#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 6.08 -0.36 1.61 1.04 -1.26 -4.96 113.70 115.85 1vb7 s SER 2 Ca 0.00 -0.34 -0.03 0.00 0.48 0.00 0.00 55.95 56.06 1vb7 s SER 2 Cb 0.00 -2.56 0.07 0.00 0.10 0.00 0.00 66.02 63.64 1vb7 s SER 2 CO 0.00 -1.88 0.12 -0.55 0.98 0.00 0.00 173.24 171.90 1vb7 s SER 3 N 4.18 5.15 -0.26 7.02 0.15 -1.26 -5.04 113.70 123.64 1vb7 s SER 3 Ca 0.39 -1.58 -0.07 0.00 0.70 0.00 0.00 55.95 55.39 1vb7 s SER 3 Cb -0.09 -1.80 0.13 0.00 -1.71 0.00 0.00 66.02 62.55 1vb7 s SER 3 CO 0.16 -0.40 0.54 -0.83 1.20 0.00 0.00 173.24 173.91 1vb7 s GLY 4 N 1.56 -0.62 0.21 9.45 0.00 -1.26 -5.02 107.32 111.64 1vb7 s GLY 4 Ca 0.01 1.86 0.00 0.00 0.00 0.00 0.00 44.72 46.60 1vb7 s GLY 4 CO -0.02 2.86 0.00 -1.26 0.00 0.00 0.00 173.10 174.68 1vb7 n SER 5 N 5.42 -1.44 -4.71 1.64 2.88 -1.26 -5.10 113.62 111.05 1vb7 n SER 5 Ca -0.08 0.39 -0.37 0.00 -1.33 0.00 0.00 58.87 57.48 1vb7 n SER 5 Cb 0.50 1.54 -0.07 0.00 -0.75 0.00 0.00 64.21 65.42 1vb7 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1vb7 s SER 6 N -3.09 6.50 0.00 -3.46 0.15 -1.26 -4.95 113.70 107.59 1vb7 s SER 6 Ca 0.00 0.59 0.00 0.00 0.70 0.00 0.00 55.95 57.24 1vb7 s SER 6 Cb 0.00 -2.23 0.00 0.00 -1.71 0.00 0.00 66.02 62.08 1vb7 s SER 6 CO 0.00 0.01 0.00 0.61 1.20 0.00 0.00 173.24 175.06 1vb7 n GLY 7 N 3.54 4.13 3.75 9.45 0.00 -1.26 -4.82 105.19 119.98 1vb7 n GLY 7 Ca -0.09 -1.14 -0.24 0.00 0.00 0.00 0.00 46.02 44.54 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 3.59 0.24 0.99 0.20 0.22 -4.89 118.68 119.03 1vb7 s LEU 8 Ca 0.00 -0.33 0.10 0.00 0.69 0.00 0.00 54.13 54.59 1vb7 s LEU 8 Cb 0.00 -2.16 -0.04 0.00 -0.43 0.00 0.00 46.19 43.55 1vb7 s LEU 8 CO 0.00 0.02 -0.06 -0.89 -0.29 0.00 0.00 176.35 175.13 1vb7 s THR 9 N -2.00 3.23 -0.02 3.68 2.01 -1.26 0.19 115.64 121.47 1vb7 s THR 9 Ca 0.31 -1.89 0.00 0.00 0.31 0.00 0.00 61.69 60.43 1vb7 s THR 9 Cb -0.08 -2.68 0.02 0.00 0.01 0.00 0.00 72.50 69.77 1vb7 s THR 9 CO 0.22 -0.28 -0.00 0.54 -0.69 0.00 0.00 174.62 174.41 1vb7 s VAL 10 N -2.13 0.14 -0.36 3.82 0.11 -0.89 -4.93 120.40 116.17 1vb7 s VAL 10 Ca 0.29 0.04 -0.09 0.00 -2.93 0.00 0.00 61.98 59.29 1vb7 s VAL 10 Cb -0.07 -0.21 0.03 0.00 -1.53 0.00 0.00 36.38 34.60 1vb7 s VAL 10 CO 0.18 0.11 0.16 1.51 -3.33 0.00 0.00 175.10 173.72 1vb7 s ASP 11 N 0.67 5.55 -0.34 3.54 1.47 -1.25 -2.18 116.67 124.13 1vb7 s ASP 11 Ca -0.06 -1.04 -0.15 0.00 1.18 0.00 0.00 52.55 52.48 1vb7 s ASP 11 Cb -0.09 -1.96 -0.01 0.00 -0.34 0.00 0.00 42.92 40.51 1vb7 s ASP 11 CO -0.01 -0.35 0.34 -0.69 0.68 0.00 0.00 175.17 175.13 1vb7 s VAL 12 N 1.49 5.19 -0.02 2.11 1.01 0.38 -4.55 120.40 126.02 1vb7 s VAL 12 Ca 0.01 0.01 -0.30 0.00 0.00 0.00 0.00 61.98 61.70 1vb7 s VAL 12 Cb -0.19 -3.79 -0.07 0.00 0.00 0.00 0.00 36.38 32.33 1vb7 s VAL 12 CO 0.05 -0.07 1.72 0.00 0.00 0.00 0.00 175.10 176.80 1vb7 s ALA 13 N 1.96 3.62 0.57 5.51 0.00 -1.26 -2.02 121.76 130.14 1vb7 s ALA 13 Ca 0.11 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.11 1vb7 s ALA 13 Cb -0.17 -3.76 