#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cvl s ALA 3 N 0.00 2.99 -0.15 4.31 0.00 -1.26 -0.30 121.76 127.34 2cvl s ALA 3 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.55 2cvl s ALA 3 Cb 0.00 -3.23 -0.00 0.00 0.00 0.00 0.00 23.12 19.88 2cvl s ALA 3 CO 0.00 -0.17 -0.15 0.08 0.00 0.00 0.00 175.76 175.52 2cvl s VAL 4 N -1.90 2.67 -0.04 0.00 1.01 -0.35 -4.89 120.40 116.90 2cvl s VAL 4 Ca 0.62 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.85 2cvl s VAL 4 Cb -0.17 -2.12 0.02 0.00 0.00 0.00 0.00 36.38 34.11 2cvl s VAL 4 CO 0.21 0.52 -0.05 -0.75 0.00 0.00 0.00 175.10 175.03 2cvl s LYS 5 N 0.78 0.82 -0.07 2.72 2.20 -1.26 -3.77 119.74 121.17 2cvl s LYS 5 Ca -0.06 -0.13 -0.11 0.00 -0.36 0.00 0.00 55.97 55.32 2cvl s LYS 5 Cb -0.15 -0.81 0.02 0.00 -1.51 0.00 0.00 37.83 35.38 2cvl s LYS 5 CO 0.00 -0.05 0.27 -0.08 -0.36 0.00 0.00 175.35 175.13 2cvl s THR 6 N 0.77 0.03 -2.36 3.43 -1.32 -1.26 -5.02 115.64 109.90 2cvl s THR 6 Ca -0.11 -0.22 0.23 0.00 -1.21 0.00 0.00 61.69 60.38 2cvl s THR 6 Cb -0.13 -0.46 0.47 0.00 -1.51 0.00 0.00 72.50 70.86 2cvl s THR 6 CO 0.00 -0.12 1.57 -0.90 -2.21 0.00 0.00 174.62 172.96 2cvl n ASP 7 N 2.30 1.81 -0.22 8.08 3.85 -1.26 -3.72 116.55 127.39 2cvl n ASP 7 Ca -0.16 -1.70 0.14 0.00 -0.71 0.00 0.00 54.79 52.36 2cvl n ASP 7 Cb 0.57 -0.09 0.56 0.00 -1.35 0.00 0.00 41.12 40.81 2cvl n ASP 7 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 2cvl n ARG 8 N 0.42 0.99 -4.16 0.11 1.74 -1.26 -4.80 116.66 109.70 2cvl n ARG 8 Ca 0.17 -0.45 -0.13 0.00 -0.77 0.00 0.00 57.85 56.66 2cvl n ARG 8 Cb 0.37 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 30.21 2cvl n ARG 8 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2cvl s ALA 9 N -2.32 1.01 0.41 7.54 0.00 -1.24 -4.73 121.76 122.42 2cvl s ALA 9 Ca 0.32 -1.16 -0.26 0.00 0.00 0.00 0.00 51.96 50.86 2cvl s ALA 9 Cb 0.20 0.05 -0.10 0.00 0.00 0.00 0.00 23.12 23.28 2cvl s ALA 9 CO 0.44 -0.07 1.31 -0.35 0.00 0.00 0.00 175.76 177.09 2cvl n PRO 10 N 0.58 2.04 -1.56 0.00 -0.04 -1.26 -4.76 135.00 130.01 2cvl n PRO 10 Ca -0.16 0.72 -0.33 0.00 -0.04 0.00 0.00 63.50 63.69 2cvl n PRO 10 Cb 0.58 -2.42 0.07 0.00 -0.04 0.00 0.00 33.50 31.69 2cvl n PRO 10 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cvl s ALA 11 N -1.18 2.28 0.23 0.55 0.00 -1.26 -4.92 