#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jvc n PRO 2 N 0.00 -2.60 -4.19 1.61 -0.04 -1.26 -5.09 135.00 123.43 2jvc n PRO 2 Ca 0.00 -1.29 -0.17 0.00 -0.04 0.00 0.00 63.50 62.00 2jvc n PRO 2 Cb 0.00 -1.21 -0.11 0.00 -0.04 0.00 0.00 33.50 32.14 2jvc n PRO 2 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2jvc s LEU 3 N 0.00 2.35 0.00 1.53 1.02 -1.26 -5.07 118.68 117.26 2jvc s LEU 3 Ca 0.52 -0.73 0.00 0.00 0.02 0.00 0.00 54.13 53.94 2jvc s LEU 3 Cb -0.05 -0.45 0.00 0.00 0.02 0.00 0.00 46.19 45.71 2jvc s LEU 3 CO 0.40 -0.16 0.00 0.61 0.02 0.00 0.00 176.35 177.23 2jvc n GLY 4 N 0.84 0.37 1.31 -3.19 0.00 -1.26 -5.06 105.19 98.21 2jvc n GLY 4 Ca -0.18 -0.93 0.17 0.00 0.00 0.00 0.00 46.02 45.07 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 4.35 -7.65 -1.97 1.61 7.64 -1.26 -5.06 113.62 111.28 2jvc n SER 5 Ca 0.00 1.05 -0.07 0.00 1.01 0.00 0.00 58.87 60.86 2jvc n SER 5 Cb 0.00 -4.32 -0.02 0.00 -1.01 0.00 0.00 64.21 58.86 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 -4.14 0.33 -4.09 1.43 0.00 -0.44 -4.98 117.12 105.23 2jvc n MET 6 Ca -0.05 -1.37 -0.08 0.00 0.00 0.00 0.00 57.70 56.20 2jvc n MET 6 Cb 0.61 1.30 -0.10 0.00 0.00 0.00 0.00 33.22 35.04 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 -2.40 0.60 0.15 3.17 -0.21 -1.09 0.14 119.66 120.02 2jvc s GLN 7 Ca 0.14 -1.13 0.06 0.00 0.02 0.00 0.00 55.36 54.45 2jvc s GLN 7 Cb -0.00 0.09 -0.04 0.00 1.00 0.00 0.00 33.01 34.05 2jvc s GLN 7 CO 0.10 -0.08 -0.12 0.96 -2.12 0.00 0.00 175.29 174.04 2jvc s ILE 8 N -3.36 1.35 -0.17 1.08 -4.36 0.48 -2.74 121.20 113.47 2jvc s ILE 8 Ca 0.04 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.41 2jvc s ILE 8 Cb 0.04 -1.80 -0.01 0.00 1.25 0.00 0.00 42.46 41.94 2jvc s ILE 8 CO -0.07 -0.62 -0.08 -0.36 0.24 0.00 0.00 174.94 174.06 2jvc s PHE 9 N -2.90 2.91 -0.14 1.37 0.08 0.12 -1.75 117.98 117.68 2jvc s PHE 9 Ca 0.16 -0.69 0.00 0.00 0.12 0.00 0.00 56.93 56.52 2jvc s PHE 9 Cb -0.00 -1.97 -0.01 0.00 -0.57 0.00 0.00 43.02 40.47 2jvc s PHE 9 CO 0.03 -0.31 -0.15 0.08 -0.10 0.00 0.00 175.22 174.77 2jvc s VAL 10 N 0.80 2.76 -0.32 -0.44 1.01 -0.28 -1.86 120.40 122.07 2jvc s VAL 10 Ca -0.03 -0.75 -0.09 0.00 0.00 0.00 0.00 61.98 61.12 2jvc s VAL 10 Cb -0.15 -2.16 0.01 0.00 0.00 0.00 0.00 36.38 34.09 2jvc s VAL 10 CO 0.01 0.52 0.14 -0.75 0.00 0.00 0.00 175.10 175.02 2jvc s LYS 11 N 0.62 3.03 0.75 2.72 2.20 -0.89 -1.79 119.74 126.38 2jvc s LYS 11 Ca -0.08 -0.91 -0.11 0.00 -0.36 0.00 0.00 55.97 54.50 2jvc s LYS 11 Cb -0.16 -3.53 0.04 0.00 -1.51 0.00 0.00 37.83 32.67 2jvc s LYS 11 CO 0.03 -0.53 1.08 0.95 -0.36 0.00 0.00 175.35 176.52 2jvc s