0.00 0.00 0.00 0.00 0.00 23.12 19.19 1vb7 s ALA 13 CO 0.11 -1.40 0.00 0.41 0.00 0.00 0.00 175.76 174.89 1vb7 n GLY 14 N 4.20 0.29 0.00 0.00 0.00 -1.26 -4.88 105.19 103.53 1vb7 n GLY 14 Ca 0.18 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.36 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 -0.50 0.62 -1.94 1.61 -0.04 -1.26 -5.09 135.00 128.40 1vb7 n PRO 15 Ca 0.00 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.17 1vb7 n PRO 15 Cb 0.00 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 33.53 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 2.83 1.10 0.55 0.00 -1.26 -4.63 121.76 116.86 1vb7 s ALA 16 Ca 0.00 -0.53 -0.18 0.00 0.00 0.00 0.00 51.96 51.24 1vb7 s ALA 16 Cb 0.00 -2.95 0.26 0.00 0.00 0.00 0.00 23.12 20.43 1vb7 s ALA 16 CO 0.00 -1.37 1.23 -1.25 0.00 0.00 0.00 175.76 174.37 1vb7 s PRO 17 N -5.43 -0.48 -0.17 0.00 0.04 -1.26 -5.13 135.00 122.57 1vb7 s PRO 17 Ca 0.60 -0.32 -0.14 0.00 0.04 0.00 0.00 61.00 61.18 1vb7 s PRO 17 Cb -0.11 -1.71 -0.08 0.00 0.04 0.00 0.00 34.50 32.64 1vb7 s PRO 17 CO 0.50 -3.18 -0.10 0.91 0.04 0.00 0.00 177.00 175.17 1vb7 n TRP 18 N -4.33 0.81 0.00 0.56 7.02 -1.26 -4.93 117.44 115.32 1vb7 n TRP 18 Ca 0.15 0.35 0.00 0.00 -1.02 0.00 0.00 57.50 56.99 1vb7 n TRP 18 Cb 0.59 -0.85 0.00 0.00 -2.42 0.00 0.00 31.31 28.64 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 1.53 1.55 3.11 6.99 0.00 -1.26 -3.07 105.19 114.04 1vb7 n GLY 19 Ca -0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 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 0.06 0.45 1.61 -0.12 -1.26 0.19 117.98 116.91 1vb7 s PHE 20 Ca 0.00 -0.19 0.05 0.00 -0.05 0.00 0.00 56.93 56.74 1vb7 s PHE 20 Cb 0.00 -0.06 0.05 0.00 -0.63 0.00 0.00 43.02 42.38 1vb7 s PHE 20 CO 0.00 -0.30 0.40 0.54 -0.05 0.00 0.00 175.22 175.81 1vb7 n ARG 21 N 1.35 0.81 -3.96 1.99 1.74 -0.56 -5.00 116.66 113.02 1vb7 n ARG 21 Ca -0.22 -2.70 -0.09 0.00 -0.77 0.00 0.00 57.85 54.07 1vb7 n ARG 21 Cb 0.56 0.19 -0.05 0.00 -1.02 0.00 0.00 32.46 32.14 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 -2.12 0.00 0.30 0.55 -4.36 -1.26 -3.56 121.20 110.76 1vb7 s ILE 22 Ca 0.30 -1.31 0.01 0.00 -0.26 0.00 0.00 60.65 59.40 1vb7 s ILE 22 Cb -0.02 -2.12 -0.00 0.00 1.25 0.00 0.00 42.46 41.57 1vb7 s ILE 22 CO 0.19 -0.02 0.37 -0.24 0.24 0.00 0.00 174.94 175.48 1vb7 n SER 23 N -0.38 -0.99 0.00 4.36 2.88 0.31 -4.68 113.62 115.11 1vb7 n SER 23 Ca -0.03 -2.76 0.00 0.00 -1.33 0.00 0.00 58.87 54.75 1vb7 n SER 23 Cb 0.62 1.97 0.00 0.00 -0.75 0.00 0.00 64.21 66.04 1vb7 n SER 23 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vb7 n GLY 24 N -0.53 2.84 0.00 0.46 0.00 -1.26 -2.77 105.19 103.93 1vb7 n GLY 24 Ca 0.03 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 1.07 0.23 -0.02 0.00 0.41 -4.10 105.19 102.78 1vb7 n GLY 25 Ca 0.00 -2.28 0.16 0.00 0.00 0.00 0.00 46.02 43.90 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 0.00 -0.06 1.61 2.43 -0.38 0.71 114.38 118.69 1vb7 h ARG 26 Ca 0.00 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 