#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 -0.95 0.00 1.61 0.04 -1.26 -5.06 135.00 129.37 2jvc s PRO 2 Ca 0.00 0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.07 2jvc s PRO 2 Cb 0.00 -1.62 0.00 0.00 0.04 0.00 0.00 34.50 32.92 2jvc s PRO 2 CO 0.00 -3.55 0.00 1.28 0.04 0.00 0.00 177.00 174.77 2jvc n LEU 3 N -4.66 0.00 -0.06 -3.56 7.99 -1.26 -4.93 117.00 110.52 2jvc n LEU 3 Ca 0.12 0.00 -0.14 0.00 -0.01 0.00 0.00 56.01 55.98 2jvc n LEU 3 Cb 0.59 -0.03 -0.12 0.00 -0.11 0.00 0.00 43.42 43.75 2jvc n LEU 3 CO 0.47 -0.39 0.43 1.23 -1.51 0.00 0.00 177.39 177.61 2jvc h GLY 4 N 0.00 -0.00 -3.05 -0.72 0.00 -2.00 -3.46 103.07 93.83 2jvc h GLY 4 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 2jvc h GLY 4 CO 0.00 -0.00 -0.26 1.44 0.00 0.00 0.00 176.54 177.72 2jvc n SER 5 N -4.66 -0.55 -1.67 0.19 7.64 -1.26 -4.74 113.62 108.56 2jvc n SER 5 Ca -0.10 0.76 -0.05 0.00 1.01 0.00 0.00 58.87 60.50 2jvc n SER 5 Cb 0.43 -1.23 -0.01 0.00 -1.01 0.00 0.00 64.21 62.39 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 -0.27 0.24 -4.07 1.43 0.00 0.32 -4.91 117.12 109.86 2jvc n MET 6 Ca 0.12 -0.94 -0.09 0.00 0.00 0.00 0.00 57.70 56.79 2jvc n MET 6 Cb 0.47 0.91 -0.10 0.00 0.00 0.00 0.00 33.22 34.50 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 -2.26 0.56 0.14 3.17 1.11 -1.13 0.17 119.66 121.43 2jvc s GLN 7 Ca 0.10 -1.02 0.05 0.00 0.01 0.00 0.00 55.36 54.50 2jvc s GLN 7 Cb -0.00 0.05 -0.04 0.00 -1.01 0.00 0.00 33.01 32.00 2jvc s GLN 7 CO 0.07 -0.06 -0.12 0.42 0.01 0.00 0.00 175.29 175.61 2jvc s ILE 8 N -2.89 1.29 -0.17 1.08 1.01 0.63 -2.74 121.20 119.41 2jvc s ILE 8 Ca -0.00 -1.94 -0.02 0.00 0.00 0.00 0.00 60.65 58.69 2jvc s ILE 8 Cb 0.00 -1.73 -0.01 0.00 0.01 0.00 0.00 42.46 40.73 2jvc s ILE 8 CO -0.05 -0.60 -0.08 -0.36 0.00 0.00 0.00 174.94 173.84 2jvc s PHE 9 N -2.81 2.90 -0.11 3.97 0.40 0.11 -1.45 117.98 120.99 2jvc s PHE 9 Ca 0.14 -0.72 0.01 0.00 -0.60 0.00 0.00 56.93 55.76 2jvc s PHE 9 Cb -0.01 -1.96 -0.01 0.00 0.51 0.00 0.00 43.02 41.55 2jvc s PHE 9 CO 0.02 -0.32 -0.15 0.08 0.70 0.00 0.00 175.22 175.55 2jvc s VAL 10 N 0.79 2.89 -0.29 -0.44 1.01 0.35 -1.89 120.40 122.81 2jvc s VAL 10 Ca -0.03 -0.73 -0.07 0.00 0.00 0.00 0.00 61.98 61.15 2jvc s VAL 10 Cb -0.15 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 34.05 2jvc s VAL 10 CO 0.01 0.54 0.07 -0.75 0.00 0.00 0.00 175.10 174.98 2jvc s LYS 11 N 0.21 3.08 0.71 2.72 2.20 -0.87 -1.24 119.74 126.55 2jvc s LYS 11 Ca -0.09 -0.86 -0.11 0.00 -0.36 0.00 0.00 55.97 54.54 2jvc s LYS 11 Cb -0.16 -3.36 0.02 0.00 -1.51 0.00 0.00 37.83 32.82 2jvc