THR 12 N 1.53 3.58 0.56 3.43 -4.23 -0.90 0.80 115.64 120.41 2jvc s THR 12 Ca 0.02 0.51 0.40 0.00 -1.18 0.00 0.00 61.69 61.45 2jvc s THR 12 Cb -0.18 -3.18 0.40 0.00 1.34 0.00 0.00 72.50 70.88 2jvc s THR 12 CO 0.05 -0.67 2.23 0.25 -0.54 0.00 0.00 174.62 175.94 2jvc h LEU 13 N -0.95 0.00 -1.34 4.79 5.85 -1.62 0.25 115.31 122.29 2jvc h LEU 13 Ca -0.45 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.27 2jvc h LEU 13 Cb 1.23 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.26 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 -2.95 0.45 -2.58 1.05 -2.24 -1.26 -4.93 114.28 101.82 2jvc n THR 14 Ca -0.03 -0.48 -0.09 0.00 -2.27 0.00 0.00 64.05 61.19 2jvc n THR 14 Cb 0.10 0.28 0.04 0.00 -2.10 0.00 0.00 70.33 68.66 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 1.11 -0.13 3.06 3.38 0.00 0.86 -5.04 105.19 108.43 2jvc n GLY 15 Ca 0.13 0.06 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 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 -4.13 2.56 -0.28 1.61 2.36 -1.24 -4.91 119.74 115.72 2jvc s LYS 16 Ca 0.16 -0.67 -0.21 0.00 -2.55 0.00 0.00 55.97 52.70 2jvc s LYS 16 Cb -0.02 -2.29 -0.01 0.00 -1.05 0.00 0.00 37.83 34.46 2jvc s LYS 16 CO 0.40 -0.23 0.65 0.95 1.55 0.00 0.00 175.35 178.67 2jvc s THR 17 N 1.41 4.95 0.02 3.43 -4.23 -1.26 -2.11 115.64 117.84 2jvc s THR 17 Ca 0.05 1.03 0.07 0.00 -1.18 0.00 0.00 61.69 61.66 2jvc s THR 17 Cb -0.13 -3.98 -0.02 0.00 1.34 0.00 0.00 72.50 69.71 2jvc s THR 17 CO -0.12 -0.07 -0.20 -0.51 -0.54 0.00 0.00 174.62 173.19 2jvc s ILE 18 N 2.59 1.58 -0.07 2.99 2.07 -0.74 -4.97 121.20 124.65 2jvc s ILE 18 Ca 0.26 -1.04 0.02 0.00 -1.41 0.00 0.00 60.65 58.49 2jvc s ILE 18 Cb -0.15 -1.35 -0.02 0.00 0.13 0.00 0.00 42.46 41.06 2jvc s ILE 18 CO 0.10 0.29 -0.13 -0.89 -1.91 0.00 0.00 174.94 172.40 2jvc s THR 19 N -0.66 3.18 -0.05 4.00 2.01 -1.26 -1.12 115.64 121.74 2jvc s THR 19 Ca 0.07 -0.66 -0.02 0.00 0.31 0.00 0.00 61.69 61.39 2jvc s THR 19 Cb -0.08 -2.28 0.03 0.00 0.01 0.00 0.00 72.50 70.18 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 -0.50 -0.04 -0.19 1.82 -4.36 -0.72 -4.96 121.20 112.25 2jvc s ILE 20 Ca 0.07 0.15 -0.27 0.00 -0.26 0.00 0.00 60.65 60.34 2jvc s ILE 20 Cb -0.12 -0.19 -0.01 0.00 1.25 0.00 0.00 42.46 43.40 2jvc s ILE 20 CO 0.02 0.06 0.91 1.51 0.24 0.00 0.00 174.94 177.68 2jvc s ASP 21 N 0.94 7.01 0.17 4.36 -4.77 -1.26 -0.39 116.67 122.73 2jvc s ASP 21 Ca -0.07 1.25 0.02 0.00 -3.30 0.00 0.00 52.55 50.45 2jvc s ASP 21 Cb -0.10 -2.49 -0.05 0.00 -1.09 0.00 0.00 42.92 39.20 2jvc s ASP 21 CO -0.04 -0.50 -0.01 0.68 0.70 0.00 0.00 175.17 176.00 2jvc s VAL 22 N 2.54 0.73 0.15 2.11 -7.23 0.36 -4.92 120.40 114.15 2jvc s VAL 22 Ca 0.41 -1.98 0.08 0.00 -1.81 0.00 0.00 61.98 58.67 2jvc s VAL 22 Cb -0.16 -2.07 -0.04 0.00 0.56 0.00 0.00 36.38 34.67 2jvc s VAL 22 CO 0.11 -0.52 -0.10 -0.62 -0.31 0.00 0.00 175.10 173.65 2jvc s ASP 23 N -3.17 4.28 0.38 4.85 -1.08 -1.26 -1.33 116.67 119.34 2jvc s ASP 23 Ca 0.23 -0.52 0.26 0.00 -0.52 0.00 0.00 52.55 51.99 2jvc s ASP 23 Cb 0.06 -0.75 1.37 0.00 -1.46 0.00 0.00 42.92 42.14 2jvc s ASP 23 CO 0.03 0.13 1.79 1.12 0.52 0.00 0.00 175.17 178.76 2jvc h HIS 24 N 3.16 0.00 -0.17 -5.34 2.07 -1.96 0.81 115.15 113.72 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 1.19 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.17 2jvc h HIS 24 CO 0.63 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 175.49 2jvc n ALA 25 N -1.83 2.51 -2.76 6.11 0.00 -1.26 -4.14 120.51 119.14 2jvc n ALA 25 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.02 2jvc n ALA 25 Cb 0.06 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.43 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 0.07 0.04 -3.98 0.00 8.00 0.28 -5.06 116.55 115.90 2jvc n ASP 26 Ca 0.12 -0.74 -0.10 0.00 0.71 0.00 0.00 54.79 54.79 2jvc n ASP 26 Cb 0.22 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.25 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 1.23 0.06 0.15 -3.53 -4.23 -1.26 -4.30 115.64 103.75 2jvc s THR 27 Ca 0.00 -1.42 -0.18 0.00 -1.18 0.00 0.00 61.69 58.91 2jvc s THR 27 Cb 0.00 -1.90 0.01 0.00 1.34 0.00 0.00 72.50 71.95 2jvc s THR 27 CO 0.00 -0.27 1.72 0.58 -0.54 0.00 0.00 174.62 176.11 2jvc h VAL 28 N 2.53 0.82 -0.47 2.29 2.07 -0.52 -1.97 116.25 121.01 2jvc h VAL 28 Ca -0.32 -0.04 0.09 0.00 0.82 0.00 0.00 66.70 67.26 2jvc h VAL 28 Cb 1.23 0.68 -0.09 0.00 -1.52 0.00 0.00 31.29 31.59 2jvc h VAL 28 CO 0.48 0.02 -0.11 1.23 0.02 0.00 0.00 177.57 179.21 2jvc h GLY 29 N 0.12 0.34 1.01 2.17 0.00 -1.77 -0.13 103.07 104.82 2jvc h GLY 29 Ca 0.14 0.15 0.01 0.00 0.00 0.00 0.00 47.33 47.63 2jvc h GLY 29 CO -0.21 -0.18 0.55 0.00 0.00 0.00 0.00 176.54 176.70 2jvc h ALA 30 N 1.47 1.07 -0.59 3.60 0.00 -1.78 -2.56 119.26 120.47 2jvc h ALA 30 Ca 0.23 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2jvc h ALA 30 Cb 0.34 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2jvc h ALA 30 CO -0.48 0.49 0.35 0.28 0.00 0.00 0.00 179.25 179.89 2jvc h VAL 31 N 1.15 1.18 -0.87 0.00 2.07 -0.45 -2.46 116.25 116.86 2jvc h VAL 31 Ca 0.31 -0.41 0.09 0.00 0.82 0.00 0.00 66.70 67.50 2jvc h VAL 31 Cb -0.12 0.39 -0.07 0.00 -1.52 0.00 0.00 31.29 29.97 2jvc h VAL 31 CO -0.06 0.19 0.52 0.11 0.02 0.00 0.00 177.57 178.34 2jvc h LYS 32 N 0.79 