1vb7 h ARG 26 Cb 0.00 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1vb7 h ARG 26 CO 0.00 0.00 -0.35 0.22 -1.51 0.00 0.00 179.97 178.33 1vb7 h ASP 27 N 0.00 0.40 -0.41 -3.80 1.82 -1.84 -3.12 116.42 109.47 1vb7 h ASP 27 Ca 0.00 -0.67 0.00 0.00 -0.39 0.00 0.00 57.03 55.97 1vb7 h ASP 27 Cb 0.38 -0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.27 1vb7 h ASP 27 CO 0.00 1.01 0.00 0.49 -1.61 0.00 0.00 179.24 179.13 1vb7 n PHE 28 N -4.40 0.62 -1.94 0.28 3.01 -1.01 -4.88 117.46 109.15 1vb7 n PHE 28 Ca -0.09 -0.29 -0.20 0.00 1.01 0.00 0.00 57.45 57.88 1vb7 n PHE 28 Cb 0.52 -0.03 -0.05 0.00 -0.01 0.00 0.00 39.48 39.91 1vb7 n PHE 28 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 1vb7 n HIS 29 N 0.70 -0.45 -4.41 1.38 8.25 -0.43 -4.85 115.22 115.41 1vb7 n HIS 29 Ca 0.14 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.37 1vb7 n HIS 29 Cb 0.39 -3.64 -0.10 0.00 1.12 0.00 0.00 29.99 27.76 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 -2.86 2.18 0.46 1.59 -4.23 0.23 -4.95 115.64 108.08 1vb7 s THR 30 Ca 0.00 -2.23 -0.21 0.00 -1.18 0.00 0.00 61.69 58.06 1vb7 s THR 30 Cb 0.00 -2.14 -0.09 0.00 1.34 0.00 0.00 72.50 71.61 1vb7 s THR 30 CO 0.00 -0.39 1.04 -2.16 -0.54 0.00 0.00 174.62 172.57 1vb7 s PRO 31 N -3.31 3.89 -0.60 3.99 0.04 -1.26 0.16 135.00 137.90 1vb7 s PRO 31 Ca 0.25 1.40 -0.27 0.00 0.04 0.00 0.00 61.00 62.42 1vb7 s PRO 31 Cb -0.04 -2.20 -0.02 0.00 0.04 0.00 0.00 34.50 32.28 1vb7 s PRO 31 CO 0.11 -0.36 1.82 0.42 0.04 0.00 0.00 177.00 179.03 1vb7 s ILE 32 N -1.90 3.39 0.10 0.56 -1.09 -1.26 -3.65 121.20 117.34 1vb7 s ILE 32 Ca 0.65 0.24 0.05 0.00 -2.23 0.00 0.00 60.65 59.37 1vb7 s ILE 32 Cb -0.18 -3.98 -0.04 0.00 -1.58 0.00 0.00 42.46 36.69 1vb7 s ILE 32 CO 0.22 -0.92 -0.02 -0.63 -1.23 0.00 0.00 174.94 172.35 1vb7 s ILE 33 N 8.72 3.89 0.13 2.92 1.01 -1.12 -0.36 121.20 136.39 1vb7 s ILE 33 Ca 0.66 -1.06 -0.25 0.00 0.00 0.00 0.00 60.65 60.00 1vb7 s ILE 33 Cb -0.13 -2.85 -0.07 0.00 0.01 0.00 0.00 42.46 39.42 1vb7 s ILE 33 CO 0.21 0.11 0.76 -0.69 0.00 0.00 0.00 174.94 175.33 1vb7 s VAL 34 N -1.31 4.49 -0.24 2.92 1.01 -1.15 0.11 120.40 126.23 1vb7 s VAL 34 Ca 0.25 1.66 -0.13 0.00 0.00 0.00 0.00 61.98 63.76 1vb7 s VAL 34 Cb -0.11 -4.12 -0.10 0.00 0.00 0.00 0.00 36.38 32.04 1vb7 s VAL 34 CO 0.18 0.48 -0.32 0.35 0.00 0.00 0.00 175.10 175.78 1vb7 n THR 35 N 1.97 1.38 -4.24 3.92 -2.24 -1.23 0.01 114.28 113.84 1vb7 n THR 35 Ca -0.05 -0.28 -0.18 0.00 -2.27 0.00 0.00 64.05 61.27 1vb7 n THR 35 Cb 0.49 -1.90 -0.11 0.00 -2.10 0.00 0.00 70.33 66.71 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 -2.50 1.01 -0.18 -0.78 2.36 -1.26 -4.79 119.74 113.60 1vb7 s LYS 36 Ca -0.33 -1.21 -0.04 0.00 -2.55 0.00 0.00 55.97 51.84 1vb7 s LYS 36 Cb 0.12 -0.94 0.06 0.00 -1.05 0.00 0.00 37.83 36.02 1vb7 s LYS 36 CO 0.43 0.19 0.06 0.08 1.55 0.00 0.00 175.35 177.66 1vb7 s VAL 37 N -1.98 0.20 -0.13 4.02 1.01 -1.26 -1.50 120.40 120.77 1vb7 s VAL 37 Ca 0.08 -0.35 -0.39 0.00 0.00 0.00 0.00 61.98 