48 1vb7 s ILE 22 Cb -0.04 -2.44 0.02 0.00 1.25 0.00 0.00 42.46 41.25 1vb7 s ILE 22 CO 0.28 0.00 0.56 -0.55 0.24 0.00 0.00 174.94 175.48 1vb7 s SER 23 N -3.06 0.51 0.81 4.36 0.15 0.29 -4.57 113.70 112.18 1vb7 s SER 23 Ca 0.20 -1.30 0.00 0.00 0.70 0.00 0.00 55.95 55.55 1vb7 s SER 23 Cb -0.03 0.71 0.00 0.00 -1.71 0.00 0.00 66.02 64.99 1vb7 s SER 23 CO 0.12 -1.38 0.00 0.61 1.20 0.00 0.00 173.24 173.79 1vb7 n GLY 24 N -0.53 1.66 0.00 9.45 0.00 -1.26 -2.33 105.19 112.18 1vb7 n GLY 24 Ca -0.02 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 2.92 0.47 -0.02 0.00 0.45 -4.11 105.19 104.90 1vb7 n GLY 25 Ca 0.00 -1.88 0.40 0.00 0.00 0.00 0.00 46.02 44.54 1vb7 n GLY 25 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1vb7 n ARG 26 N 0.06 -0.03 0.25 1.61 3.00 0.23 0.97 116.66 122.75 1vb7 n ARG 26 Ca 0.00 1.21 -0.17 0.00 -0.00 0.00 0.00 57.85 58.90 1vb7 n ARG 26 Cb 0.00 -2.41 -0.09 0.00 0.00 0.00 0.00 32.46 29.96 1vb7 n ARG 26 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 1vb7 h ASP 27 N 0.00 -1.19 -0.17 6.15 1.82 -1.85 -0.84 116.42 120.35 1vb7 h ASP 27 Ca 0.86 0.10 0.00 0.00 -0.39 0.00 0.00 57.03 57.60 1vb7 h ASP 27 Cb 2.82 0.40 0.00 0.00 0.68 0.00 0.00 39.33 43.23 1vb7 h ASP 27 CO -0.43 -0.58 0.00 0.49 -1.61 0.00 0.00 179.24 177.10 1vb7 n PHE 28 N -5.52 0.31 -2.42 0.28 3.72 0.27 -4.85 117.46 109.26 1vb7 n PHE 28 Ca -0.11 -0.13 -0.14 0.00 -0.05 0.00 0.00 57.45 57.02 1vb7 n PHE 28 Cb 0.42 -0.06 -0.01 0.00 -0.94 0.00 0.00 39.48 38.89 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 0.05 -1.32 -4.37 1.38 8.25 0.57 -4.81 115.22 114.96 1vb7 n HIS 29 Ca 0.06 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.32 1vb7 n HIS 29 Cb 0.24 -2.98 -0.10 0.00 1.12 0.00 0.00 29.99 28.27 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 -2.69 1.93 0.35 1.59 -4.23 -0.79 -4.93 115.64 106.87 1vb7 s THR 30 Ca 0.00 -2.22 -0.26 0.00 -1.18 0.00 0.00 61.69 58.03 1vb7 s THR 30 Cb 0.00 -2.08 -0.09 0.00 1.34 0.00 0.00 72.50 71.67 1vb7 s THR 30 CO 0.00 -0.50 1.07 -2.16 -0.54 0.00 0.00 174.62 172.48 1vb7 s PRO 31 N -3.48 4.38 -0.53 3.99 0.04 -1.26 0.17 135.00 138.31 1vb7 s PRO 31 Ca 0.23 1.63 -0.27 0.00 0.04 0.00 0.00 61.00 62.64 1vb7 s PRO 31 Cb -0.03 -2.83 -0.04 0.00 0.04 0.00 0.00 34.50 31.65 1vb7 s PRO 31 CO 0.09 0.02 2.04 0.42 0.04 0.00 0.00 177.00 179.61 1vb7 s ILE 32 N -1.44 3.24 0.04 