s LYS 11 CO 0.06 -0.44 1.07 0.95 -0.36 0.00 0.00 175.35 176.63 2jvc s THR 12 N 1.49 3.80 0.55 3.43 -4.23 -0.78 0.72 115.64 120.63 2jvc s THR 12 Ca 0.02 0.61 0.40 0.00 -1.18 0.00 0.00 61.69 61.54 2jvc s THR 12 Cb -0.17 -3.26 0.40 0.00 1.34 0.00 0.00 72.50 70.80 2jvc s THR 12 CO 0.02 -0.74 2.21 0.25 -0.54 0.00 0.00 174.62 175.83 2jvc h LEU 13 N -0.71 0.00 -1.29 4.79 5.85 -1.71 0.27 115.31 122.51 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 0.55 0.00 0.00 0.35 -0.34 0.00 0.00 178.44 179.00 2jvc n THR 14 N -2.94 0.37 -2.30 1.05 -2.24 -1.26 -4.93 114.28 102.03 2jvc n THR 14 Ca -0.03 -0.44 -0.06 0.00 -2.27 0.00 0.00 64.05 61.26 2jvc n THR 14 Cb 0.11 0.33 0.03 0.00 -2.10 0.00 0.00 70.33 68.70 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 1.13 0.13 3.02 3.38 0.00 0.95 -5.05 105.19 108.74 2jvc n GLY 15 Ca 0.15 -0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.88 2.27 -0.28 1.61 2.36 -1.24 -4.91 119.74 115.69 2jvc s LYS 16 Ca 0.11 -0.61 -0.22 0.00 -2.55 0.00 0.00 55.97 52.70 2jvc s LYS 16 Cb -0.01 -2.17 -0.01 0.00 -1.05 0.00 0.00 37.83 34.58 2jvc s LYS 16 CO 0.28 -0.27 0.72 0.95 1.55 0.00 0.00 175.35 178.58 2jvc s THR 17 N 1.47 4.89 -0.00 3.43 -4.23 -1.26 -1.86 115.64 118.08 2jvc s THR 17 Ca 0.04 1.19 0.06 0.00 -1.18 0.00 0.00 61.69 61.80 2jvc s THR 17 Cb -0.13 -4.04 -0.02 0.00 1.34 0.00 0.00 72.50 69.65 2jvc s THR 17 CO -0.10 -0.10 -0.20 -0.51 -0.54 0.00 0.00 174.62 173.17 2jvc s ILE 18 N 2.72 1.56 -0.07 2.99 2.07 -0.37 -4.97 121.20 125.14 2jvc s ILE 18 Ca 0.30 -0.90 0.02 0.00 -1.41 0.00 0.00 60.65 58.66 2jvc s ILE 18 Cb -0.15 -1.31 -0.03 0.00 0.13 0.00 0.00 42.46 41.11 2jvc s ILE 18 CO 0.10 0.39 -0.12 -0.89 -1.91 0.00 0.00 174.94 172.51 2jvc s THR 19 N -0.52 3.24 -0.05 4.00 2.01 -1.26 -0.50 115.64 122.55 2jvc s THR 19 Ca 0.07 -0.65 -0.03 0.00 0.31 0.00 0.00 61.69 61.40 2jvc s THR 19 Cb -0.08 -2.30 0.03 0.00 0.01 0.00 0.00 72.50 70.17 2jvc s THR 19 CO -0.00 0.58 0.12 0.27 -0.69 0.00 0.00 174.62 174.90 2jvc s ILE 20 N -0.60 -0.04 -0.25 1.82 -4.36 -0.53 -4.96 121.20 112.28 2jvc s ILE 20 Ca 0.09 0.15 -0.26 0.00 -0.26 0.00 0.00 60.65 60.37 2jvc s ILE 20 Cb -0.11 -0.20 -0.00 0.00 1.25 0.00 0.00 42.46 43.39 2jvc s ILE 20 CO 0.01 0.06 0.88 1.51 0.24 0.00 0.00 174.94 177.65 2jvc s ASP 21 N 0.96 6.89 0.21 4.36 -4.77 -1.26 -0.27 116.67 122.78 2jvc s ASP 21 Ca -0.07 1.09 0.06 0.00 -3.30 0.00 0.00 52.55 50.33 2jvc s ASP 21 Cb -0.10 -2.46 -0.05 0.00 -1.09 0.00 0.00 42.92 39.22 2jvc s ASP 21 CO -0.04 -0.57 -0.10 0.68 0.70 0.00 0.00 175.17 175.83 2jvc s VAL 22 N 2.96 1.52 0.30 2.11 -7.23 0.45 -4.92 