61.33 1vb7 s VAL 37 Cb -0.06 -0.79 -0.16 0.00 0.00 0.00 0.00 36.38 35.38 1vb7 s VAL 37 CO 0.03 -0.24 1.59 0.41 0.00 0.00 0.00 175.10 176.89 1vb7 n THR 38 N 5.17 0.19 -2.18 3.92 -1.04 0.51 -4.89 114.28 115.96 1vb7 n THR 38 Ca -0.08 -0.03 -0.36 0.00 -2.04 0.00 0.00 64.05 61.53 1vb7 n THR 38 Cb 0.48 -1.10 0.01 0.00 -1.82 0.00 0.00 70.33 67.90 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 2.35 3.43 -1.68 -2.82 2.12 -1.26 -2.96 118.70 117.87 1vb7 s GLU 39 Ca 0.93 1.76 -0.19 0.00 0.36 0.00 0.00 54.97 57.82 1vb7 s GLU 39 Cb -1.01 -2.16 0.19 0.00 0.26 0.00 0.00 34.13 31.41 1vb7 s GLU 39 CO 0.58 -0.82 0.48 0.54 -0.54 0.00 0.00 175.26 175.50 1vb7 n ARG 40 N -1.02 -0.76 0.00 4.30 5.12 -1.26 -4.87 116.66 118.17 1vb7 n ARG 40 Ca 0.10 0.12 0.00 0.00 -1.93 0.00 0.00 57.85 56.14 1vb7 n ARG 40 Cb 0.49 -4.18 0.00 0.00 -1.16 0.00 0.00 32.46 27.62 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 -1.17 2.79 0.08 -0.13 0.00 -1.16 -4.92 105.19 100.68 1vb7 n GLY 41 Ca 0.06 -1.87 -0.15 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 1.57 -1.81 -3.07 116.57 114.86 1vb7 h LYS 42 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1vb7 h LYS 42 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1vb7 h LYS 42 CO 0.00 0.80 0.00 0.00 -0.57 0.00 0.00 179.45 179.68 1vb7 n ALA 43 N -3.03 -0.29 -0.38 3.86 0.00 -1.21 -1.56 120.51 117.90 1vb7 n ALA 43 Ca -0.17 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.27 1vb7 n ALA 43 Cb 0.48 0.07 0.05 0.00 0.00 0.00 0.00 19.45 20.05 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 -0.00 -0.86 0.00 4.81 -1.71 0.99 114.58 117.80 1vb7 h GLU 44 Ca 0.00 0.00 0.20 0.00 -0.13 0.00 0.00 59.36 59.43 1vb7 h GLU 44 Cb 0.00 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 29.22 1vb7 h GLU 44 CO 0.00 -0.00 -0.09 0.00 -0.73 0.00 0.00 179.01 178.19 1vb7 h ALA 45 N 1.44 0.78 -3.00 2.92 0.00 -1.43 -3.14 119.26 116.84 1vb7 h ALA 45 Ca 0.36 0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.58 1vb7 h ALA 45 Cb 0.61 0.57 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1vb7 h ALA 45 CO -1.00 -0.45 0.00 0.00 0.00 0.00 0.00 179.25 177.81 1vb7 n ALA 46 N -3.20 0.00 -2.13 0.00 0.00 0.34 -4.94 120.51 110.58 1vb7 n ALA 46 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.58 1vb7 n ALA 46 Cb 0.52 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.98 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 0.00 -0.32 -4.70 0.00 2.03 -0.87 -4.94 116.55 107.76 1vb7 n ASP 47 Ca 0.00 -0.94 -0.35 0.00 0.52 0.00 0.00 54.79 54.02 1vb7 n ASP 47 Cb 0.00 0.13 -0.09 0.00 -0.72 0.00 0.00 41.12 40.44 1vb7 n ASP 47 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1vb7 s LEU 48 N -0.57 4.09 0.20 -2.67 2.96 -1.16 -4.86 118.68 116.67 1vb7 s LEU 48 Ca 0.01 0.18 0.04 0.00 -0.22 0.00 0.00 54.13 54.14 1vb7 s LEU 48 Cb 0.06 -2.06 -0.05 0.00 0.50 0.00 0.00 46.19 44.65 1vb7 s LEU 48 CO -0.02 0.16 -0.05 -0.13 -1.32 0.00 0.00 176.35 175.00 1vb7 s ARG 49 N 0.45 1.22 0.01 1.98 0.52 -1.26 -3.77 118.95 