0.56 -1.09 -1.26 -4.06 121.20 117.20 1vb7 s ILE 32 Ca 0.52 0.16 0.03 0.00 -2.23 0.00 0.00 60.65 59.14 1vb7 s ILE 32 Cb -0.26 -3.57 -0.04 0.00 -1.58 0.00 0.00 42.46 37.01 1vb7 s ILE 32 CO 0.33 -0.53 -0.03 -0.63 -1.23 0.00 0.00 174.94 172.85 1vb7 s ILE 33 N 9.81 3.88 -0.16 2.92 1.01 -0.98 0.37 121.20 138.05 1vb7 s ILE 33 Ca 0.80 -0.83 -0.26 0.00 0.00 0.00 0.00 60.65 60.36 1vb7 s ILE 33 Cb -0.16 -2.76 -0.01 0.00 0.01 0.00 0.00 42.46 39.54 1vb7 s ILE 33 CO 0.24 0.29 0.87 -0.69 0.00 0.00 0.00 174.94 175.65 1vb7 s VAL 34 N -1.13 4.86 -0.11 2.92 1.01 -1.10 0.11 120.40 126.96 1vb7 s VAL 34 Ca 0.21 1.72 -0.09 0.00 0.00 0.00 0.00 61.98 63.81 1vb7 s VAL 34 Cb -0.11 -4.18 -0.08 0.00 0.00 0.00 0.00 36.38 32.01 1vb7 s VAL 34 CO 0.12 0.02 0.26 0.71 0.00 0.00 0.00 175.10 176.22 1vb7 h THR 35 N 5.17 0.55 -2.93 3.92 1.35 -1.80 0.92 112.91 120.08 1vb7 h THR 35 Ca -0.30 -1.39 -0.12 0.00 -0.55 0.00 0.00 66.41 64.05 1vb7 h THR 35 Cb 1.13 1.03 -0.22 0.00 -1.73 0.00 0.00 68.15 68.37 1vb7 h THR 35 CO 0.84 0.18 -0.26 -0.54 -0.25 0.00 0.00 175.52 175.49 1vb7 s LYS 36 N -1.84 0.58 -0.09 4.72 1.02 -1.26 -4.66 119.74 118.22 1vb7 s LYS 36 Ca -0.06 0.11 0.03 0.00 0.02 0.00 0.00 55.97 56.06 1vb7 s LYS 36 Cb -0.01 0.27 0.01 0.00 -0.52 0.00 0.00 37.83 37.58 1vb7 s LYS 36 CO 0.22 -0.13 -0.17 0.14 -0.92 0.00 0.00 175.35 174.48 1vb7 s VAL 37 N -0.71 1.55 -0.37 3.17 -7.23 -1.26 -0.45 120.40 115.11 1vb7 s VAL 37 Ca -0.08 -0.72 -0.35 0.00 -1.81 0.00 0.00 61.98 59.02 1vb7 s VAL 37 Cb -0.04 -1.38 -0.12 0.00 0.56 0.00 0.00 36.38 35.40 1vb7 s VAL 37 CO 0.03 0.45 2.20 0.41 -0.31 0.00 0.00 175.10 177.88 1vb7 n THR 38 N 3.75 0.17 -1.20 5.32 -1.04 0.49 -4.86 114.28 116.91 1vb7 n THR 38 Ca -0.21 -0.25 -0.35 0.00 -2.04 0.00 0.00 64.05 61.20 1vb7 n THR 38 Cb 0.52 -1.60 0.09 0.00 -1.82 0.00 0.00 70.33 67.53 1vb7 n THR 38 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1vb7 n GLU 39 N 8.19 0.26 -2.48 -2.82 2.13 -1.26 -1.38 120.64 123.29 1vb7 n GLU 39 Ca 0.42 0.14 -0.02 0.00 0.66 0.00 0.00 57.16 58.37 1vb7 n GLU 39 Cb 0.22 -2.05 -0.00 0.00 0.27 0.00 0.00 31.44 29.88 1vb7 n GLU 39 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1vb7 n ARG 40 N -1.63 -2.87 0.00 5.31 5.12 -1.26 -4.85 116.66 116.48 1vb7 n ARG 40 Ca 0.11 0.09 0.00 0.00 -1.93 0.00 0.00 57.85 56.12 1vb7 n ARG 40 Cb 0.50 -4.60 0.00 0.00 -1.16 0.00 0.00 32.46 