120.40 115.60 2jvc s VAL 22 Ca 0.37 -2.14 0.10 0.00 -1.81 0.00 0.00 61.98 58.50 2jvc s VAL 22 Cb -0.15 -2.11 -0.05 0.00 0.56 0.00 0.00 36.38 34.63 2jvc s VAL 22 CO 0.08 -0.55 -0.08 -0.62 -0.31 0.00 0.00 175.10 173.62 2jvc s ASP 23 N -3.31 4.01 0.51 4.85 -1.08 -1.26 -0.52 116.67 119.87 2jvc s ASP 23 Ca 0.23 -0.94 0.33 0.00 -0.52 0.00 0.00 52.55 51.65 2jvc s ASP 23 Cb 0.01 -0.51 1.82 0.00 -1.46 0.00 0.00 42.92 42.78 2jvc s ASP 23 CO 0.07 -0.08 2.02 1.12 0.52 0.00 0.00 175.17 178.82 2jvc h HIS 24 N 2.01 0.00 -0.28 -5.34 2.07 -1.94 0.25 115.15 111.92 2jvc h HIS 24 Ca -0.42 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.10 2jvc h HIS 24 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 2jvc h HIS 24 CO 0.74 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 175.60 2jvc n ALA 25 N -1.93 2.48 -3.48 6.11 0.00 -1.26 -4.73 120.51 117.69 2jvc n ALA 25 Ca -0.02 -0.67 -0.35 0.00 0.00 0.00 0.00 53.44 52.40 2jvc n ALA 25 Cb 0.07 -1.02 -0.14 0.00 0.00 0.00 0.00 19.45 18.36 2jvc n ALA 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2jvc s ASP 26 N -1.38 4.47 0.75 0.00 1.01 0.89 -5.11 116.67 117.30 2jvc s ASP 26 Ca 0.32 -0.56 -0.10 0.00 0.71 0.00 0.00 52.55 52.93 2jvc s ASP 26 Cb 0.17 -1.75 0.06 0.00 1.01 0.00 0.00 42.92 42.41 2jvc s ASP 26 CO 0.25 -0.08 1.10 0.42 0.21 0.00 0.00 175.17 177.07 2jvc s THR 27 N 1.45 2.39 0.20 -1.27 -4.23 -1.26 -4.26 115.64 108.66 2jvc s THR 27 Ca 0.04 -0.02 -0.11 0.00 -1.18 0.00 0.00 61.69 60.42 2jvc s THR 27 Cb -0.15 -3.09 0.15 0.00 1.34 0.00 0.00 72.50 70.75 2jvc s THR 27 CO -0.02 -0.11 1.70 0.58 -0.54 0.00 0.00 174.62 176.23 2jvc h VAL 28 N -0.80 0.64 -0.67 2.29 2.07 -0.65 -1.99 116.25 117.13 2jvc h VAL 28 Ca -0.45 -0.08 0.13 0.00 0.82 0.00 0.00 66.70 67.12 2jvc h VAL 28 Cb 1.31 0.39 -0.13 0.00 -1.52 0.00 0.00 31.29 31.34 2jvc h VAL 28 CO 0.64 0.04 -0.21 1.23 0.02 0.00 0.00 177.57 179.28 2jvc h GLY 29 N 0.24 0.35 1.46 2.17 0.00 -1.76 0.30 103.07 105.82 2jvc h GLY 29 Ca 0.30 0.28 -0.02 0.00 0.00 0.00 0.00 47.33 47.89 2jvc h GLY 29 CO -0.40 -0.25 0.24 0.00 0.00 0.00 0.00 176.54 176.13 2jvc h ALA 30 N 1.52 1.47 -0.32 3.60 0.00 -1.69 -2.67 119.26 121.18 2jvc h ALA 30 Ca 0.31 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 2jvc h ALA 30 Cb 0.52 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2jvc h ALA 30 CO -0.71 0.42 0.06 0.28 0.00 0.00 0.00 179.25 179.31 2jvc h VAL 31 N 0.71 1.23 -0.84 0.00 2.07 -0.15 -2.54 116.25 116.74 2jvc h VAL 31 Ca 0.18 -0.77 0.09 0.00 0.82 0.00 0.00 66.70 67.01 2jvc h VAL 31 Cb 0.08 1.13 -0.07 0.00 -1.52 0.00 0.00 31.29 30.91 2jvc