118.10 1vb7 s ARG 49 Ca 0.07 -1.58 -0.30 0.00 -0.52 0.00 0.00 55.73 53.39 1vb7 s ARG 49 Cb -0.12 -0.63 -0.04 0.00 0.52 0.00 0.00 34.95 34.68 1vb7 s ARG 49 CO -0.01 -0.02 1.19 -1.25 0.02 0.00 0.00 175.30 175.23 1vb7 s PRO 50 N -3.81 4.40 0.00 3.54 0.04 -1.26 -3.21 135.00 134.70 1vb7 s PRO 50 Ca 0.23 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.99 1vb7 s PRO 50 Cb 0.04 -3.45 0.00 0.00 0.04 0.00 0.00 34.50 31.13 1vb7 s PRO 50 CO 0.05 -0.33 0.00 0.41 0.04 0.00 0.00 177.00 177.17 1vb7 n GLY 51 N 3.27 2.46 3.58 0.56 0.00 0.10 -4.90 105.19 110.25 1vb7 n GLY 51 Ca 0.10 -0.75 -0.55 0.00 0.00 0.00 0.00 46.02 44.83 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 0.18 1.23 -4.56 1.61 8.00 -1.20 -4.36 116.55 117.46 1vb7 n ASP 52 Ca 0.00 1.13 -0.43 0.00 0.71 0.00 0.00 54.79 56.20 1vb7 n ASP 52 Cb 0.00 -1.11 -0.05 0.00 -0.02 0.00 0.00 41.12 39.94 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 0.57 4.68 -0.46 0.53 1.01 -1.26 -2.95 121.20 123.32 1vb7 s ILE 53 Ca 0.87 0.61 -0.28 0.00 0.00 0.00 0.00 60.65 61.85 1vb7 s ILE 53 Cb -1.06 -4.27 0.00 0.00 0.01 0.00 0.00 42.46 37.14 1vb7 s ILE 53 CO 0.51 -0.60 1.55 -0.63 0.00 0.00 0.00 174.94 175.78 1vb7 s ILE 54 N 3.21 3.70 -0.09 2.92 1.01 0.52 0.77 121.20 133.24 1vb7 s ILE 54 Ca 0.30 0.66 -0.10 0.00 0.00 0.00 0.00 60.65 61.51 1vb7 s ILE 54 Cb -0.12 -4.12 -0.08 0.00 0.01 0.00 0.00 42.46 38.15 1vb7 s ILE 54 CO 0.20 -0.82 0.33 0.58 0.00 0.00 0.00 174.94 175.23 1vb7 h VAL 55 N 6.57 0.46 -2.24 2.92 2.07 0.26 -3.40 116.25 122.89 1vb7 h VAL 55 Ca -0.28 -1.24 -0.55 0.00 0.82 0.00 0.00 66.70 65.45 1vb7 h VAL 55 Cb 1.12 0.85 -0.13 0.00 -1.52 0.00 0.00 31.29 31.61 1vb7 h VAL 55 CO 1.12 0.15 -0.60 0.00 0.02 0.00 0.00 177.57 178.26 1vb7 s ALA 56 N -2.78 2.79 -0.28 1.67 0.00 -1.00 0.19 121.76 122.35 1vb7 s ALA 56 Ca -0.06 -2.07 -0.01 0.00 0.00 0.00 0.00 51.96 49.82 1vb7 s ALA 56 Cb -0.00 0.43 0.09 0.00 0.00 0.00 0.00 23.12 23.64 1vb7 s ALA 56 CO 0.22 -0.22 0.07 0.42 0.00 0.00 0.00 175.76 176.25 1vb7 s ILE 57 N -3.03 0.87 -1.18 0.00 1.01 0.51 -1.76 121.20 117.63 1vb7 s ILE 57 Ca 0.34 -1.19 0.00 0.00 0.00 0.00 0.00 60.65 59.80 1vb7 s ILE 57 Cb 0.09 -1.54 0.00 0.00 0.01 0.00 0.00 42.46 41.02 1vb7 s ILE 57 CO 0.16 -0.51 0.00 0.59 0.00 0.00 0.00 174.94 175.18 1vb7 n ASN 58 N 4.87 -4.32 0.00 3.58 3.02 0.57 -1.59 115.26 121.39 1vb7 n ASN 58 Ca -0.05 0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.77 1vb7 n ASN 58 Cb 0.43 -2.83 0.00 0.00 -0.61 0.00 0.00 39.78 36.77 1vb7 n ASN 58 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vb7 n GLY 59 N -1.59 0.30 3.58 7.41 0.00 -1.24 -4.92 105.19 108.73 1vb7 n GLY 59 Ca -0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.87 3.83 0.38 1.61 0.74 -0.62 -5.01 119.66 119.73 1vb7 s GLN 60 Ca 0.00 -0.10 -0.22 0.00 0.05 0.00 0.00 55.36 55.09 1vb7 s GLN 60 Cb 0.00 -3.72 -0.16 0.00 1.10 0.00 0.00 33.01 30.23 1vb7 s GLN 60 CO 0.00 -0.40 0.12 0.43 -0.55 0.00 0.00 175.29 174.89 1vb7 n SER 61 N 5.42 -2.71 -0.12 6.67 7.64 -1.26 0.19 