27.20 1vb7 n ARG 40 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1vb7 n GLY 41 N -0.54 2.72 0.18 -0.13 0.00 -0.48 -4.88 105.19 102.06 1vb7 n GLY 41 Ca -0.02 -2.01 -0.06 0.00 0.00 0.00 0.00 46.02 43.92 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 -0.34 -0.59 1.61 1.57 -1.79 0.58 116.57 117.61 1vb7 h LYS 42 Ca 0.00 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.86 1vb7 h LYS 42 Cb 0.00 0.08 -0.09 0.00 0.08 0.00 0.00 32.23 32.30 1vb7 h LYS 42 CO 0.00 -0.18 -0.54 0.00 -0.57 0.00 0.00 179.45 178.17 1vb7 h ALA 43 N -1.01 -0.67 -0.33 3.86 0.00 -1.85 0.27 119.26 119.54 1vb7 h ALA 43 Ca -0.04 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1vb7 h ALA 43 Cb 0.32 1.20 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 1vb7 h ALA 43 CO 0.06 -0.97 0.17 1.49 0.00 0.00 0.00 179.25 179.99 1vb7 h GLU 44 N -0.23 0.34 -1.07 0.00 4.22 -1.69 -1.10 114.58 115.05 1vb7 h GLU 44 Ca 0.10 -0.02 0.31 0.00 0.08 0.00 0.00 59.36 59.83 1vb7 h GLU 44 Cb 0.49 -0.08 -0.12 0.00 0.50 0.00 0.00 28.75 29.54 1vb7 h GLU 44 CO -0.68 0.22 0.65 0.00 -2.18 0.00 0.00 179.01 177.03 1vb7 h ALA 45 N 1.17 2.14 -3.00 2.92 0.00 0.14 -3.27 119.26 119.36 1vb7 h ALA 45 Ca 0.14 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1vb7 h ALA 45 Cb 0.05 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1vb7 h ALA 45 CO -0.09 -0.66 0.00 0.00 0.00 0.00 0.00 179.25 178.50 1vb7 n ALA 46 N -2.39 0.00 -1.88 0.00 0.00 0.72 -4.98 120.51 111.98 1vb7 n ALA 46 Ca 0.30 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.69 1vb7 n ALA 46 Cb 0.98 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.37 1vb7 n ALA 46 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1vb7 n ASP 47 N 0.00 -0.73 -4.92 0.00 8.00 -0.96 -4.97 116.55 112.97 1vb7 n ASP 47 Ca 0.00 -1.50 -0.29 0.00 0.71 0.00 0.00 54.79 53.71 1vb7 n ASP 47 Cb 0.00 0.22 -0.04 0.00 -0.02 0.00 0.00 41.12 41.28 1vb7 n ASP 47 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1vb7 s LEU 48 N 0.00 4.27 0.11 0.64 2.96 -0.70 -4.86 118.68 121.10 1vb7 s LEU 48 Ca 0.00 0.41 -0.25 0.00 -0.22 0.00 0.00 54.13 54.07 1vb7 s LEU 48 Cb 0.00 -3.15 0.07 0.00 0.50 0.00 0.00 46.19 43.62 1vb7 s LEU 48 CO 0.00 0.02 0.65 -0.13 -1.32 0.00 0.00 176.35 175.57 1vb7 s ARG 49 N -3.02 1.19 0.04 1.98 0.52 -1.26 -3.98 118.95 114.42 1vb7 s ARG 49 Ca 0.38 -0.35 -0.30 0.00 -0.52 0.00 0.00 