#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jvc s PRO 2 N 0.00 3.36 0.32 1.61 0.04 -1.26 -5.06 135.00 134.01 2jvc s PRO 2 Ca 0.00 1.61 0.02 0.00 0.04 0.00 0.00 61.00 62.67 2jvc s PRO 2 Cb 0.00 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 2jvc s PRO 2 CO 0.00 -0.85 0.36 -0.48 0.04 0.00 0.00 177.00 176.07 2jvc s LEU 3 N -3.80 1.33 0.00 -3.56 2.34 -1.26 -5.02 118.68 108.72 2jvc s LEU 3 Ca 0.73 -1.59 0.00 0.00 0.06 0.00 0.00 54.13 53.33 2jvc s LEU 3 Cb -0.24 0.99 0.00 0.00 -0.56 0.00 0.00 46.19 46.38 2jvc s LEU 3 CO 0.27 -1.15 0.00 0.61 -1.06 0.00 0.00 176.35 175.01 2jvc n GLY 4 N -0.56 3.04 3.39 -3.48 0.00 -1.26 -5.14 105.19 101.18 2jvc n GLY 4 Ca 0.04 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.31 2jvc n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jvc n SER 5 N 0.00 -2.11 -0.92 1.61 7.64 -1.26 -4.61 113.62 113.96 2jvc n SER 5 Ca 0.00 0.43 0.00 0.00 1.01 0.00 0.00 58.87 60.31 2jvc n SER 5 Cb 0.00 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 62.04 2jvc n SER 5 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 2jvc n MET 6 N -0.87 0.00 -4.05 1.43 0.00 0.06 -5.00 117.12 108.69 2jvc n MET 6 Ca 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 57.70 57.70 2jvc n MET 6 Cb 0.52 0.00 -0.10 0.00 0.00 0.00 0.00 33.22 33.64 2jvc n MET 6 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 2jvc s GLN 7 N -1.77 0.58 0.21 3.17 1.11 -1.21 0.15 119.66 121.90 2jvc s GLN 7 Ca 0.00 -1.10 0.05 0.00 0.01 0.00 0.00 55.36 54.32 2jvc s GLN 7 Cb 0.00 0.20 -0.05 0.00 -1.01 0.00 0.00 33.01 32.16 2jvc s GLN 7 CO 0.00 -0.11 -0.07 0.42 0.01 0.00 0.00 175.29 175.54 2jvc s ILE 8 N -3.52 1.30 -0.15 1.08 1.01 0.49 -2.97 121.20 118.45 2jvc s ILE 8 Ca 0.03 -2.09 0.00 0.00 0.00 0.00 0.00 60.65 58.59 2jvc s ILE 8 Cb 0.05 -2.15 -0.00 0.00 0.01 0.00 0.00 42.46 40.36 2jvc s ILE 8 CO -0.09 -0.50 -0.15 -0.36 0.00 0.00 0.00 174.94 173.84 2jvc s PHE 9 N -3.24 2.78 -0.11 3.97 0.08 0.12 -1.74 117.98 119.84 2jvc s PHE 9 Ca 0.24 -0.99 0.02 0.00 0.12 0.00 0.00 56.93 56.32 2jvc s PHE 9 Cb 0.03 -1.88 -0.01 0.00 -0.57 0.00 0.00 43.02 40.59 2jvc s PHE 9 CO 0.06 -0.44 -0.19 0.08 -0.10 0.00 0.00 175.22 174.64 2jvc s VAL 10 N 0.76 2.57 -0.31 -0.44 1.01 -0.17 -2.09 120.40 121.72 2jvc s VAL 10 Ca -0.06 -0.84 -0.07 0.00 0.00 0.00 0.00 61.98 61.00 2jvc s VAL 10 Cb -0.15 -2.03 0.02 0.00 0.00 0.00 0.00 36.38 34.21 2jvc s VAL 10 CO 0.01 0.54 0.10 -0.75 0.00 0.00 0.00 175.10 175.00 2jvc s LYS 11 N 0.28 2.98 0.73 2.72 2.20 -0.84 -1.50 119.74 126.31 2jvc s LYS 11 Ca -0.13 -0.94 -0.11 0.00 -0.36 0.00 0.00 55.97 54.43 2jvc s LYS 11 Cb -0.17 -3.44 0.03 0.00 -1.51 0.00 0.00 37.83 32.75 2jvc s LYS 11 CO 0.07 -0.51 1.07 0.95 -0.36 0.00 0.00 175.35 