h VAL 31 CO -0.02 0.26 0.49 0.11 0.02 0.00 0.00 177.57 178.43 2jvc h LYS 32 N 0.35 0.81 -0.70 1.57 6.56 -0.68 -1.43 116.57 123.05 2jvc h LYS 32 Ca 0.10 -0.05 -0.05 0.00 -1.06 0.00 0.00 60.65 59.59 2jvc h LYS 32 Cb 0.32 -0.18 -0.03 0.00 -0.57 0.00 0.00 32.23 31.77 2jvc h LYS 32 CO 0.00 0.54 0.25 0.00 -2.06 0.00 0.00 179.45 178.19 2jvc h ALA 33 N 1.45 0.91 -0.58 3.86 0.00 -1.34 -1.84 119.26 121.73 2jvc h ALA 33 Ca 0.40 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2jvc h ALA 33 Cb 0.33 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2jvc h ALA 33 CO -0.23 0.56 0.37 -0.22 0.00 0.00 0.00 179.25 179.73 2jvc h LYS 34 N 1.01 0.78 -0.50 0.00 1.63 -0.86 -2.45 116.57 116.18 2jvc h LYS 34 Ca 0.23 -0.06 -0.08 0.00 -0.85 0.00 0.00 60.65 59.90 2jvc h LYS 34 Cb 0.25 -0.17 -0.02 0.00 -0.60 0.00 0.00 32.23 31.69 2jvc h LYS 34 CO -0.01 0.53 -0.01 0.82 -3.45 0.00 0.00 179.45 177.33 2jvc h ILE 35 N 0.79 1.25 -0.56 2.00 1.08 -1.13 -1.30 117.51 119.64 2jvc h ILE 35 Ca 0.21 -1.04 0.06 0.00 -0.39 0.00 0.00 64.86 63.70 2jvc h ILE 35 Cb -0.06 0.87 -0.05 0.00 -3.07 0.00 0.00 36.82 34.51 2jvc h ILE 35 CO -0.04 0.37 0.27 0.22 -0.69 0.00 0.00 178.15 178.28 2jvc h TYR 36 N 0.78 0.49 -0.00 1.37 3.20 -0.87 -1.81 116.97 120.12 2jvc h TYR 36 Ca 0.15 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.88 2jvc h TYR 36 Cb 0.48 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 2jvc h TYR 36 CO 0.03 0.22 -0.77 0.22 -1.64 0.00 0.00 178.16 176.22 2jvc h ASP 37 N 0.51 0.08 -0.55 -2.11 3.58 -1.31 0.80 116.42 117.42 2jvc h ASP 37 Ca 0.25 -0.06 0.08 0.00 0.42 0.00 0.00 57.03 57.73 2jvc h ASP 37 Cb 0.19 -0.02 -0.07 0.00 1.72 0.00 0.00 39.33 41.15 2jvc h ASP 37 CO -0.19 0.81 0.18 0.11 -2.88 0.00 0.00 179.24 177.27 2jvc h LYS 38 N 0.04 0.34 0.00 0.28 6.56 -0.38 -3.37 116.57 120.03 2jvc h LYS 38 Ca -0.02 -0.02 -0.08 0.00 -1.06 0.00 0.00 60.65 59.48 2jvc h LYS 38 Cb 1.35 -0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 32.92 2jvc h LYS 38 CO 0.11 0.23 -0.99 -0.85 -2.06 0.00 0.00 179.45 175.88 2jvc n GLU 39 N -5.03 0.15 0.00 3.15 0.28 -1.00 -5.08 120.64 113.11 2jvc n GLU 39 Ca 0.07 0.06 0.00 0.00 -0.16 0.00 0.00 57.16 57.13 2jvc n GLU 39 Cb 0.25 -0.76 0.00 0.00 1.43 0.00 0.00 31.44 32.36 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 2.69 0.72 3.43 -1.84 0.00 0.28 -5.09 105.19 105.38 2jvc n GLY 40 Ca -0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.14 2.34 -0.25 -0.61 -4.36 -1.06 -5.03 121.20 112.09 2jvc s ILE 41 Ca 0.00 -2.11 -0.29 0.00 -0.26 0.00 0.00 60.65 57.99 2jvc s ILE 41 Cb 0.00 -2.14 -0.02 0.00 1.25 