55.73 54.94 1vb7 s ARG 49 Cb -0.12 0.55 -0.05 0.00 0.52 0.00 0.00 34.95 35.85 1vb7 s ARG 49 CO 0.28 -0.50 1.17 -1.25 0.02 0.00 0.00 175.30 175.02 1vb7 s PRO 50 N -3.32 4.44 0.00 3.54 0.04 -1.26 -3.15 135.00 135.28 1vb7 s PRO 50 Ca -0.00 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.75 1vb7 s PRO 50 Cb -0.01 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 31.14 1vb7 s PRO 50 CO -0.09 -0.26 0.00 0.41 0.04 0.00 0.00 177.00 177.10 1vb7 n GLY 51 N 3.20 0.89 3.69 0.56 0.00 0.32 -4.92 105.19 108.93 1vb7 n GLY 51 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1vb7 n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vb7 s ASP 52 N -1.49 7.05 -0.44 1.61 1.01 -1.19 -4.77 116.67 118.45 1vb7 s ASP 52 Ca 0.00 1.28 -0.27 0.00 0.71 0.00 0.00 52.55 54.27 1vb7 s ASP 52 Cb 0.00 -2.47 0.02 0.00 1.01 0.00 0.00 42.92 41.48 1vb7 s ASP 52 CO 0.00 -0.34 1.00 -0.63 0.21 0.00 0.00 175.17 175.42 1vb7 s ILE 53 N 1.75 4.41 -0.39 0.77 1.01 -1.26 -2.70 121.20 124.78 1vb7 s ILE 53 Ca 0.41 1.05 -0.28 0.00 0.00 0.00 0.00 60.65 61.83 1vb7 s ILE 53 Cb -0.17 -4.47 -0.00 0.00 0.01 0.00 0.00 42.46 37.83 1vb7 s ILE 53 CO 0.16 -0.81 1.58 -0.63 0.00 0.00 0.00 174.94 175.24 1vb7 s ILE 54 N 3.91 3.71 -0.09 2.92 1.01 0.16 0.83 121.20 133.64 1vb7 s ILE 54 Ca 0.41 0.70 -0.26 0.00 0.00 0.00 0.00 60.65 61.50 1vb7 s ILE 54 Cb -0.10 -3.99 -0.25 0.00 0.01 0.00 0.00 42.46 38.13 1vb7 s ILE 54 CO 0.26 -0.65 0.91 0.58 0.00 0.00 0.00 174.94 176.04 1vb7 h VAL 55 N 6.61 1.65 -4.02 2.92 2.07 0.21 -3.39 116.25 122.30 1vb7 h VAL 55 Ca -0.30 -2.14 -0.39 0.00 0.82 0.00 0.00 66.70 64.70 1vb7 h VAL 55 Cb 1.13 3.07 -0.14 0.00 -1.52 0.00 0.00 31.29 33.83 1vb7 h VAL 55 CO 1.07 0.57 -0.57 0.00 0.02 0.00 0.00 177.57 178.66 1vb7 s ALA 56 N -2.72 1.83 -0.29 1.67 0.00 -1.12 0.16 121.76 121.29 1vb7 s ALA 56 Ca -0.17 -1.78 -0.02 0.00 0.00 0.00 0.00 51.96 49.99 1vb7 s ALA 56 Cb -0.01 1.17 0.09 0.00 0.00 0.00 0.00 23.12 24.38 1vb7 s ALA 56 CO 0.72 -0.51 0.09 0.42 0.00 0.00 0.00 175.76 176.48 1vb7 s ILE 57 N -3.69 0.65 -0.15 0.00 1.01 0.48 -2.91 121.20 116.58 1vb7 s ILE 57 Ca 0.37 -1.16 0.00 0.00 0.00 0.00 0.00 60.65 59.85 1vb7 s ILE 57 Cb 0.06 -1.45 0.00 0.00 0.01 0.00 0.00 42.46 41.08 1vb7 s ILE 57 CO 0.17 -0.62 0.00 -3.20 0.00 0.00 0.00 174.94 171.28 1vb7 n ASN 58 N 4.95 -4.03 0.00 3.58 2.85 0.52 -1.98 115.26 121.16 1vb7 n ASN 