0.87 -0.72 1.57 6.56 -0.68 -1.51 116.57 123.46 2jvc h LYS 32 Ca 0.21 -0.05 -0.05 0.00 -1.06 0.00 0.00 60.65 59.70 2jvc h LYS 32 Cb -0.00 -0.20 -0.03 0.00 -0.57 0.00 0.00 32.23 31.43 2jvc h LYS 32 CO -0.04 0.57 0.25 0.00 -2.06 0.00 0.00 179.45 178.18 2jvc h ALA 33 N 1.45 0.94 -0.77 3.86 0.00 -1.19 -1.99 119.26 121.56 2jvc h ALA 33 Ca 0.40 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 55.12 2jvc h ALA 33 Cb 0.31 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2jvc h ALA 33 CO -0.22 0.59 0.51 -0.22 0.00 0.00 0.00 179.25 179.91 2jvc h LYS 34 N 1.04 1.00 -0.35 0.00 1.63 -0.86 -2.26 116.57 116.77 2jvc h LYS 34 Ca 0.23 -0.06 -0.10 0.00 -0.85 0.00 0.00 60.65 59.87 2jvc h LYS 34 Cb 0.27 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 31.66 2jvc h LYS 34 CO -0.01 0.66 -0.21 0.82 -3.45 0.00 0.00 179.45 177.26 2jvc h ILE 35 N 1.03 1.27 -0.60 2.00 1.08 -1.14 -1.84 117.51 119.30 2jvc h ILE 35 Ca 0.29 -1.27 0.06 0.00 -0.39 0.00 0.00 64.86 63.54 2jvc h ILE 35 Cb -0.10 1.22 -0.05 0.00 -3.07 0.00 0.00 36.82 34.82 2jvc h ILE 35 CO -0.07 0.42 0.32 0.22 -0.69 0.00 0.00 178.15 178.34 2jvc h TYR 36 N 0.58 0.58 -0.01 1.37 3.20 -0.78 -1.87 116.97 120.04 2jvc h TYR 36 Ca 0.09 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.81 2jvc h TYR 36 Cb 0.67 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.75 2jvc h TYR 36 CO 0.03 0.27 -0.78 0.22 -1.64 0.00 0.00 178.16 176.26 2jvc h ASP 37 N 0.59 0.16 -0.53 -2.11 1.82 -1.37 0.86 116.42 115.85 2jvc h ASP 37 Ca 0.27 -0.12 0.08 0.00 -0.39 0.00 0.00 57.03 56.87 2jvc h ASP 37 Cb 0.18 -0.05 -0.06 0.00 0.68 0.00 0.00 39.33 40.08 2jvc h ASP 37 CO -0.18 0.87 0.19 0.11 -1.61 0.00 0.00 179.24 178.62 2jvc h LYS 38 N 0.08 0.35 0.00 0.28 6.56 -0.53 -3.37 116.57 119.95 2jvc h LYS 38 Ca -0.02 -0.02 -0.11 0.00 -1.06 0.00 0.00 60.65 59.44 2jvc h LYS 38 Cb 1.36 -0.08 -0.02 0.00 -0.57 0.00 0.00 32.23 32.93 2jvc h LYS 38 CO 0.11 0.23 -1.11 -0.85 -2.06 0.00 0.00 179.45 175.78 2jvc n GLU 39 N -5.01 0.25 0.00 3.15 0.28 -0.96 -5.08 120.64 113.26 2jvc n GLU 39 Ca 0.06 0.10 0.00 0.00 -0.16 0.00 0.00 57.16 57.17 2jvc n GLU 39 Cb 0.22 -0.92 0.00 0.00 1.43 0.00 0.00 31.44 32.17 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 2.40 0.85 3.34 -1.84 0.00 0.30 -5.09 105.19 105.14 2jvc n GLY 40 Ca -0.16 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.03 1.72 -0.23 -0.61 -4.36 -1.08 -5.03 121.20 111.59 2jvc s ILE 41 Ca 0.00 -2.13 -0.29 0.00 -0.26 0.00 0.00 60.65 57.97 2jvc s ILE 41 Cb 0.00 -1.97 -0.03 0.00 1.25 0.00 0.00 42.46 41.71 2jvc s ILE 41 CO 0.00 -0.54 1.61 -2.16 0.24 0.00 0.00 174.94 174.09 2jvc s PRO 42 N -3.44 3.78 0.29 0.37 0.04 -1.26 -4.50 135.00 130.28 2jvc s PRO 42 Ca 0.20 1.64 0.07 0.00 0.04 0.00 0.00 61.00 62.95 2jvc s PRO 42 Cb -0.02 -4.04 0.42 0.00 0.04 0.00 0.00 34.50 30.90 2jvc s PRO 42 CO 0.06 -1.31 1.67 -1.00 0.04 0.00 0.00 177.00 176.47 2jvc h PRO 43 N 10.76 0.20 0.00 0.56 0.13 -1.91 -2.71 132.00 139.04 2jvc h PRO 43 Ca -0.33 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2jvc h PRO 43 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2jvc h PRO 43 CO 1.00 0.63 0.00 0.22 -0.23 0.00 0.00 178.00 179.63 2jvc h ASP 44 N 0.17 0.00 0.50 1.44 3.58 -1.95 -2.74 116.42 117.41 2jvc h ASP 44 Ca 0.01 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2jvc h ASP 44 Cb 0.89 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.94 2jvc h ASP 44 CO 0.07 0.00 -0.75 0.00 -2.88 0.00 0.00 179.24 175.68 2jvc n GLN 45 N -2.58 0.16 -4.22 0.28 6.02 -1.03 -4.91 117.38 111.09 2jvc n GLN 45 Ca 0.03 0.02 -0.23 0.00 -0.01 0.00 0.00 57.00 56.80 2jvc n GLN 45 Cb 0.34 -1.57 -0.06 0.00 1.02 0.00 0.00 30.24 29.97 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 -3.10 2.51 0.06 -1.09 -2.07 -1.04 -1.97 119.66 112.96 2jvc s GLN 46 Ca 0.07 -1.25 -0.01 0.00 -1.82 0.00 0.00 55.36 52.35 2jvc s GLN 46 Cb 0.15 -2.32 -0.04 0.00 -1.09 0.00 0.00 33.01 29.72 2jvc s GLN 46 CO 0.75 0.39 -0.02 0.50 -1.32 0.00 0.00 175.29 175.59 2jvc s ARG 47 N -3.61 0.65 -0.01 9.60 6.06 0.65 -4.93 118.95 127.37 2jvc s ARG 47 Ca 0.31 -1.24 -0.01 0.00 -2.50 0.00 0.00 55.73 52.29 2jvc s ARG 47 Cb -0.07 0.20 -0.04 0.00 0.06 0.00 0.00 34.95 35.09 2jvc s ARG 47 CO 0.21 -0.12 0.09 -0.51 -2.50 0.00 0.00 175.30 172.48 2jvc s LEU 48 N -2.94 3.97 -0.03 -0.88 2.01 -1.26 -1.57 118.68 117.98 2jvc s LEU 48 Ca 0.09 0.18 -0.01 0.00 0.01 0.00 0.00 54.13 54.40 2jvc s LEU 48 Cb 0.08 -2.30 0.03 0.00 0.01 0.00 0.00 46.19 44.00 2jvc s LEU 48 CO -0.09 0.28 0.05 -0.63 1.01 0.00 0.00 176.35 176.97 2jvc s ILE 49 N -1.20 -0.08 -0.11 -0.59 1.01 0.12 -1.50 121.20 118.86 2jvc s ILE 49 Ca 0.23 0.34 0.01 0.00 0.00 0.00 0.00 60.65 61.23 2jvc s ILE 49 Cb -0.12 -0.13 0.02 0.00 0.01 0.00 0.00 42.46 42.23 2jvc s ILE 49 CO 0.14 0.15 -0.13 0.12 0.00 0.00 0.00 174.94 175.22 2jvc s PHE 50 N 1.74 1.81 0.00 3.97 2.19 0.12 -1.84 117.98 125.96 2jvc s PHE 50 Ca -0.01 -0.87 0.00 0.00 0.33 0.00 0.00 56.93 56.39 2jvc s PHE 50 Cb -0.12 -1.35 0.00 0.00 -1.31 0.00 0.00 43.02 40.24 2jvc s PHE 50 CO -0.03 -0.49 0.00 0.41 1.83 0.00 0.00 175.22 176.94 2jvc n GLY 51 N 4.41 0.16 0.00 13.12 0.00 -1.26 -2.14 105.19 119.49 2jvc n GLY 51 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.31 1.49 3.88 -0.02 0.00 -1.26 -5.08 105.19 