113.62 129.44 1vb7 n SER 61 Ca -0.08 0.83 0.01 0.00 1.01 0.00 0.00 58.87 60.64 1vb7 n SER 61 Cb 0.50 -0.88 0.01 0.00 -1.01 0.00 0.00 64.21 62.83 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 -0.92 1.54 0.18 -0.43 0.00 0.51 -4.51 120.51 116.87 1vb7 n ALA 62 Ca 0.12 -0.90 0.05 0.00 0.00 0.00 0.00 53.44 52.71 1vb7 n ALA 62 Cb 0.38 -0.15 0.52 0.00 0.00 0.00 0.00 19.45 20.20 1vb7 n ALA 62 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1vb7 h GLU 63 N 0.00 0.13 -1.51 0.00 4.81 -1.76 -2.71 114.58 113.53 1vb7 h GLU 63 Ca 0.00 -0.02 -0.57 0.00 -0.13 0.00 0.00 59.36 58.64 1vb7 h GLU 63 Cb 1.00 -0.02 -0.42 0.00 0.63 0.00 0.00 28.75 29.94 1vb7 h GLU 63 CO 0.00 0.18 -0.76 0.09 -0.73 0.00 0.00 179.01 177.79 1vb7 n ASN 64 N -4.41 4.47 -4.36 1.04 3.02 -1.26 -4.73 115.26 109.02 1vb7 n ASN 64 Ca -0.01 -3.65 -0.36 0.00 -0.03 0.00 0.00 54.58 50.52 1vb7 n ASN 64 Cb 0.17 -0.47 -0.13 0.00 -0.61 0.00 0.00 39.78 38.74 1vb7 n ASN 64 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1vb7 s MET 65 N -3.51 3.32 0.85 3.52 -1.94 -1.02 -4.79 119.30 115.73 1vb7 s MET 65 Ca 0.47 -0.69 -0.11 0.00 -1.71 0.00 0.00 55.69 53.65 1vb7 s MET 65 Cb 0.40 -3.26 0.11 0.00 2.01 0.00 0.00 34.83 34.09 1vb7 s MET 65 CO -0.17 -0.31 1.14 -0.51 -0.01 0.00 0.00 175.02 175.16 1vb7 s LEU 66 N 1.52 2.96 0.62 -0.03 1.43 -1.26 0.07 118.68 123.99 1vb7 s LEU 66 Ca 0.04 2.10 0.35 0.00 -1.03 0.00 0.00 54.13 55.59 1vb7 s LEU 66 Cb -0.16 -4.56 1.99 0.00 0.03 0.00 0.00 46.19 43.49 1vb7 s LEU 66 CO 0.01 -2.70 2.24 -0.74 0.23 0.00 0.00 176.35 175.39 1vb7 h HIS 67 N -1.48 0.00 0.00 0.29 -0.00 -1.88 0.35 115.15 112.44 1vb7 h HIS 67 Ca -0.44 0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 59.83 1vb7 h HIS 67 Cb 1.26 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.65 1vb7 h HIS 67 CO 0.52 0.00 -1.48 0.00 -0.00 0.00 0.00 177.93 176.98 1vb7 n ALA 68 N -2.20 2.24 0.17 5.26 0.00 -1.26 -3.07 120.51 121.64 1vb7 n ALA 68 Ca -0.02 -0.51 -0.08 0.00 0.00 0.00 0.00 53.44 52.84 1vb7 n ALA 68 Cb 0.16 -0.90 -0.04 0.00 0.00 0.00 0.00 19.45 18.67 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 -0.48 -0.78 0.00 4.39 -0.69 -1.03 114.58 115.99 1vb7 h GLU 69 Ca -0.12 0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 1vb7 h GLU 69 Cb 1.35 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 30.07 1vb7 h GLU 69 CO 0.02 -0.32 0.48 0.00 -1.16 0.00 0.00 179.01 178.03 1vb7 h ALA 70 N -1.22 1.38 -0.64 3.43 0.00 -1.28 0.49 119.26 121.41 1vb7 h ALA 70 Ca -0.05 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1vb7 h ALA 70 Cb 0.38 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1vb7 h ALA 70 CO 0.08 0.54 0.38 1.96 0.00 0.00 0.00 179.25 182.22 1vb7 h GLN 71 N 1.06 0.88 -0.07 0.00 1.08 -1.61 0.61 115.11 117.07 1vb7 h GLN 71 Ca 0.28 -0.08 -0.06 0.00 -1.45 0.00 0.00 58.65 57.34 1vb7 h GLN 71 Cb -0.06 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 27.19 1vb7 h GLN 71 CO -0.05 0.63 -0.19 1.03 -0.95 0.00 0.00 178.83 179.30 1vb7 h SER 72 N 0.87 0.28 