176.57 2jvc s THR 12 N 1.49 3.70 0.52 3.43 -4.23 -0.89 0.69 115.64 120.35 2jvc s THR 12 Ca 0.02 0.55 0.39 0.00 -1.18 0.00 0.00 61.69 61.47 2jvc s THR 12 Cb -0.18 -3.22 0.39 0.00 1.34 0.00 0.00 72.50 70.83 2jvc s THR 12 CO 0.03 -0.72 2.19 0.25 -0.54 0.00 0.00 174.62 175.83 2jvc h LEU 13 N -0.89 0.00 -0.98 4.79 5.85 -1.72 0.26 115.31 122.62 2jvc h LEU 13 Ca -0.44 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.28 2jvc h LEU 13 Cb 1.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 2jvc h LEU 13 CO 0.56 0.00 0.00 0.35 -0.34 0.00 0.00 178.44 179.01 2jvc n THR 14 N -2.91 0.25 -2.49 1.05 -2.24 -1.26 -4.92 114.28 101.75 2jvc n THR 14 Ca -0.03 -0.33 -0.08 0.00 -2.27 0.00 0.00 64.05 61.35 2jvc n THR 14 Cb 0.11 0.24 0.04 0.00 -2.10 0.00 0.00 70.33 68.62 2jvc n THR 14 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jvc n GLY 15 N 1.04 -0.01 3.04 3.38 0.00 0.92 -5.05 105.19 108.50 2jvc n GLY 15 Ca 0.14 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2jvc n GLY 15 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jvc s LYS 16 N -4.12 2.20 -0.28 1.61 2.36 -1.24 -4.92 119.74 115.36 2jvc s LYS 16 Ca 0.12 -0.54 -0.20 0.00 -2.55 0.00 0.00 55.97 52.79 2jvc s LYS 16 Cb -0.02 -1.93 -0.01 0.00 -1.05 0.00 0.00 37.83 34.82 2jvc s LYS 16 CO 0.35 -0.12 0.63 0.95 1.55 0.00 0.00 175.35 178.70 2jvc s THR 17 N 1.16 4.96 0.02 3.43 -4.23 -1.26 -2.08 115.64 117.64 2jvc s THR 17 Ca -0.03 0.99 0.07 0.00 -1.18 0.00 0.00 61.69 61.55 2jvc s THR 17 Cb -0.14 -3.96 -0.02 0.00 1.34 0.00 0.00 72.50 69.71 2jvc s THR 17 CO -0.04 -0.05 -0.22 -0.51 -0.54 0.00 0.00 174.62 173.25 2jvc s ILE 18 N 2.55 1.79 -0.06 2.99 2.07 -0.57 -4.97 121.20 125.00 2jvc s ILE 18 Ca 0.26 -1.14 0.03 0.00 -1.41 0.00 0.00 60.65 58.39 2jvc s ILE 18 Cb -0.15 -1.52 -0.02 0.00 0.13 0.00 0.00 42.46 40.89 2jvc s ILE 18 CO 0.10 0.35 -0.13 -0.89 -1.91 0.00 0.00 174.94 172.45 2jvc s THR 19 N -0.69 3.12 -0.05 4.00 2.01 -1.26 -1.00 115.64 121.77 2jvc s THR 19 Ca 0.09 -0.69 -0.02 0.00 0.31 0.00 0.00 61.69 61.37 2jvc s THR 19 Cb -0.09 -2.24 0.03 0.00 0.01 0.00 0.00 72.50 70.21 2jvc s THR 19 CO 0.01 0.58 0.11 0.27 -0.69 0.00 0.00 174.62 174.90 2jvc s ILE 20 N -0.58 -0.04 -0.18 1.82 -4.36 -0.71 -4.96 121.20 112.18 2jvc s ILE 20 Ca 0.08 0.15 -0.27 0.00 -0.26 0.00 0.00 60.65 60.35 2jvc s ILE 20 Cb -0.11 -0.19 -0.01 0.00 1.25 0.00 0.00 42.46 43.40 2jvc s ILE 20 CO 0.01 0.06 0.92 1.51 0.24 0.00 0.00 174.94 177.68 2jvc s ASP 21 N 0.90 7.03 0.14 4.36 -4.77 -1.26 -0.38 116.67 122.69 2jvc s ASP 21 Ca -0.07 1.27 0.01 0.00 -3.30 0.00 0.00 52.55 50.46 2jvc s ASP 21 Cb -0.09 -2.49 -0.04 0.00 -1.09 0.00 0.00 42.92 39.20 2jvc s ASP 21 CO -0.04 -0.49 0.00 0.68 0.70 0.00 0.00 175.17 176.02 2jvc s VAL 22 N 