58 Ca -0.04 0.04 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1vb7 n ASN 58 Cb 0.43 -1.66 0.00 0.00 1.24 0.00 0.00 39.78 39.79 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 -1.68 0.87 3.58 8.20 0.00 -1.26 -4.91 105.19 109.98 1vb7 n GLY 59 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.40 3.83 0.45 1.61 0.74 -0.84 -5.00 119.66 120.05 1vb7 s GLN 60 Ca 0.00 -0.30 -0.19 0.00 0.05 0.00 0.00 55.36 54.92 1vb7 s GLN 60 Cb 0.00 -3.71 -0.15 0.00 1.10 0.00 0.00 33.01 30.25 1vb7 s GLN 60 CO 0.00 -0.31 -0.02 0.43 -0.55 0.00 0.00 175.29 174.84 1vb7 n SER 61 N 5.20 -3.23 0.00 6.67 7.64 -1.26 0.18 113.62 128.81 1vb7 n SER 61 Ca -0.11 0.72 0.00 0.00 1.01 0.00 0.00 58.87 60.48 1vb7 n SER 61 Cb 0.51 -0.85 0.00 0.00 -1.01 0.00 0.00 64.21 62.86 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 -1.25 1.82 0.08 -0.43 0.00 0.42 -4.50 120.51 116.65 1vb7 n ALA 62 Ca 0.09 -0.74 0.08 0.00 0.00 0.00 0.00 53.44 52.87 1vb7 n ALA 62 Cb 0.43 0.00 0.54 0.00 0.00 0.00 0.00 19.45 20.41 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 0.00 0.28 -2.24 0.00 5.08 -1.82 -2.84 114.58 113.04 1vb7 h GLU 63 Ca 0.00 -0.02 -0.57 0.00 -1.00 0.00 0.00 59.36 57.77 1vb7 h GLU 63 Cb 0.47 -0.06 -0.42 0.00 0.50 0.00 0.00 28.75 29.24 1vb7 h GLU 63 CO 0.00 0.18 -0.73 0.27 -1.00 0.00 0.00 179.01 177.73 1vb7 n ASN 64 N -4.49 3.86 -4.09 1.42 0.23 -1.26 -4.54 115.26 106.38 1vb7 n ASN 64 Ca 0.02 -3.57 -0.32 0.00 -0.53 0.00 0.00 54.58 50.19 1vb7 n ASN 64 Cb 0.16 -0.57 -0.16 0.00 -2.08 0.00 0.00 39.78 37.12 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 -3.27 2.78 0.65 -3.83 -1.94 -1.07 -4.81 119.30 107.81 1vb7 s MET 65 Ca 0.47 -0.75 -0.16 0.00 -1.71 0.00 0.00 55.69 53.54 1vb7 s MET 65 Cb 0.29 -2.42 -0.01 0.00 2.01 0.00 0.00 34.83 34.70 1vb7 s MET 65 CO -0.13 -0.21 1.14 -0.51 -0.01 0.00 0.00 175.02 175.31 1vb7 s LEU 66 N 1.32 3.46 0.65 -0.03 1.43 -1.26 0.77 118.68 125.02 1vb7 s LEU 66 Ca 0.04 2.14 0.31 0.00 -1.03 0.00 0.00 54.13 55.59 1vb7 s LEU 66 Cb -0.13 -4.57 1.67 0.00 0.03 0.00 0.00 46.19 43.19 1vb7 s LEU 66 CO -0.12 -1.69 1.97 -0.74 0.23 0.00 0.00 176.35 176.00 1vb7 h HIS 67 N 0.24 0.00 0.00 0.29 -0.00 -1.86 0.90 115.15 114.73 1vb7 h HIS 67 Ca -0.48 0.00 -0.24 0.00 -0.00 0.00 0.00 60.37 59.66 1vb7 h HIS 67 Cb 1.26 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 28.63 1vb7 h HIS 67 CO 0.52 