0.00 0.00 42.46 41.54 2jvc s ILE 41 CO 0.00 -0.20 1.63 -2.16 0.24 0.00 0.00 174.94 174.44 2jvc s PRO 42 N -2.88 3.72 0.38 0.37 0.04 -1.26 -4.47 135.00 130.90 2jvc s PRO 42 Ca 0.23 1.59 0.17 0.00 0.04 0.00 0.00 61.00 63.02 2jvc s PRO 42 Cb -0.07 -4.05 0.77 0.00 0.04 0.00 0.00 34.50 31.18 2jvc s PRO 42 CO 0.11 -1.38 1.80 -1.00 0.04 0.00 0.00 177.00 176.56 2jvc h PRO 43 N 11.00 0.00 0.00 0.56 0.13 -1.90 -2.39 132.00 139.40 2jvc h PRO 43 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 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 1.01 0.37 0.00 0.22 -0.23 0.00 0.00 178.00 179.37 2jvc h ASP 44 N 0.00 0.00 0.00 1.44 3.58 -1.96 -3.07 116.42 116.41 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 0.77 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.82 2jvc h ASP 44 CO 0.05 0.00 -1.19 0.00 -2.88 0.00 0.00 179.24 175.22 2jvc n GLN 45 N -2.47 0.34 -4.11 0.28 6.02 -1.00 -4.96 117.38 111.49 2jvc n GLN 45 Ca 0.04 -0.04 -0.24 0.00 -0.01 0.00 0.00 57.00 56.75 2jvc n GLN 45 Cb 0.41 -1.47 -0.05 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 -3.05 2.89 0.12 -1.09 1.03 -0.94 -2.55 119.66 116.07 2jvc s GLN 46 Ca 0.04 -0.98 -0.08 0.00 0.04 0.00 0.00 55.36 54.38 2jvc s GLN 46 Cb 0.15 -2.59 -0.01 0.00 0.03 0.00 0.00 33.01 30.59 2jvc s GLN 46 CO 0.85 0.44 0.21 1.03 -2.54 0.00 0.00 175.29 175.27 2jvc s ARG 47 N -3.51 0.95 0.05 9.60 3.00 -0.11 -4.90 118.95 124.04 2jvc s ARG 47 Ca 0.32 -1.07 0.02 0.00 0.00 0.00 0.00 55.73 54.99 2jvc s ARG 47 Cb -0.09 0.34 -0.04 0.00 0.00 0.00 0.00 34.95 35.17 2jvc s ARG 47 CO 0.24 -0.32 0.08 -0.51 0.00 0.00 0.00 175.30 174.79 2jvc s LEU 48 N -2.91 3.82 -0.02 2.53 2.01 -1.26 -1.30 118.68 121.54 2jvc s LEU 48 Ca 0.11 0.04 -0.00 0.00 0.01 0.00 0.00 54.13 54.28 2jvc s LEU 48 Cb 0.05 -2.39 0.03 0.00 0.01 0.00 0.00 46.19 43.88 2jvc s LEU 48 CO -0.06 0.21 0.04 -0.63 1.01 0.00 0.00 176.35 176.91 2jvc s ILE 49 N -1.31 -0.07 -0.27 -0.59 1.01 0.14 -1.23 121.20 118.88 2jvc s ILE 49 Ca 0.27 0.26 0.02 0.00 0.00 0.00 0.00 60.65 61.19 2jvc s ILE 49 Cb -0.12 -0.09 0.06 0.00 0.01 0.00 0.00 42.46 42.32 2jvc s ILE 49 CO 0.19 0.11 -0.08 0.12 0.00 0.00 0.00 174.94 175.28 2jvc s PHE 50 N 1.27 3.30 0.00 3.97 2.19 0.11 -1.74 117.98 127.08 2jvc s PHE 50 Ca -0.07 -2.29 0.00 0.00 0.33 0.00 0.00 56.93 54.91 2jvc s PHE 50 Cb -0.13 -2.04 0.00 0.00 -1.31 0.00 0.00 43.02 39.54 2jvc s PHE 50 CO -0.03 -0.87 0.00 0.41 1.83 0.00 0.00 175.22 176.56 2jvc n GLY 51 N 4.46 1.17 0.00 13.12 0.00 -1.26 -2.77 105.19 119.91 2jvc n GLY 51 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 1.27 3.86 -0.02 