2.49 0.50 0.14 2.11 -7.23 0.41 -4.92 120.40 113.89 2jvc s VAL 22 Ca 0.41 -1.94 0.08 0.00 -1.81 0.00 0.00 61.98 58.72 2jvc s VAL 22 Cb -0.16 -1.98 -0.04 0.00 0.56 0.00 0.00 36.38 34.76 2jvc s VAL 22 CO 0.11 -0.58 -0.08 -0.62 -0.31 0.00 0.00 175.10 173.61 2jvc s ASP 23 N -3.10 4.41 0.36 4.85 -1.08 -1.26 -0.76 116.67 120.10 2jvc s ASP 23 Ca 0.21 -0.44 0.25 0.00 -0.52 0.00 0.00 52.55 52.04 2jvc s ASP 23 Cb 0.06 -0.83 1.32 0.00 -1.46 0.00 0.00 42.92 42.02 2jvc s ASP 23 CO 0.01 0.14 1.77 1.12 0.52 0.00 0.00 175.17 178.73 2jvc h HIS 24 N 3.27 0.00 -0.19 -5.34 2.07 -1.93 0.63 115.15 113.67 2jvc h HIS 24 Ca -0.48 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.04 2jvc h HIS 24 Cb 1.18 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.16 2jvc h HIS 24 CO 0.62 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 175.48 2jvc n ALA 25 N -1.82 2.50 -2.75 6.11 0.00 -1.26 -4.30 120.51 118.99 2jvc n ALA 25 Ca -0.01 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.00 2jvc n ALA 25 Cb 0.06 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.45 2jvc n ALA 25 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2jvc n ASP 26 N 0.13 0.14 -4.06 0.00 8.00 0.21 -5.07 116.55 115.90 2jvc n ASP 26 Ca 0.12 -0.68 -0.10 0.00 0.71 0.00 0.00 54.79 54.84 2jvc n ASP 26 Cb 0.23 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.26 2jvc n ASP 26 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2jvc s THR 27 N 1.20 0.01 0.12 -3.53 -4.23 -1.26 -4.31 115.64 103.65 2jvc s THR 27 Ca 0.00 -1.59 -0.20 0.00 -1.18 0.00 0.00 61.69 58.72 2jvc s THR 27 Cb 0.00 -2.25 -0.06 0.00 1.34 0.00 0.00 72.50 71.53 2jvc s THR 27 CO 0.00 -0.04 1.75 0.58 -0.54 0.00 0.00 174.62 176.38 2jvc h VAL 28 N 2.41 0.97 -0.48 2.29 2.07 -1.23 -2.28 116.25 120.00 2jvc h VAL 28 Ca -0.30 -0.06 0.10 0.00 0.82 0.00 0.00 66.70 67.26 2jvc h VAL 28 Cb 1.25 0.77 -0.10 0.00 -1.52 0.00 0.00 31.29 31.69 2jvc h VAL 28 CO 0.43 0.03 -0.20 1.23 0.02 0.00 0.00 177.57 179.08 2jvc h GLY 29 N 0.18 0.16 1.00 2.17 0.00 -1.86 0.67 103.07 105.40 2jvc h GLY 29 Ca 0.08 0.26 0.01 0.00 0.00 0.00 0.00 47.33 47.68 2jvc h GLY 29 CO -0.07 -0.21 0.59 0.00 0.00 0.00 0.00 176.54 176.85 2jvc h ALA 30 N 1.26 1.13 -0.67 3.60 0.00 -1.86 -2.48 119.26 120.24 2jvc h ALA 30 Ca 0.23 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2jvc h ALA 30 Cb 0.45 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2jvc h ALA 30 CO -0.55 0.53 0.36 0.28 0.00 0.00 0.00 179.25 179.87 2jvc h VAL 31 N 1.21 1.21 -0.86 0.00 2.07 -0.53 -2.56 116.25 116.80 2jvc h VAL 31 Ca 0.33 -0.55 0.09 0.00 0.82 0.00 0.00 66.70 67.38 2jvc h VAL 31 Cb -0.14 0.35 -0.07 0.00 -1.52 0.00 0.00 31.29 29.91 2jvc h VAL 31 CO -0.07 0.24 0.51 0.11 0.02 0.00 