121.76 117.46 2cvl s ALA 11 Ca 0.60 0.66 -0.31 0.00 0.00 0.00 0.00 51.96 52.90 2cvl s ALA 11 Cb -0.51 -3.38 -0.12 0.00 0.00 0.00 0.00 23.12 19.12 2cvl s ALA 11 CO 0.59 -1.60 1.66 0.00 0.00 0.00 0.00 175.76 176.42 2cvl s ALA 12 N -2.24 3.86 -0.59 0.00 0.00 -1.26 -4.90 121.76 116.63 2cvl s ALA 12 Ca 0.69 1.56 0.00 0.00 0.00 0.00 0.00 51.96 54.21 2cvl s ALA 12 Cb -0.24 -3.67 0.52 0.00 0.00 0.00 0.00 23.12 19.73 2cvl s ALA 12 CO 0.44 -0.92 1.98 0.44 0.00 0.00 0.00 175.76 177.70 2cvl n ILE 13 N 3.41 3.47 -0.93 0.00 -5.35 -1.26 -4.96 119.36 113.75 2cvl n ILE 13 Ca 0.13 -2.62 0.00 0.00 -0.27 0.00 0.00 62.75 59.99 2cvl n ILE 13 Cb 0.36 -0.92 0.00 0.00 -1.74 0.00 0.00 39.64 37.34 2cvl n ILE 13 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2cvl n GLY 14 N -0.99 -1.19 2.96 3.28 0.00 -1.26 -5.04 105.19 102.94 2cvl n GLY 14 Ca 0.61 -0.96 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 2cvl n GLY 14 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cvl n PRO 15 N -0.03 2.12 -3.50 1.61 -0.04 -1.26 -4.81 135.00 129.09 2cvl n PRO 15 Ca 0.00 -2.21 -0.12 0.00 -0.04 0.00 0.00 63.50 61.12 2cvl n PRO 15 Cb 0.00 -3.11 -0.03 0.00 -0.04 0.00 0.00 33.50 30.32 2cvl n PRO 15 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2cvl s TYR 16 N 4.32 -0.46 0.14 0.54 -0.85 -1.26 -5.17 117.35 114.62 2cvl s TYR 16 Ca 0.53 0.31 -0.00 0.00 -0.52 0.00 0.00 57.07 57.39 2cvl s TYR 16 Cb 0.14 0.45 -0.04 0.00 0.38 0.00 0.00 41.96 42.89 2cvl s TYR 16 CO 0.03 -0.77 0.31 0.00 -1.52 0.00 0.00 175.55 173.59 2cvl s ALA 17 N -3.40 3.92 0.25 9.51 0.00 -1.26 -4.74 121.76 126.04 2cvl s ALA 17 Ca -0.00 -0.86 -0.04 0.00 0.00 0.00 0.00 51.96 51.06 2cvl s ALA 17 Cb -0.00 -1.90 0.37 0.00 0.00 0.00 0.00 23.12 21.59 2cvl s ALA 17 CO -0.10 0.60 1.87 1.96 0.00 0.00 0.00 175.76 180.10 2cvl h GLN 18 N 2.43 1.07 -2.93 0.00 4.20 -1.95 -3.40 115.11 114.54 2cvl h GLN 18 Ca -0.47 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.16 2cvl h GLN 18 Cb 1.18 -0.24 -0.12 0.00 0.30 0.00 0.00 27.48 28.59 2cvl h GLN 18 CO 0.71 0.71 0.22 0.00 -0.67 0.00 0.00 178.83 179.80 2cvl s ALA 19 N -6.05 -1.62 -0.04 3.87 0.00 -1.25 -1.03 121.76 115.65 2cvl s ALA 19 Ca -0.13 0.55 0.01 0.00 0.00 0.00 0.00 51.96 52.40 2cvl s ALA 19 Cb 0.19 0.83 0.02 0.00 0.00 0.00 0.00 23.12 24.16 2cvl s ALA 