0.00 -1.26 -5.12 105.19 101.93 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 3.80 0.85 1.61 0.00 -1.11 -5.01 119.74 119.87 2jvc s LYS 53 Ca 0.00 0.23 -0.11 0.00 0.00 0.00 0.00 55.97 56.09 2jvc s LYS 53 Cb 0.00 -2.95 0.10 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 -2.02 1.66 -0.14 1.78 1.11 -1.26 0.08 119.66 120.87 2jvc s GLN 54 Ca 0.35 0.85 0.01 0.00 0.01 0.00 0.00 55.36 56.58 2jvc s GLN 54 Cb -0.14 -1.85 0.00 0.00 -1.01 0.00 0.00 33.01 30.01 2jvc s GLN 54 CO 0.19 -1.97 -0.18 -0.51 0.01 0.00 0.00 175.29 172.84 2jvc s LEU 55 N -6.05 2.37 0.00 2.90 1.43 -0.37 -4.74 118.68 114.22 2jvc s LEU 55 Ca 0.62 -0.50 -0.18 0.00 -1.03 0.00 0.00 54.13 53.04 2jvc s LEU 55 Cb -0.17 -1.52 0.27 0.00 0.03 0.00 0.00 46.19 44.80 2jvc s LEU 55 CO 0.56 0.10 0.83 1.21 0.23 0.00 0.00 176.35 179.28 2jvc n GLU 56 N 3.95 -3.37 0.23 1.70 4.07 -1.26 -4.62 120.64 121.34 2jvc n GLU 56 Ca -0.19 -1.34 0.15 0.00 -0.06 0.00 0.00 57.16 55.72 2jvc n GLU 56 Cb 0.52 -1.42 0.55 0.00 -0.06 0.00 0.00 31.44 31.03 2jvc n GLU 56 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 2jvc h ASP 57 N -2.76 0.00 -0.17 4.31 3.32 -2.00 -2.77 116.42 116.35 2jvc h ASP 57 Ca -0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.72 2jvc h ASP 57 Cb 1.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2jvc h ASP 57 CO 0.21 0.00 0.00 -0.24 -1.72 0.00 0.00 179.24 177.49 2jvc n SER 58 N -2.89 2.44 -4.57 6.45 2.88 -1.26 0.06 113.62 116.73 2jvc n SER 58 Ca 0.02 -1.72 -0.42 0.00 -1.33 0.00 0.00 58.87 55.42 2jvc n SER 58 Cb 0.34 -0.11 -0.01 0.00 -0.75 0.00 0.00 64.21 63.68 2jvc n SER 58 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 2jvc s ASN 59 N -1.02 6.69 0.00 -3.46 -0.87 -1.05 -4.02 114.94 111.21 2jvc s ASN 59 Ca 0.19 -2.15 0.00 0.00 -1.57 0.00 0.00 52.86 49.34 2jvc s ASN 59 Cb 0.12 -2.58 0.00 0.00 -0.02 0.00 0.00 41.25 38.77 2jvc s ASN 59 CO 0.16 -1.32 0.00 0.00 -2.57 0.00 0.00 177.10 173.37 2jvc n ALA 60 N 8.73 0.00 -0.07 0.60 0.00 -1.26 -4.72 120.51 123.80 2jvc n ALA 60 Ca 0.45 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.81 2jvc n ALA 60 Cb 0.47 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.91 2jvc n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jvc h MET 61 N 0.00 0.07 0.01 0.00 -0.00 -1.76 -2.18 114.93 111.06 2jvc h MET 61 Ca 0.00 -0.00 -0.20 0.00 -0.00 0.00 0.00 59.70 59.50 2jvc h MET 61 Cb 0.00 -0.01 -0.01 0.00 -0.00 0.00 0.00 31.60 31.57 2jvc h MET 61 CO 0.00 0.04 -0.89 1.03 -0.00 0.00 0.00 176.91 177.09 2jvc h SER 62 N 0.07 0.26 -0.17 -0.10 0.87 -1.85 -3.13 113.55 109.49 2jvc h SER 62 Ca 0.13 -0.22 0.05 0.00 -1.23 0.00 0.00 61.79 60.52 2jvc h SER 62 Cb 0.17 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 2jvc h SER 62 CO -0.22 1.03 0.18 -0.78 -0.53 0.00 0.00 176.83 176.51 2jvc h ASP 63 N 0.11 0.00 -0.21 6.23 1.82 -1.58 -3.45 116.42 119.33 2jvc h ASP 63 Ca -0.05 0.00 -0.09 0.00 -0.39 0.00 0.00 57.03 56.50 2jvc h ASP 63 Cb 1.53 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 41.50 2jvc h ASP 63 CO 0.14 0.00 -0.08 0.00 -1.61 0.00 0.00 179.24 177.68 2jvc n TYR 64 N -3.84 0.00 -0.63 0.28 9.36 -0.87 -4.89 117.16 116.58 2jvc n TYR 64 Ca 0.01 0.00 0.07 0.00 3.32 0.00 0.00 57.90 61.31 2jvc n TYR 64 Cb 0.31 -1.15 0.22 0.00 -0.63 0.00 0.00 39.34 38.09 2jvc n TYR 64 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 2jvc n ASN 65 N 0.77 3.53 -4.35 2.98 6.94 -1.22 -4.85 115.26 119.06 2jvc n ASN 65 Ca -0.04 -2.56 -0.46 0.00 -0.02 0.00 0.00 54.58 51.50 2jvc n ASN 65 Cb 0.18 -0.41 -0.01 0.00 -2.36 0.00 0.00 39.78 37.17 2jvc n ASN 65 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2jvc s VAL 66 N -2.00 5.68 0.52 3.53 0.11 -1.25 -4.84 120.40 122.16 2jvc s VAL 66 Ca 0.34 -2.79 0.02 0.00 -2.93 0.00 0.00 61.98 56.63 2jvc s VAL 66 Cb 0.25 -4.56 0.10 0.00 -1.53 0.00 0.00 36.38 30.63 2jvc s VAL 66 CO 0.12 -1.15 0.72 0.00 -3.33 0.00 0.00 175.10 171.47 2jvc n GLN 67 N 3.73 0.26 0.19 1.54 10.64 -1.26 -4.94 117.38 127.54 2jvc n GLN 67 Ca 0.19 -2.18 0.07 0.00 -1.83 0.00 0.00 57.00 53.25 2jvc n GLN 67 Cb 0.44 -0.41 0.59 0.00 -0.86 0.00 0.00 30.24 30.00 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 0.12 -1.77 2.61 1.63 -1.94 -3.29 116.57 113.93 2jvc h LYS 68 Ca -0.24 -0.01 -0.40 0.00 -0.85 0.00 0.00 60.65 59.15 2jvc h LYS 68 Cb 0.94 -0.03 -0.28 0.00 -0.60 0.00 0.00 32.23 32.26 2jvc h LYS 68 CO 0.28 0.08 -0.77 -0.85 -3.45 0.00 0.00 179.45 174.74 2jvc n GLU 69 N -4.52 0.34 -3.56 1.90 0.28 -1.11 -2.83 120.64 111.14 2jvc n GLU 69 Ca -0.01 -2.68 -0.36 0.00 -0.16 0.00 0.00 57.16 53.95 2jvc n GLU 69 Cb 0.10 -1.58 -0.07 0.00 1.43 0.00 0.00 31.44 31.32 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 0.40 6.43 -0.24 -1.84 0.15 -1.25 -4.87 113.70 112.47 2jvc s SER 70 Ca 0.32 0.50 -0.16 0.00 0.70 0.00 0.00 55.95 57.30 2jvc s SER 70 Cb 0.02 -2.17 -0.04 0.00 -1.71 0.00 0.00 66.02 62.12 2jvc s SER 70 CO -0.14 0.12 0.42 0.42 1.20 0.00 0.00 173.24 175.26 2jvc s THR 71 N 0.38 5.15 0.08 6.45 -4.23 -1.26 0.07 115.64 122.29 2jvc s THR 71 Ca 0.16 0.70 0.04 0.00 -1.18 0.00 0.00 61.69 61.41 2jvc s THR 71 Cb -0.13 -3.74 -0.03 0.00 1.34 0.00 0.00 72.50 69.94 2jvc s THR 71 CO 0.04 0.17 -0.11 -1.48 -0.54 0.00 