0.00 177.57 178.37 2jvc h LYS 32 N 0.92 0.85 -0.72 1.57 6.56 -0.48 -1.44 116.57 123.83 2jvc h LYS 32 Ca 0.24 -0.05 -0.06 0.00 -1.06 0.00 0.00 60.65 59.72 2jvc h LYS 32 Cb 0.06 -0.19 -0.03 0.00 -0.57 0.00 0.00 32.23 31.50 2jvc h LYS 32 CO -0.04 0.56 0.23 0.00 -2.06 0.00 0.00 179.45 178.14 2jvc h ALA 33 N 1.45 0.94 -0.53 3.86 0.00 -1.24 -1.86 119.26 121.87 2jvc h ALA 33 Ca 0.40 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2jvc h ALA 33 Cb 0.32 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2jvc h ALA 33 CO -0.23 0.61 0.34 -0.22 0.00 0.00 0.00 179.25 179.76 2jvc h LYS 34 N 1.06 0.70 -0.41 0.00 1.63 -0.92 -2.41 116.57 116.21 2jvc h LYS 34 Ca 0.23 -0.05 -0.08 0.00 -0.85 0.00 0.00 60.65 59.91 2jvc h LYS 34 Cb 0.30 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.75 2jvc h LYS 34 CO -0.01 0.47 -0.08 0.82 -3.45 0.00 0.00 179.45 177.21 2jvc h ILE 35 N 0.71 1.24 -0.56 2.00 1.08 -1.17 -1.56 117.51 119.26 2jvc h ILE 35 Ca 0.19 -1.07 0.05 0.00 -0.39 0.00 0.00 64.86 63.65 2jvc h ILE 35 Cb -0.07 1.02 -0.05 0.00 -3.07 0.00 0.00 36.82 34.64 2jvc h ILE 35 CO -0.04 0.36 0.28 0.22 -0.69 0.00 0.00 178.15 178.28 2jvc h TYR 36 N 0.65 0.50 -0.00 1.37 3.20 -0.85 -1.88 116.97 119.96 2jvc h TYR 36 Ca 0.12 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.84 2jvc h TYR 36 Cb 0.51 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 2jvc h TYR 36 CO 0.02 0.23 -0.78 0.22 -1.64 0.00 0.00 178.16 176.22 2jvc h ASP 37 N 0.53 0.08 -0.56 -2.11 1.82 -1.31 0.81 116.42 115.67 2jvc h ASP 37 Ca 0.25 -0.06 0.08 0.00 -0.39 0.00 0.00 57.03 56.92 2jvc h ASP 37 Cb 0.18 -0.02 -0.07 0.00 0.68 0.00 0.00 39.33 40.10 2jvc h ASP 37 CO -0.18 0.82 0.19 0.11 -1.61 0.00 0.00 179.24 178.57 2jvc h LYS 38 N 0.04 0.35 0.00 0.28 6.56 -0.47 -3.37 116.57 119.95 2jvc h LYS 38 Ca -0.02 -0.02 -0.08 0.00 -1.06 0.00 0.00 60.65 59.47 2jvc h LYS 38 Cb 1.37 -0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 32.94 2jvc h LYS 38 CO 0.11 0.23 -1.00 -0.85 -2.06 0.00 0.00 179.45 175.88 2jvc n GLU 39 N -5.02 0.16 0.00 3.15 0.28 -1.00 -5.08 120.64 113.13 2jvc n GLU 39 Ca 0.07 0.07 0.00 0.00 -0.16 0.00 0.00 57.16 57.14 2jvc n GLU 39 Cb 0.25 -0.77 0.00 0.00 1.43 0.00 0.00 31.44 32.34 2jvc n GLU 39 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2jvc n GLY 40 N 2.67 0.72 3.44 -1.84 0.00 0.28 -5.09 105.19 105.37 2jvc n GLY 40 Ca -0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.64 2jvc n GLY 40 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2jvc s ILE 41 N -0.20 2.44 -0.19 -0.61 -4.36 -1.05 -5.03 121.20 112.20 2jvc s ILE 41 Ca 0.00 -2.05 -0.29 0.00 -0.26 0.00 0.00 60.65 58.05 2jvc s ILE 41 Cb 0.00 -2.18 -0.03 0.00 1.25 0.00 0.00 42.46 41.50 2jvc s ILE 41 CO 0.00 -0.15 1.59 -2.16 0.24 0.00 0.00 174.94 174.46 2jvc s PRO 42 N -2.78 3.90 0.36 0.37 0.04 -1.26 -4.47 135.00 131.16 2jvc s PRO 42 Ca 0.22 1.75 0.15 0.00 0.04 0.00 0.00 61.00 63.16 2jvc s PRO 42 Cb -0.08 -4.00 0.68 0.00 0.04 0.00 0.00 34.50 31.14 2jvc s PRO 42 CO 0.11 -1.16 1.77 -1.00 0.04 0.00 0.00 177.00 176.75 2jvc h PRO 43 N 10.28 0.00 0.00 0.56 0.13 -1.90 -2.25 132.00 138.82 2jvc h PRO 43 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2jvc h PRO 43 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2jvc h PRO 43 CO 0.99 0.41 0.00 0.22 -0.23 0.00 0.00 178.00 179.39 2jvc h ASP 44 N 0.00 0.00 0.00 1.44 3.58 -1.96 -3.09 116.42 116.39 2jvc h ASP 44 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2jvc h ASP 44 Cb 0.81 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.86 2jvc h ASP 44 CO 0.05 0.00 -1.22 0.00 -2.88 0.00 0.00 179.24 175.20 2jvc n GLN 45 N -2.49 0.27 -4.02 0.28 6.02 -1.00 -4.95 117.38 111.48 2jvc n GLN 45 Ca 0.04 -0.05 -0.29 0.00 -0.01 0.00 0.00 57.00 56.70 2jvc n GLN 45 Cb 0.42 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 30.14 2jvc n GLN 45 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2jvc s GLN 46 N -3.08 3.03 0.06 -1.09 1.03 -0.88 -2.46 119.66 116.27 2jvc s GLN 46 Ca 0.04 -0.68 -0.01 0.00 0.04 0.00 0.00 55.36 54.76 2jvc s GLN 46 Cb 0.15 -2.79 -0.04 0.00 0.03 0.00 0.00 33.01 30.37 2jvc s GLN 46 CO 0.86 0.55 -0.03 -0.98 -2.54 0.00 0.00 175.29 173.15 2jvc s ARG 47 N -2.64 0.65 0.02 9.60 3.03 0.54 -4.90 118.95 125.26 2jvc s ARG 47 Ca 0.31 -1.24 0.01 0.00 2.03 0.00 0.00 55.73 56.84 2jvc s ARG 47 Cb -0.12 0.17 -0.04 0.00 -1.03 0.00 0.00 34.95 33.93 2jvc s ARG 47 CO 0.24 -0.11 0.06 -0.51 -1.13 0.00 0.00 175.30 173.86 2jvc s LEU 48 N -2.94 3.79 -0.03 -1.89 2.01 -1.26 -0.95 118.68 117.41 2jvc s LEU 48 Ca 0.08 0.07 -0.01 0.00 0.01 0.00 0.00 54.13 54.29 2jvc s LEU 48 Cb 0.08 -2.27 0.03 0.00 0.01 0.00 0.00 46.19 44.04 2jvc s LEU 48 CO -0.09 0.25 0.05 -0.63 1.01 0.00 0.00 176.35 176.94 2jvc s ILE 49 N -1.22 -0.07 -0.28 -0.59 1.09 0.14 -1.37 121.20 118.90 2jvc s ILE 49 Ca 0.24 0.25 0.02 0.00 -1.10 0.00 0.00 60.65 60.06 2jvc s ILE 49 Cb -0.12 -0.11 0.06 0.00 -1.06 0.00 0.00 42.46 41.23 2jvc s ILE 49 CO 0.15 0.10 -0.07 0.12 -0.10 0.00 0.00 174.94 175.15 2jvc s PHE 50 N 1.27 3.32 0.00 3.97 5.36 0.11 -1.83 117.98 130.17 2jvc s PHE 50 Ca -0.07 -2.30 0.00 0.00 -0.96 0.00 0.00 56.93 53.60 2jvc s PHE 50 Cb -0.13 -2.07 0.00 0.00 -0.34 0.00 0.00 43.02 40.48 2jvc s PHE 50 CO -0.03 -0.87 0.00 0.41 -1.46 0.00 0.00 175.22 173.26 2jvc n GLY 51 N 4.46 1.24 0.00 13.12 0.00 -1.26 -2.77 105.19 119.98 2jvc n GLY 51 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2jvc n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jvc