0.46 1.46 0.87 -0.35 -1.95 113.55 115.20 1vb7 h SER 72 Ca 0.23 -0.61 -0.01 0.00 -1.23 0.00 0.00 61.79 60.17 1vb7 h SER 72 Cb -0.02 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 1vb7 h SER 72 CO -0.04 0.84 -0.35 0.11 -0.53 0.00 0.00 176.83 176.86 1vb7 h LYS 73 N -0.26 -0.77 -0.73 2.24 1.57 0.14 1.48 116.57 120.25 1vb7 h LYS 73 Ca -0.01 0.05 0.15 0.00 -1.87 0.00 0.00 60.65 58.98 1vb7 h LYS 73 Cb 0.81 0.17 -0.10 0.00 0.08 0.00 0.00 32.23 33.19 1vb7 h LYS 73 CO 0.04 -0.51 0.22 0.82 -0.57 0.00 0.00 179.45 179.45 1vb7 h ILE 74 N -0.80 0.58 -0.20 1.86 2.04 0.16 1.57 117.51 122.72 1vb7 h ILE 74 Ca -0.05 -0.11 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 1vb7 h ILE 74 Cb 0.68 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1vb7 h ILE 74 CO 0.01 0.06 -0.00 -0.09 0.00 0.00 0.00 178.15 178.12 1vb7 h ARG 75 N 0.33 0.36 -1.08 2.37 1.12 -0.70 -2.83 114.38 113.95 1vb7 h ARG 75 Ca 0.40 -0.12 -0.43 0.00 -1.11 0.00 0.00 59.98 58.72 1vb7 h ARG 75 Cb 0.65 -0.03 -0.23 0.00 -0.01 0.00 0.00 29.97 30.35 1vb7 h ARG 75 CO -0.46 0.56 0.55 1.04 -3.11 0.00 0.00 179.97 178.56 1vb7 n GLN 76 N -4.68 2.06 -3.47 0.20 1.13 0.50 -4.91 117.38 108.20 1vb7 n GLN 76 Ca -0.04 -2.35 -0.37 0.00 -1.94 0.00 0.00 57.00 52.30 1vb7 n GLN 76 Cb 0.23 -1.92 -0.07 0.00 0.11 0.00 0.00 30.24 28.59 1vb7 n GLN 76 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1vb7 s SER 77 N -0.79 6.41 0.39 1.08 0.15 0.52 -4.87 113.70 116.60 1vb7 s SER 77 Ca 0.45 0.48 -0.26 0.00 0.70 0.00 0.00 55.95 57.33 1vb7 s SER 77 Cb 0.37 -2.20 -0.09 0.00 -1.71 0.00 0.00 66.02 62.39 1vb7 s SER 77 CO 0.05 0.01 1.17 0.00 1.20 0.00 0.00 173.24 175.68 1vb7 s ALA 78 N 0.91 3.18 0.25 5.45 0.00 -1.26 -4.89 121.76 125.41 1vb7 s ALA 78 Ca 0.17 0.98 -0.12 0.00 0.00 0.00 0.00 51.96 52.99 1vb7 s ALA 78 Cb -0.14 -3.38 -0.08 0.00 0.00 0.00 0.00 23.12 19.52 1vb7 s ALA 78 CO 0.06 -0.52 0.62 -1.54 0.00 0.00 0.00 175.76 174.38 1vb7 s SER 79 N -1.10 6.71 0.74 0.00 1.04 -1.26 -3.86 113.70 115.98 1vb7 s SER 79 Ca 0.56 1.08 -0.11 0.00 0.48 0.00 0.00 55.95 57.96 1vb7 s SER 79 Cb -0.31 -2.29 0.03 0.00 0.10 0.00 0.00 66.02 63.55 1vb7 s SER 79 CO 0.39 -0.10 1.08 -2.16 0.98 0.00 0.00 173.24 173.43 1vb7 s PRO 80 N -2.77 2.57 -0.23 4.02 0.04 -1.26 -5.00 135.00 132.38 1vb7 s PRO 80 Ca 0.49 0.82 -0.16 0.00 0.04 0.00 0.00 61.00 62.19 1vb7 s PRO 80 Cb -0.11 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1vb7 s PRO 80 CO 0.20 -1.32 0.40 -1.17 0.04 0.00 0.00 177.00 175.15 1vb7 s LEU 81 N -5.64 4.11 -0.43 -3.56 2.96 -0.86 -4.91 118.68 110.35 1vb7 s LEU 81 Ca 0.59 0.44 0.02 0.00 -0.22 0.00 0.00 54.13 54.96 1vb7 s LEU 81 Cb -0.14 -2.50 0.12 0.00 0.50 0.00 0.00 46.19 44.16 1vb7 s LEU 81 CO 0.55 -0.13 0.17 -0.60 -1.32 0.00 0.00 176.35 175.02 1vb7 s ARG 82 N 1.66 1.83 -0.24 1.98 3.52 -1.25 -0.47 118.95 125.98 1vb7 s ARG 82 Ca 0.18 -2.09 -0.11 0.00 -0.13 0.00 0.00 55.73 53.57 1vb7 s ARG 82 Cb -0.15 -3.38 -0.05 0.00 -1.56 0.00 0.00 34.95 29.81 1vb7 s ARG 82 CO 0.09 -1.03 0.20 -0.51 -0.81 0.00 