0.00 -1.79 0.00 -0.00 0.00 0.00 177.93 176.66 1vb7 n ALA 68 N -2.01 1.79 0.20 5.26 0.00 -1.26 -3.23 120.51 121.25 1vb7 n ALA 68 Ca -0.00 -0.80 -0.12 0.00 0.00 0.00 0.00 53.44 52.51 1vb7 n ALA 68 Cb 0.40 -0.71 -0.07 0.00 0.00 0.00 0.00 19.45 19.06 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 -0.52 -0.83 0.00 4.39 0.41 0.59 114.58 118.61 1vb7 h GLU 69 Ca -0.28 0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.45 1vb7 h GLU 69 Cb 1.81 0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 30.54 1vb7 h GLU 69 CO 0.05 -0.22 0.49 0.00 -1.16 0.00 0.00 179.01 178.17 1vb7 h ALA 70 N -0.65 1.31 -0.62 3.43 0.00 -1.21 0.34 119.26 121.86 1vb7 h ALA 70 Ca -0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1vb7 h ALA 70 Cb 0.55 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1vb7 h ALA 70 CO 0.09 0.59 0.31 1.96 0.00 0.00 0.00 179.25 182.20 1vb7 h GLN 71 N 1.15 0.89 0.26 0.00 1.08 -1.54 0.20 115.11 117.15 1vb7 h GLN 71 Ca 0.30 -0.13 -0.01 0.00 -1.45 0.00 0.00 58.65 57.36 1vb7 h GLN 71 Cb -0.04 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.23 1vb7 h GLN 71 CO -0.05 0.71 -0.12 1.03 -0.95 0.00 0.00 178.83 179.44 1vb7 h SER 72 N 0.85 -0.29 -0.07 1.46 0.87 -0.11 -0.20 113.55 116.06 1vb7 h SER 72 Ca 0.21 -0.24 0.04 0.00 -1.23 0.00 0.00 61.79 60.57 1vb7 h SER 72 Cb 0.11 0.08 -0.06 0.00 -0.44 0.00 0.00 62.40 62.08 1vb7 h SER 72 CO -0.03 0.15 -0.43 0.11 -0.53 0.00 0.00 176.83 176.10 1vb7 h LYS 73 N -0.81 -0.52 -0.73 2.24 6.56 -0.29 1.52 116.57 124.54 1vb7 h LYS 73 Ca -0.04 0.04 0.11 0.00 -1.06 0.00 0.00 60.65 59.70 1vb7 h LYS 73 Cb 0.51 0.12 -0.08 0.00 -0.57 0.00 0.00 32.23 32.21 1vb7 h LYS 73 CO 0.06 -0.35 0.34 0.82 -2.06 0.00 0.00 179.45 178.26 1vb7 h ILE 74 N -0.54 0.78 0.00 1.86 2.04 -0.67 0.41 117.51 121.39 1vb7 h ILE 74 Ca 0.06 -0.19 -0.06 0.00 1.00 0.00 0.00 64.86 65.67 1vb7 h ILE 74 Cb 0.64 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1vb7 h ILE 74 CO -0.37 0.10 -0.28 -0.09 0.00 0.00 0.00 178.15 177.51 1vb7 h ARG 75 N 0.55 0.00 -0.87 2.37 2.43 0.86 -2.59 114.38 117.13 1vb7 h ARG 75 Ca 0.38 0.00 -0.61 0.00 -0.81 0.00 0.00 59.98 58.93 1vb7 h ARG 75 Cb 0.46 0.00 -0.36 0.00 -0.42 0.00 0.00 29.97 29.66 1vb7 h ARG 75 CO -0.32 0.28 0.05 1.04 -1.51 0.00 0.00 179.97 179.52 1vb7 n GLN 76 N -4.09 3.13 -4.30 0.20 6.02 0.50 -4.96 117.38 113.88 1vb7 n GLN 76 Ca -0.02 -3.71 -0.34 0.00 -0.01 0.00 0.00 57.00 52.92 1vb7 n GLN 76 Cb 0.34 -2.28 -0.13 0.00 1.02 0.00 0.00 30.24 29.19 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 -2.69 4.49 0.61 1.08 0.15 0.55 -4.88 113.70 113.03 1vb7 s SER 77 Ca 0.58 -0.26 -0.13 0.00 0.70 0.00 0.00 55.95 56.85 1vb7 s SER 77 Cb 0.46 -1.74 -0.04 0.00 -1.71 0.00 0.00 66.02 62.99 1vb7 s SER 77 CO 0.01 0.10 1.03 0.00 1.20 0.00 0.00 173.24 175.59 1vb7 s ALA 78 N 0.77 2.93 0.07 5.45 0.00 -1.26 -4.91 121.76 124.81 1vb7 s ALA 78 Ca -0.02 0.09 -0.12 0.00 0.00 0.00 0.00 51.96 51.91 1vb7 s ALA 78 Cb -0.15 -3.14 -0.06 0.00 0.00 0.00 0.00 23.12 19.78 1vb7 s ALA 78 CO 0.02 -0.74 0.44 0.45 0.00 0.00 0.00 175.76 175.93 1vb7 s SER 79 N -3.61 6.73 0.73 0.00 0.15 -1.26 -3.39 113.70 113.05 1vb7 s SER 79 Ca 0.58 0.90 -0.11 0.00 0.70 0.00 0.00 55.95 58.02 1vb7 s SER 79 Cb -0.12 -2.22 0.03 0.00 -1.71 0.00 0.00 66.02 62.00 1vb7 s SER 79 CO 0.46 0.20 1.07 -2.16 1.20 0.00 0.00 173.24 174.02 1vb7 s PRO 80 N -1.70 2.62 -0.37 5.44 0.04 -1.26 -4.94 135.00 134.83 1vb7 s PRO 80 Ca 0.32 0.84 -0.11 0.00 0.04 0.00 0.00 61.00 62.09 1vb7 s PRO 80 Cb -0.15 -1.96 0.03 0.00 0.04 0.00 0.00 34.50 32.45 1vb7 s PRO 80 CO 0.17 -1.30 0.20 -1.17 0.04 0.00 0.00 177.00 174.95 1vb7 s LEU 81 N -5.63 4.68 -0.31 -3.56 2.96 -0.89 -4.91 118.68 111.02 1vb7 s LEU 81 Ca 0.59 -0.97 -0.22 0.00 -0.22 0.00 0.00 54.13 53.31 1vb7 s LEU 81 Cb -0.14 -2.02 -0.00 0.00 0.50 0.00 0.00 46.19 44.52 1vb7 s LEU 81 CO 0.55 -0.37 0.71 -0.60 -1.32 0.00 0.00 176.35 175.31 1vb7 s ARG 82 N 1.55 3.92 -0.17 1.98 3.52 -1.26 -2.21 118.95 126.29 1vb7 s ARG 82 Ca 0.02 0.43 0.01 0.00 -0.13 0.00 0.00 55.73 56.06 1vb7 s ARG 82 Cb -0.19 -3.73 0.03 0.00 -1.56 0.00 0.00 34.95 29.50 1vb7 s ARG 82 CO 0.07 -0.63 -0.15 -0.51 -0.81 0.00 0.00 175.30 173.27 1vb7 s LEU 83 N 2.79 2.03 -0.36 -0.88 1.43 -0.86 0.20 118.68 123.02 1vb7 s LEU 83 Ca 0.29 -0.67 -0.24 0.00 -1.03 0.00 0.00 54.13 52.47 1vb7 s LEU 83 Cb -0.14 -1.29 0.01 0.00 0.03 0.00 0.00 46.19 44.80 1vb7 s LEU 83 CO 0.12 -0.07 0.83 -1.58 0.23 0.00 0.00 176.35 175.88 1vb7 s GLN 84 N 1.39 3.79 -0.05 1.70 0.74 -1.15 -0.39 119.66 125.70 1vb7 s GLN 84 Ca 0.03 0.41 -0.03 0.00 0.05 0.00 0.00 55.36 55.81 1vb7 s GLN 84 Cb -0.14 -3.80 -0.04 0.00 1.10 0.00 0.00 33.01 30.13 1vb7 s GLN 84 CO -0.10 -0.87 0.13 -0.51 -0.55 0.00 0.00 175.29 173.39 1vb7 s LEU 85 N 