n GLY 52 N -2.00 1.29 3.87 -0.02 0.00 -1.26 -5.12 105.19 101.95 2jvc n GLY 52 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2jvc n GLY 52 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jvc s LYS 53 N 0.00 3.77 0.84 1.61 0.00 -1.11 -5.01 119.74 119.83 2jvc s LYS 53 Ca 0.00 0.19 -0.11 0.00 0.00 0.00 0.00 55.97 56.04 2jvc s LYS 53 Cb 0.00 -2.94 0.09 0.00 0.00 0.00 0.00 37.83 34.98 2jvc s LYS 53 CO 0.00 0.52 1.09 -0.65 0.00 0.00 0.00 175.35 176.31 2jvc s GLN 54 N -2.08 1.73 -0.12 1.78 1.11 -1.26 0.07 119.66 120.88 2jvc s GLN 54 Ca 0.36 0.85 0.03 0.00 0.01 0.00 0.00 55.36 56.61 2jvc s GLN 54 Cb -0.14 -1.86 0.00 0.00 -1.01 0.00 0.00 33.01 30.01 2jvc s GLN 54 CO 0.19 -1.92 -0.21 -0.51 0.01 0.00 0.00 175.29 172.85 2jvc s LEU 55 N -6.02 2.19 0.00 2.90 1.43 -0.47 -4.75 118.68 113.96 2jvc s LEU 55 Ca 0.62 -0.55 -0.08 0.00 -1.03 0.00 0.00 54.13 53.09 2jvc s LEU 55 Cb -0.17 -1.46 0.12 0.00 0.03 0.00 0.00 46.19 44.71 2jvc s LEU 55 CO 0.56 0.12 0.44 -1.84 0.23 0.00 0.00 176.35 175.86 2jvc n GLU 56 N 3.80 -1.74 0.19 1.70 0.28 -1.26 -4.63 120.64 118.98 2jvc n GLU 56 Ca -0.19 -0.70 0.14 0.00 -0.16 0.00 0.00 57.16 56.25 2jvc n GLU 56 Cb 0.52 -0.64 0.48 0.00 1.43 0.00 0.00 31.44 33.24 2jvc n GLU 56 CO 0.00 0.00 0.00 0.38 -0.16 0.00 0.00 177.13 177.35 2jvc h ASP 57 N -1.60 0.00 -0.25 -1.84 3.04 -2.00 -2.82 116.42 110.94 2jvc h ASP 57 Ca -0.16 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.63 2jvc h ASP 57 Cb 0.49 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.78 2jvc h ASP 57 CO 0.11 0.00 0.00 -0.24 -2.04 0.00 0.00 179.24 177.07 2jvc n SER 58 N -2.68 2.69 -4.17 4.15 2.88 -1.26 -0.77 113.62 114.46 2jvc n SER 58 Ca 0.03 -1.82 -0.43 0.00 -1.33 0.00 0.00 58.87 55.31 2jvc n SER 58 Cb 0.35 -0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.64 2jvc n SER 58 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2jvc n ASN 59 N 0.69 5.26 0.00 -3.46 4.13 -1.07 -3.23 115.26 117.59 2jvc n ASN 59 Ca 0.11 -3.07 0.00 0.00 1.68 0.00 0.00 54.58 53.31 2jvc n ASN 59 Cb 0.40 -1.50 0.00 0.00 -1.54 0.00 0.00 39.78 37.14 2jvc n ASN 59 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2jvc n ALA 60 N 4.43 0.00 -0.04 5.41 0.00 -1.26 -4.68 120.51 124.37 2jvc n ALA 60 Ca 0.37 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.73 2jvc n ALA 60 Cb 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.78 2jvc n ALA 60 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2jvc h MET 61 N 0.00 -0.04 -0.46 0.00 2.86 -1.79 -3.09 114.93 112.41 2jvc h MET 61 Ca 0.00 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.70 2jvc h MET 61 Cb 0.00 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 2jvc h MET 61 CO 0.00 0.42 0.31 1.03 