103.89 2jvc n GLY 52 Ca 0.00 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 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 3.73 1.02 1.61 0.00 -0.91 -5.02 119.74 120.17 2jvc s LYS 53 Ca 0.00 0.12 -0.12 0.00 0.00 0.00 0.00 55.97 55.96 2jvc s LYS 53 Cb 0.00 -2.91 0.20 0.00 0.00 0.00 0.00 37.83 35.12 2jvc s LYS 53 CO 0.00 0.50 1.09 -0.65 0.00 0.00 0.00 175.35 176.29 2jvc s GLN 54 N -2.23 0.29 -0.12 1.78 -0.21 -1.26 0.14 119.66 118.05 2jvc s GLN 54 Ca 0.37 0.52 0.03 0.00 0.02 0.00 0.00 55.36 56.30 2jvc s GLN 54 Cb -0.13 -1.72 0.00 0.00 1.00 0.00 0.00 33.01 32.16 2jvc s GLN 54 CO 0.20 -2.83 -0.23 -0.51 -2.12 0.00 0.00 175.29 169.81 2jvc s LEU 55 N -6.52 2.13 0.00 2.90 1.43 -0.56 -4.68 118.68 113.37 2jvc s LEU 55 Ca 0.66 -0.56 -0.13 0.00 -1.03 0.00 0.00 54.13 53.06 2jvc s LEU 55 Cb -0.19 -1.43 0.20 0.00 0.03 0.00 0.00 46.19 44.80 2jvc s LEU 55 CO 0.58 0.13 0.63 -0.62 0.23 0.00 0.00 176.35 177.30 2jvc n GLU 56 N 3.72 -2.69 0.20 1.70 -0.58 -1.26 -4.65 120.64 117.08 2jvc n GLU 56 Ca -0.19 -1.02 0.07 0.00 -0.42 0.00 0.00 57.16 55.60 2jvc n GLU 56 Cb 0.52 -1.04 0.36 0.00 -0.57 0.00 0.00 31.44 30.72 2jvc n GLU 56 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 2jvc h ASP 57 N -2.30 0.00 -0.15 1.62 3.32 -2.00 -3.01 116.42 113.90 2jvc h ASP 57 Ca -0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.80 2jvc h ASP 57 Cb 0.78 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.33 2jvc h ASP 57 CO 0.16 0.31 0.00 -0.24 -1.72 0.00 0.00 179.24 177.75 2jvc n SER 58 N -3.44 2.35 -4.49 6.45 2.88 -1.26 0.20 113.62 116.32 2jvc n SER 58 Ca 0.00 -1.68 -0.43 0.00 -1.33 0.00 0.00 58.87 55.43 2jvc n SER 58 Cb 0.49 -0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.86 2jvc n SER 58 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2jvc n ASN 59 N 0.62 5.06 0.00 -3.46 2.85 -1.14 -3.65 115.26 115.54 2jvc n ASN 59 Ca 0.09 -2.95 0.00 0.00 -0.11 0.00 0.00 54.58 51.61 2jvc n ASN 59 Cb 0.35 -1.65 0.00 0.00 1.24 0.00 0.00 39.78 39.71 2jvc n ASN 59 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jvc n ALA 60 N 6.86 0.00 0.11 5.20 0.00 -1.26 -4.53 120.51 126.89 2jvc n ALA 60 Ca 0.43 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.80 2jvc n ALA 60 Cb 0.44 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.85 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 -0.37 -0.45 0.00 2.86 -1.78 -2.78 114.93 112.42 2jvc h MET 61 Ca 0.00 0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.72 2jvc h MET 61 Cb 0.00 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 2jvc h MET 61 CO 0.00 -0.19 0.30 1.03 1.06 0.00 0.00 176.91 179.11 2jvc h