3.20 4.20 -0.53 3.68 1.43 0.52 0.21 118.68 131.39 1vb7 s LEU 85 Ca 0.33 0.32 -0.16 0.00 -1.03 0.00 0.00 54.13 53.59 1vb7 s LEU 85 Cb -0.13 -2.31 0.11 0.00 0.03 0.00 0.00 46.19 43.90 1vb7 s LEU 85 CO 0.17 0.32 0.51 -0.62 0.23 0.00 0.00 176.35 176.95 1vb7 s ASP 86 N -1.54 6.18 -0.38 2.29 -1.08 0.24 -0.01 116.67 122.38 1vb7 s ASP 86 Ca 0.21 -1.63 -0.04 0.00 -0.52 0.00 0.00 52.55 50.57 1vb7 s ASP 86 Cb -0.12 -2.22 0.09 0.00 -1.46 0.00 0.00 42.92 39.21 1vb7 s ASP 86 CO 0.12 -0.85 0.17 -0.60 0.52 0.00 0.00 175.17 174.53 1vb7 s ARG 87 N 1.76 2.28 -0.73 4.34 3.52 -1.26 -4.19 118.95 124.68 1vb7 s ARG 87 Ca 0.05 -1.57 0.02 0.00 -0.13 0.00 0.00 55.73 54.09 1vb7 s ARG 87 Cb -0.28 -3.54 0.18 0.00 -1.56 0.00 0.00 34.95 29.75 1vb7 s ARG 87 CO 0.04 -0.92 0.54 0.45 -0.81 0.00 0.00 175.30 174.60 1vb7 s SER 88 N 1.76 5.14 1.10 -2.12 0.15 -1.26 -4.13 113.70 114.33 1vb7 s SER 88 Ca 0.03 -3.61 -0.16 0.00 0.70 0.00 0.00 55.95 52.92 1vb7 s SER 88 Cb -0.22 -1.74 0.15 0.00 -1.71 0.00 0.00 66.02 62.50 1vb7 s SER 88 CO -0.02 -0.16 0.41 -0.24 1.20 0.00 0.00 173.24 174.44 1vb7 n SER 89 N 2.37 -2.00 -2.79 5.45 2.88 -1.26 -5.04 113.62 113.23 1vb7 n SER 89 Ca 0.17 -0.03 -0.06 0.00 -1.33 0.00 0.00 58.87 57.62 1vb7 n SER 89 Cb 0.35 -1.11 0.02 0.00 -0.75 0.00 0.00 64.21 62.73 1vb7 n SER 89 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vb7 n GLY 90 N 1.56 0.93 3.59 0.46 0.00 -1.26 -5.11 105.19 105.36 1vb7 n GLY 90 Ca 0.03 -1.20 -0.42 0.00 0.00 0.00 0.00 46.02 44.43 1vb7 n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1vb7 s PRO 91 N -2.07 3.44 0.10 1.61 0.04 -1.26 -4.93 135.00 131.93 1vb7 s PRO 91 Ca 0.17 0.78 -0.26 0.00 0.04 0.00 0.00 61.00 61.73 1vb7 s PRO 91 Cb -0.04 -4.08 0.08 0.00 0.04 0.00 0.00 34.50 30.50 1vb7 s PRO 91 CO 0.09 -1.75 0.86 -1.12 0.04 0.00 0.00 177.00 175.12 1vb7 s SER 92 N 4.34 -0.32 -0.28 6.66 0.01 -1.26 -5.16 113.70 117.69 1vb7 s SER 92 Ca 0.59 -0.20 -0.07 0.00 1.31 0.00 0.00 55.95 57.58 1vb7 s SER 92 Cb -0.13 0.48 0.14 0.00 0.21 0.00 0.00 66.02 66.73 1vb7 s SER 92 CO 0.30 -0.84 0.59 -0.94 0.41 0.00 0.00 173.24 172.76 1vb7 s SER 93 N -2.73 -1.01 0.00 2.44 1.04 -1.26 -5.28 113.70 106.91 1vb7 s SER 93 Ca 0.08 1.22 0.30 0.00 0.48 0.00 0.00 55.95 58.02 1vb7 s SER 93 Cb -0.02 2.06 1.43 0.00 0.10 0.00 0.00 66.02 69.60 1vb7 s SER 93 CO -0.04 -0.24 1.96 0.61 0.98 0.00 0.00 173.24 176.51