19 CO 0.80 -0.75 -0.05 0.08 0.00 0.00 0.00 175.76 175.84 2cvl s VAL 20 N -3.61 0.56 -0.22 0.00 1.01 0.29 -1.21 120.40 117.23 2cvl s VAL 20 Ca 0.01 -0.16 -0.11 0.00 0.00 0.00 0.00 61.98 61.71 2cvl s VAL 20 Cb -0.01 -0.56 -0.05 0.00 0.00 0.00 0.00 36.38 35.76 2cvl s VAL 20 CO -0.12 0.22 0.18 -0.54 0.00 0.00 0.00 175.10 174.84 2cvl s LYS 21 N 0.73 4.13 -0.25 2.72 1.02 0.59 -0.22 119.74 128.45 2cvl s LYS 21 Ca -0.10 -0.19 -0.26 0.00 0.02 0.00 0.00 55.97 55.44 2cvl s LYS 21 Cb -0.13 -3.50 0.12 0.00 -0.52 0.00 0.00 37.83 33.80 2cvl s LYS 21 CO 0.00 0.13 0.98 0.00 -0.92 0.00 0.00 175.35 175.55 2cvl s ALA 22 N 0.85 -1.94 -1.76 5.17 0.00 -0.15 -2.69 121.76 121.23 2cvl s ALA 22 Ca 0.09 1.81 0.00 0.00 0.00 0.00 0.00 51.96 53.86 2cvl s ALA 22 Cb -0.13 -1.20 0.00 0.00 0.00 0.00 0.00 23.12 21.79 2cvl s ALA 22 CO 0.03 -0.27 0.00 0.41 0.00 0.00 0.00 175.76 175.93 2cvl n GLY 23 N 1.89 0.58 1.26 0.00 0.00 -1.26 -1.56 105.19 106.11 2cvl n GLY 23 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2cvl n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cvl n GLY 24 N -0.66 0.73 3.49 -0.02 0.00 -1.26 -5.05 105.19 102.42 2cvl n GLY 24 Ca -0.20 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 2cvl n GLY 24 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2cvl s PHE 25 N -2.75 2.17 -0.16 1.61 0.40 -0.60 -0.68 117.98 117.97 2cvl s PHE 25 Ca 0.00 -0.68 0.01 0.00 -0.60 0.00 0.00 56.93 55.66 2cvl s PHE 25 Cb 0.00 -1.32 0.02 0.00 0.51 0.00 0.00 43.02 42.23 2cvl s PHE 25 CO 0.00 0.35 -0.16 0.08 0.70 0.00 0.00 175.22 176.18 2cvl s VAL 26 N -2.90 1.77 -0.35 -0.44 1.01 0.78 -0.98 120.40 119.29 2cvl s VAL 26 Ca 0.32 -0.76 -0.13 0.00 0.00 0.00 0.00 61.98 61.42 2cvl s VAL 26 Cb 0.05 -1.63 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 2cvl s VAL 26 CO 0.15 0.49 0.24 -0.36 0.00 0.00 0.00 175.10 175.61 2cvl s PHE 27 N 1.41 3.22 -0.19 5.22 0.08 0.69 -1.34 117.98 127.07 2cvl s PHE 27 Ca 0.05 -0.35 -0.08 0.00 0.12 0.00 0.00 56.93 56.66 2cvl s PHE 27 Cb -0.13 -2.48 -0.04 0.00 -0.57 0.00 0.00 43.02 39.80 2cvl s PHE 27 CO -0.12 -0.42 0.09 0.08 -0.10 0.00 0.00 175.22 174.75 2cvl s VAL 28 N 1.69 5.00 0.88 -0.44 1.01 -0.14 -0.54 120.40 127.86 2cvl s VAL 28 Ca 0.06 0.04 -0.10 0.00 0.00 0.00 0.00 61.98 61.97 2cvl s VAL 28 Cb -0.18 -3.27 0.13 0.00 0.00 