0.00 174.62 172.70 2jvc s LEU 72 N 1.88 2.35 -0.27 4.79 0.05 -0.79 -5.00 118.68 121.69 2jvc s LEU 72 Ca 0.18 -0.73 -0.14 0.00 0.05 0.00 0.00 54.13 53.50 2jvc s LEU 72 Cb -0.15 -0.33 -0.04 0.00 -2.05 0.00 0.00 46.19 43.62 2jvc s LEU 72 CO 0.09 -0.21 0.32 -2.28 -0.55 0.00 0.00 176.35 173.72 2jvc s HIS 73 N -2.01 3.25 -0.27 3.48 5.65 -0.71 -2.06 115.29 122.61 2jvc s HIS 73 Ca 0.01 0.35 -0.07 0.00 0.25 0.00 0.00 55.06 55.60 2jvc s HIS 73 Cb -0.06 -2.51 -0.01 0.00 -1.18 0.00 0.00 32.58 28.83 2jvc s HIS 73 CO 0.01 -0.18 0.07 -1.17 -0.65 0.00 0.00 174.74 172.82 2jvc s LEU 74 N 1.89 3.63 -0.15 8.88 2.96 0.22 0.27 118.68 136.38 2jvc s LEU 74 Ca 0.13 -0.46 -0.02 0.00 -0.22 0.00 0.00 54.13 53.56 2jvc s LEU 74 Cb -0.16 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.61 2jvc s LEU 74 CO 0.10 -0.11 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.25 2jvc s VAL 75 N 1.56 3.48 -0.03 1.68 1.01 -0.42 -1.83 120.40 125.84 2jvc s VAL 75 Ca 0.05 -0.50 0.05 0.00 0.00 0.00 0.00 61.98 61.58 2jvc s VAL 75 Cb -0.16 -2.51 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 2jvc s VAL 75 CO 0.03 0.50 -0.20 -0.76 0.00 0.00 0.00 175.10 174.67 2jvc s LEU 76 N 0.52 1.99 -0.68 3.92 1.02 -1.26 -0.94 118.68 123.25 2jvc s LEU 76 Ca -0.06 -0.39 0.04 0.00 0.02 0.00 0.00 54.13 53.75 2jvc s LEU 76 Cb -0.15 -1.07 0.31 0.00 0.02 0.00 0.00 46.19 45.30 2jvc s LEU 76 CO 0.03 0.21 1.04 0.54 0.02 0.00 0.00 176.35 178.19 2jvc n ARG 77 N 2.87 3.42 0.07 1.70 3.00 -1.06 -4.88 116.66 121.78 2jvc n ARG 77 Ca -0.17 -4.77 -0.12 0.00 -0.01 0.00 0.00 57.85 52.78 2jvc n ARG 77 Cb 0.53 -2.29 -0.06 0.00 0.00 0.00 0.00 32.46 30.63 2jvc n ARG 77 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 2jvc h LEU 78 N 3.61 -0.16 0.00 0.55 4.07 -1.97 -3.48 115.31 117.93 2jvc h LEU 78 Ca 0.21 0.02 0.05 0.00 0.08 0.00 0.00 57.88 58.23 2jvc h LEU 78 Cb 0.53 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.32 2jvc h LEU 78 CO 0.90 -0.10 -0.06 -1.14 -1.08 0.00 0.00 178.44 176.97 2jvc n ARG 79 N -5.17 -0.34 0.00 1.13 3.00 -1.26 -5.02 116.66 109.00 2jvc n ARG 79 Ca -0.07 0.22 0.00 0.00 -0.00 0.00 0.00 57.85 58.00 2jvc n ARG 79 Cb 0.10 -0.42 0.00 0.00 0.00 0.00 0.00 32.46 32.14 2jvc n ARG 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2jvc n GLY 80 N -0.51 0.99 0.00 5.14 0.00 -1.26 -5.12 105.19 104.44 2jvc n GLY 80 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 -0.66 0.06 -0.02 0.00 -1.26 -5.36 105.19 97.95 2jvc n GLY 81 Ca 0.00 -1.30 0.16 0.00 0.00 0.00 0.00 46.02 44.88 2jvc n GLY 81 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70