1.06 0.00 0.00 176.91 179.74 2jvc h SER 62 N -0.98 0.33 0.14 1.22 0.87 -1.75 0.35 113.55 113.73 2jvc h SER 62 Ca -0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2jvc h SER 62 Cb 0.48 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.37 2jvc h SER 62 CO 0.01 0.21 -0.05 -0.78 -0.53 0.00 0.00 176.83 175.69 2jvc h ASP 63 N 0.37 0.00 -0.10 6.23 1.82 -1.65 -3.46 116.42 119.63 2jvc h ASP 63 Ca 0.20 0.00 -0.04 0.00 -0.39 0.00 0.00 57.03 56.80 2jvc h ASP 63 Cb 0.33 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.32 2jvc h ASP 63 CO -0.05 0.05 -0.04 0.00 -1.61 0.00 0.00 179.24 177.59 2jvc n TYR 64 N -3.76 -0.00 -0.41 0.28 9.36 0.11 -4.91 117.16 117.82 2jvc n TYR 64 Ca -0.03 0.00 0.07 0.00 3.32 0.00 0.00 57.90 61.27 2jvc n TYR 64 Cb 0.14 -0.80 0.22 0.00 -0.63 0.00 0.00 39.34 38.27 2jvc n TYR 64 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 2jvc n ASN 65 N 1.69 3.44 -4.66 2.98 5.15 -1.21 -4.96 115.26 117.69 2jvc n ASN 65 Ca -0.02 -2.26 -0.41 0.00 -0.60 0.00 0.00 54.58 51.29 2jvc n ASN 65 Cb 0.09 -0.36 -0.04 0.00 -0.53 0.00 0.00 39.78 38.93 2jvc n ASN 65 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2jvc s VAL 66 N -1.47 4.88 0.38 3.44 0.11 -1.17 -4.97 120.40 121.59 2jvc s VAL 66 Ca 0.33 1.55 0.01 0.00 -2.93 0.00 0.00 61.98 60.94 2jvc s VAL 66 Cb 0.20 -4.11 -0.00 0.00 -1.53 0.00 0.00 36.38 30.94 2jvc s VAL 66 CO 0.17 0.00 0.02 0.00 -3.33 0.00 0.00 175.10 171.96 2jvc n GLN 67 N 5.49 0.97 0.18 1.54 10.64 -1.26 -5.03 117.38 129.91 2jvc n GLN 67 Ca 0.04 -2.82 0.03 0.00 -1.83 0.00 0.00 57.00 52.42 2jvc n GLN 67 Cb 0.48 0.91 0.39 0.00 -0.86 0.00 0.00 30.24 31.17 2jvc n GLN 67 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.06 175.01 2jvc h LYS 68 N 0.00 0.04 -1.90 2.61 1.63 -1.95 -3.32 116.57 113.68 2jvc h LYS 68 Ca -0.31 -0.01 -0.45 0.00 -0.85 0.00 0.00 60.65 59.03 2jvc h LYS 68 Cb 0.98 -0.00 -0.31 0.00 -0.60 0.00 0.00 32.23 32.29 2jvc h LYS 68 CO 0.51 0.33 -0.83 -0.85 -3.45 0.00 0.00 179.45 175.16 2jvc n GLU 69 N -4.18 0.32 -3.36 1.90 0.28 -1.16 -3.33 120.64 111.12 2jvc n GLU 69 Ca -0.02 -2.80 -0.38 0.00 -0.16 0.00 0.00 57.16 53.80 2jvc n GLU 69 Cb 0.35 -1.59 -0.07 0.00 1.43 0.00 0.00 31.44 31.56 2jvc n GLU 69 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2jvc s SER 70 N 0.24 6.52 -0.35 -1.84 0.15 -1.26 -4.85 113.70 112.31 2jvc s SER 70 Ca 0.32 0.62 -0.18 0.00 0.70 0.00 0.00 55.95 57.41 2jvc s SER 70 Cb 0.03 -2.25 -0.00 0.00 -1.71 0.00 0.00 66.02 62.09 2jvc s SER 70 CO -0.15 -0.06 0.50 0.42 1.20 0.00 0.00 173.24 175.14 2jvc s THR 71 N 1.13 5.03 0.12 6.45 -4.23 -1.26 0.14 115.64 123.02 2jvc s THR 71 Ca 0.21 0.27 0.07 0.00 -1.18 0.00 0.00 61.69 61.06 2jvc s THR 71 Cb -0.15 -3.96 -0.04 0.00 1.34 0.00 0.00 