0.00 175.30 173.24 1vb7 s LEU 83 N 0.61 4.11 -0.56 -0.88 2.01 -0.93 0.21 118.68 123.25 1vb7 s LEU 83 Ca 0.12 0.16 -0.25 0.00 0.01 0.00 0.00 54.13 54.18 1vb7 s LEU 83 Cb -0.22 -2.17 0.04 0.00 0.01 0.00 0.00 46.19 43.85 1vb7 s LEU 83 CO -0.05 0.03 0.97 -1.58 1.01 0.00 0.00 176.35 176.73 1vb7 s GLN 84 N 1.19 3.34 0.21 1.70 0.74 -0.72 -2.09 119.66 124.02 1vb7 s GLN 84 Ca 0.09 -0.24 -0.15 0.00 0.05 0.00 0.00 55.36 55.12 1vb7 s GLN 84 Cb -0.14 -4.06 -0.08 0.00 1.10 0.00 0.00 33.01 29.83 1vb7 s GLN 84 CO 0.06 -1.53 0.62 -0.51 -0.55 0.00 0.00 175.29 173.37 1vb7 s LEU 85 N 4.09 4.26 -0.51 3.68 1.43 0.50 0.23 118.68 132.36 1vb7 s LEU 85 Ca 0.31 1.15 -0.14 0.00 -1.03 0.00 0.00 54.13 54.43 1vb7 s LEU 85 Cb -0.12 -3.56 0.12 0.00 0.03 0.00 0.00 46.19 42.66 1vb7 s LEU 85 CO 0.19 -0.00 0.44 -0.62 0.23 0.00 0.00 176.35 176.59 1vb7 s ASP 86 N -1.93 6.01 -0.30 2.29 2.15 0.23 0.70 116.67 125.83 1vb7 s ASP 86 Ca 0.44 -1.78 0.02 0.00 0.43 0.00 0.00 52.55 51.65 1vb7 s ASP 86 Cb -0.14 -2.14 0.07 0.00 -0.30 0.00 0.00 42.92 40.42 1vb7 s ASP 86 CO 0.20 -0.78 -0.02 -0.60 -0.17 0.00 0.00 175.17 173.80 1vb7 s ARG 87 N 1.52 2.04 -0.87 4.34 3.52 -1.26 -4.26 118.95 123.99 1vb7 s ARG 87 Ca 0.04 -1.52 0.01 0.00 -0.13 0.00 0.00 55.73 54.12 1vb7 s ARG 87 Cb -0.28 -3.09 0.27 0.00 -1.56 0.00 0.00 34.95 30.29 1vb7 s ARG 87 CO 0.02 -0.72 1.08 0.45 -0.81 0.00 0.00 175.30 175.31 1vb7 n SER 88 N 4.43 5.01 -3.18 -2.12 2.88 -1.26 -4.22 113.62 115.15 1vb7 n SER 88 Ca -0.08 -3.39 -0.11 0.00 -1.33 0.00 0.00 58.87 53.96 1vb7 n SER 88 Cb 0.42 -0.98 -0.01 0.00 -0.75 0.00 0.00 64.21 62.89 1vb7 n SER 88 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1vb7 s SER 89 N -1.88 0.29 0.07 -3.46 0.15 -1.26 -5.16 113.70 102.44 1vb7 s SER 89 Ca 0.35 -1.21 -0.12 0.00 0.70 0.00 0.00 55.95 55.67 1vb7 s SER 89 Cb 0.08 0.76 -0.06 0.00 -1.71 0.00 0.00 66.02 65.09 1vb7 s SER 89 CO 0.03 -1.50 0.43 -0.83 1.20 0.00 0.00 173.24 172.57 1vb7 s GLY 90 N -3.11 2.40 0.18 9.45 0.00 -1.26 -5.09 107.32 109.88 1vb7 s GLY 90 Ca 0.21 -0.30 -0.03 0.00 0.00 0.00 0.00 44.72 44.60 1vb7 s GLY 90 CO 0.14 -0.03 0.20 -1.55 0.00 0.00 0.00 173.10 171.85 1vb7 n PRO 91 N 1.12 -0.77 0.00 2.90 -0.04 -1.26 -4.17 135.00 132.78 1vb7 n PRO 91 Ca -0.09 -0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.06 1vb7 n PRO 91 Cb 0.52 -0.24 0.00 0.00 -0.04 0.00 0.00 33.50 33.74 1vb7 n PRO 91 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1vb7 n SER 92 N -3.22 0.00 -3.90 3.54 2.88 -1.26 -4.54 113.62 107.11 1vb7 n SER 92 Ca 0.03 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.34 1vb7 n SER 92 Cb 0.10 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.39 1vb7 n SER 92 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1vb7 s SER 93 N 0.00 1.36 0.00 -3.46 0.01 -1.26 -5.34 113.70 105.01 1vb7 s SER 93 Ca 0.00 -0.18 0.00 0.00 1.31 0.00 0.00 55.95 57.08 1vb7 s SER 93 Cb 0.00 -0.57 0.00 0.00 0.21 0.00 0.00 66.02 65.66 1vb7 s SER 93 CO 0.00 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.19