SER 62 N -1.08 0.32 0.24 1.22 0.87 -1.72 0.44 113.55 113.84 2jvc h SER 62 Ca -0.04 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.51 2jvc h SER 62 Cb 0.34 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.23 2jvc h SER 62 CO 0.06 0.21 -0.08 -0.78 -0.53 0.00 0.00 176.83 175.72 2jvc h ASP 63 N 0.37 0.00 -0.05 6.23 3.58 -1.64 -3.46 116.42 121.45 2jvc h ASP 63 Ca 0.20 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.64 2jvc h ASP 63 Cb 0.31 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.36 2jvc h ASP 63 CO -0.05 0.08 -0.01 0.00 -2.88 0.00 0.00 179.24 176.38 2jvc n TYR 64 N -3.68 -0.01 -0.39 0.28 4.19 0.14 -4.93 117.16 112.76 2jvc n TYR 64 Ca -0.02 0.00 0.06 0.00 3.31 0.00 0.00 57.90 61.25 2jvc n TYR 64 Cb 0.18 -0.89 0.17 0.00 0.49 0.00 0.00 39.34 39.29 2jvc n TYR 64 CO 0.00 0.00 0.00 -1.71 0.91 0.00 0.00 176.86 176.06 2jvc n ASN 65 N 1.92 3.10 -4.67 2.98 5.15 -1.06 -4.98 115.26 117.70 2jvc n ASN 65 Ca -0.01 -2.28 -0.39 0.00 -0.60 0.00 0.00 54.58 51.30 2jvc n ASN 65 Cb 0.33 -0.30 -0.06 0.00 -0.53 0.00 0.00 39.78 39.22 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 -1.49 5.07 0.39 3.44 0.11 -1.16 -4.99 120.40 121.77 2jvc s VAL 66 Ca 0.27 1.07 0.01 0.00 -2.93 0.00 0.00 61.98 60.40 2jvc s VAL 66 Cb 0.17 -3.89 -0.00 0.00 -1.53 0.00 0.00 36.38 31.13 2jvc s VAL 66 CO 0.13 0.16 0.04 0.00 -3.33 0.00 0.00 175.10 172.10 2jvc n GLN 67 N 4.77 0.89 0.15 1.54 10.64 -1.26 -5.03 117.38 129.08 2jvc n GLN 67 Ca -0.03 -2.97 0.02 0.00 -1.83 0.00 0.00 57.00 52.19 2jvc n GLN 67 Cb 0.50 1.02 0.38 0.00 -0.86 0.00 0.00 30.24 31.29 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 0.13 -1.76 2.61 1.63 -1.94 -3.26 116.57 113.97 2jvc h LYS 68 Ca -0.32 -0.04 -0.37 0.00 -0.85 0.00 0.00 60.65 59.07 2jvc h LYS 68 Cb 1.03 -0.01 -0.28 0.00 -0.60 0.00 0.00 32.23 32.36 2jvc h LYS 68 CO 0.53 0.37 -0.73 -1.83 -3.45 0.00 0.00 179.45 174.33 2jvc s GLU 69 N -4.50 0.90 -0.18 1.90 -1.05 -1.11 -2.68 118.70 111.99 2jvc s GLU 69 Ca -0.04 -1.42 -0.11 0.00 -0.15 0.00 0.00 54.97 53.24 2jvc s GLU 69 Cb 0.15 -0.75 -0.05 0.00 -0.44 0.00 0.00 34.13 33.04 2jvc s GLU 69 CO 0.73 -1.32 0.18 0.45 0.95 0.00 0.00 175.26 176.25 2jvc s SER 70 N 0.69 6.30 -0.35 0.83 0.15 -1.25 -4.88 113.70 115.19 2jvc s SER 70 Ca 0.28 0.34 -0.18 0.00 0.70 0.00 0.00 55.95 57.09 2jvc s SER 70 Cb -0.02 -2.12 -0.00 0.00 -1.71 0.00 0.00 66.02 62.17 2jvc s SER 70 CO -0.10 0.17 0.49 0.42 1.20 0.00 0.00 173.24 175.42 2jvc s THR 71 N 0.28 5.04 0.13 6.45 -4.23 -1.26 0.16 115.64 122.22 2jvc s THR 71 Ca 0.11 0.29 0.08 0.00 -1.18 0.00 0.00 61.69 60.99 2jvc s THR 71 Cb -0.12 -3.94 -0.04 0.00 1.34 