72.50 69.70 2jvc s THR 71 CO 0.08 -0.22 -0.16 -1.48 -0.54 0.00 0.00 174.62 172.30 2jvc s LEU 72 N 2.35 2.38 -0.27 4.79 0.05 -0.89 -5.01 118.68 122.08 2jvc s LEU 72 Ca 0.18 -0.78 -0.14 0.00 0.05 0.00 0.00 54.13 53.43 2jvc s LEU 72 Cb -0.16 -0.64 -0.04 0.00 -2.05 0.00 0.00 46.19 43.30 2jvc s LEU 72 CO 0.13 -0.09 0.34 -2.28 -0.55 0.00 0.00 176.35 173.91 2jvc s HIS 73 N -1.89 3.24 -0.27 3.48 5.65 -0.76 -1.98 115.29 122.75 2jvc s HIS 73 Ca 0.09 0.34 -0.07 0.00 0.25 0.00 0.00 55.06 55.66 2jvc s HIS 73 Cb -0.06 -2.54 -0.01 0.00 -1.18 0.00 0.00 32.58 28.78 2jvc s HIS 73 CO 0.04 -0.23 0.08 -1.17 -0.65 0.00 0.00 174.74 172.81 2jvc s LEU 74 N 2.02 3.65 -0.16 8.88 2.96 0.22 0.24 118.68 136.48 2jvc s LEU 74 Ca 0.13 -0.45 -0.03 0.00 -0.22 0.00 0.00 54.13 53.57 2jvc s LEU 74 Cb -0.16 -1.91 -0.02 0.00 0.50 0.00 0.00 46.19 44.60 2jvc s LEU 74 CO 0.10 -0.12 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.26 2jvc s VAL 75 N 1.56 3.54 -0.03 1.68 1.01 -0.13 -1.85 120.40 126.18 2jvc s VAL 75 Ca 0.05 -0.47 0.05 0.00 0.00 0.00 0.00 61.98 61.61 2jvc s VAL 75 Cb -0.16 -2.55 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 2jvc s VAL 75 CO 0.03 0.49 -0.19 -0.76 0.00 0.00 0.00 175.10 174.66 2jvc s LEU 76 N 0.59 1.99 -0.83 3.92 1.02 -1.26 -0.34 118.68 123.78 2jvc s LEU 76 Ca -0.04 -0.38 0.02 0.00 0.02 0.00 0.00 54.13 53.75 2jvc s LEU 76 Cb -0.15 -1.05 0.27 0.00 0.02 0.00 0.00 46.19 45.28 2jvc s LEU 76 CO 0.03 0.20 1.00 0.54 0.02 0.00 0.00 176.35 178.15 2jvc n ARG 77 N 2.88 3.21 -0.00 1.70 1.74 -1.03 -4.84 116.66 120.32 2jvc n ARG 77 Ca -0.17 -4.61 -0.17 0.00 -0.77 0.00 0.00 57.85 52.13 2jvc n ARG 77 Cb 0.53 -2.37 -0.10 0.00 -1.02 0.00 0.00 32.46 29.50 2jvc n ARG 77 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2jvc h LEU 78 N 4.85 0.64 -8.26 0.55 4.07 -1.98 -3.40 115.31 111.78 2jvc h LEU 78 Ca 0.19 -0.71 -0.52 0.00 0.08 0.00 0.00 57.88 56.92 2jvc h LEU 78 Cb 0.66 -0.19 -0.08 0.00 1.08 0.00 0.00 40.66 42.13 2jvc h LEU 78 CO 1.01 1.26 1.22 -0.13 -1.08 0.00 0.00 178.44 180.72 2jvc s ARG 79 N -3.41 3.18 -0.01 1.13 3.00 -1.26 -4.38 118.95 117.20 2jvc s ARG 79 Ca -0.12 -0.47 0.00 0.00 0.00 0.00 0.00 55.73 55.14 2jvc s ARG 79 Cb 0.05 -4.78 0.01 0.00 0.00 0.00 0.00 34.95 30.22 2jvc s ARG 79 CO 0.84 -2.43 0.19 0.41 0.00 0.00 0.00 175.30 174.31 2jvc n GLY 80 N 6.21 -0.54 0.00 -3.53 0.00 -1.26 -5.12 105.19 100.95 2jvc n GLY 80 Ca 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2jvc n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jvc n GLY 81 N -0.02 0.57 0.00 -0.02 0.00 -1.26 -5.23 105.19 99.23 2jvc n GLY 81 Ca -0.01 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2jvc n GLY 81 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87