0.00 0.00 72.50 69.74 2jvc s THR 71 CO 0.00 -0.20 -0.20 -1.48 -0.54 0.00 0.00 174.62 172.21 2jvc s LEU 72 N 2.33 2.37 -0.27 4.79 0.05 -0.77 -5.00 118.68 122.18 2jvc s LEU 72 Ca 0.17 -0.77 -0.13 0.00 0.05 0.00 0.00 54.13 53.45 2jvc s LEU 72 Cb -0.16 -0.86 -0.04 0.00 -2.05 0.00 0.00 46.19 43.08 2jvc s LEU 72 CO 0.13 0.01 0.29 -2.28 -0.55 0.00 0.00 176.35 173.96 2jvc s HIS 73 N -1.60 3.25 -0.25 3.48 5.65 -0.77 -2.10 115.29 122.94 2jvc s HIS 73 Ca 0.11 0.30 -0.03 0.00 0.25 0.00 0.00 55.06 55.69 2jvc s HIS 73 Cb -0.08 -2.48 0.01 0.00 -1.18 0.00 0.00 32.58 28.85 2jvc s HIS 73 CO 0.05 -0.18 -0.03 -1.17 -0.65 0.00 0.00 174.74 172.77 2jvc s LEU 74 N 1.86 3.25 -0.04 8.88 2.96 0.24 0.13 118.68 135.96 2jvc s LEU 74 Ca 0.12 -0.72 0.03 0.00 -0.22 0.00 0.00 54.13 53.33 2jvc s LEU 74 Cb -0.16 -1.73 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 2jvc s LEU 74 CO 0.10 -0.12 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.22 2jvc s VAL 75 N 1.40 3.42 -0.02 1.68 1.01 -0.61 -1.49 120.40 125.79 2jvc s VAL 75 Ca 0.02 -0.66 0.06 0.00 0.00 0.00 0.00 61.98 61.40 2jvc s VAL 75 Cb -0.16 -2.40 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 2jvc s VAL 75 CO -0.03 0.54 -0.20 -0.76 0.00 0.00 0.00 175.10 174.65 2jvc s LEU 76 N -0.94 2.02 -0.71 3.92 1.43 -1.26 -0.25 118.68 122.88 2jvc s LEU 76 Ca 0.13 -0.38 -0.00 0.00 -1.03 0.00 0.00 54.13 52.85 2jvc s LEU 76 Cb -0.11 -1.06 0.39 0.00 0.03 0.00 0.00 46.19 45.44 2jvc s LEU 76 CO 0.03 0.23 1.82 0.54 0.23 0.00 0.00 176.35 179.20 2jvc n ARG 77 N 2.70 2.91 -0.15 1.70 3.00 -0.83 -4.73 116.66 121.25 2jvc n ARG 77 Ca -0.16 -3.69 -0.07 0.00 -0.01 0.00 0.00 57.85 53.92 2jvc n ARG 77 Cb 0.53 -2.27 0.02 0.00 0.00 0.00 0.00 32.46 30.74 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 2.70 0.46 -0.96 0.55 4.07 -1.97 -3.47 115.31 116.70 2jvc h LEU 78 Ca 0.52 0.00 -0.42 0.00 0.08 0.00 0.00 57.88 58.05 2jvc h LEU 78 Cb 0.40 -0.10 0.08 0.00 1.08 0.00 0.00 40.66 42.12 2jvc h LEU 78 CO 1.33 0.33 -0.72 -1.14 -1.08 0.00 0.00 178.44 177.16 2jvc n ARG 79 N -4.81 -7.01 -1.75 1.13 0.63 -1.26 -4.18 116.66 99.41 2jvc n ARG 79 Ca 0.02 0.75 -0.00 0.00 -0.92 0.00 0.00 57.85 57.70 2jvc n ARG 79 Cb 0.06 -5.73 -0.00 0.00 0.45 0.00 0.00 32.46 27.23 2jvc n ARG 79 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2jvc n GLY 80 N -1.85 -3.18 0.00 5.14 0.00 -1.26 -5.11 105.19 98.93 2jvc n GLY 80 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 0.18 4.18 0.00 -0.02 0.00 -1.26 -5.27 105.19 103.00 2jvc n GLY 81 Ca -0.01 -0.40 0.04 0.00 0.00 0.00 0.00 46.02 45.64 2jvc n GLY 81 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70