0.00 0.00 36.38 33.06 2cvl s VAL 28 CO 0.10 0.45 1.14 -0.44 0.00 0.00 0.00 175.10 176.35 2cvl s SER 29 N 0.42 3.22 -0.03 3.32 0.01 -0.20 -2.49 113.70 117.96 2cvl s SER 29 Ca 0.05 2.15 -0.30 0.00 1.31 0.00 0.00 55.95 59.16 2cvl s SER 29 Cb -0.12 -2.56 -0.07 0.00 0.21 0.00 0.00 66.02 63.48 2cvl s SER 29 CO -0.00 -2.90 1.89 -0.83 0.41 0.00 0.00 173.24 171.81 2cvl s GLY 30 N -2.75 1.35 0.06 3.44 0.00 -1.26 -4.45 107.32 103.71 2cvl s GLY 30 Ca 0.66 1.10 -0.17 0.00 0.00 0.00 0.00 44.72 46.31 2cvl s GLY 30 CO 0.57 3.37 0.51 1.20 0.00 0.00 0.00 173.10 178.75 2cvl s GLN 31 N 4.58 4.08 0.35 2.90 -1.52 0.51 -4.78 119.66 125.78 2cvl s GLN 31 Ca 0.85 0.60 0.07 0.00 -1.95 0.00 0.00 55.36 54.93 2cvl s GLN 31 Cb -0.38 -3.20 -0.07 0.00 -0.22 0.00 0.00 33.01 29.14 2cvl s GLN 31 CO 0.37 0.64 -0.03 0.96 -0.25 0.00 0.00 175.29 176.98 2cvl s ILE 32 N -1.13 1.85 -0.74 1.08 -4.36 -1.26 -1.58 121.20 115.06 2cvl s ILE 32 Ca 0.28 -2.09 -0.13 0.00 -0.26 0.00 0.00 60.65 58.45 2cvl s ILE 32 Cb -0.18 -2.74 -0.11 0.00 1.25 0.00 0.00 42.46 40.68 2cvl s ILE 32 CO 0.17 -0.12 1.92 -0.81 0.24 0.00 0.00 174.94 176.33 2cvl n PRO 33 N -0.79 1.57 -4.88 0.37 -0.04 -1.26 -4.53 135.00 125.45 2cvl n PRO 33 Ca -0.05 -1.52 -0.33 0.00 -0.04 0.00 0.00 63.50 61.57 2cvl n PRO 33 Cb 0.65 -2.61 -0.13 0.00 -0.04 0.00 0.00 33.50 31.37 2cvl n PRO 33 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2cvl s LEU 34 N 0.53 2.74 0.71 1.53 1.43 -1.26 -0.61 118.68 123.74 2cvl s LEU 34 Ca 0.45 -0.20 -0.11 0.00 -1.03 0.00 0.00 54.13 53.24 2cvl s LEU 34 Cb 0.11 -1.56 0.01 0.00 0.03 0.00 0.00 46.19 44.79 2cvl s LEU 34 CO 0.05 0.34 1.09 0.00 0.23 0.00 0.00 176.35 178.06 2cvl s ALA 35 N -0.74 2.85 0.43 4.21 0.00 0.70 -4.55 121.76 124.65 2cvl s ALA 35 Ca 0.12 -0.29 0.21 0.00 0.00 0.00 0.00 51.96 52.00 2cvl s ALA 35 Cb -0.11 -3.04 1.16 0.00 0.00 0.00 0.00 23.12 21.13 2cvl s ALA 35 CO 0.01 -1.15 1.82 -1.35 0.00 0.00 0.00 175.76 175.08 2cvl h PRO 36 N -0.66 0.32 0.00 0.00 0.11 -1.85 0.30 132.00 130.22 2cvl h PRO 36 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2cvl h PRO 36 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2cvl h PRO 36 CO 0.63 0.21 0.00 -0.40 -0.21 0.00 0.00 178.00 178.23 2cvl n ASP 37 N -4.51 0.00 0.00 -2.05 3.85 -1.26 -4.14 116.55 108.44 2cvl n ASP 37 Ca 0.22 -1.22 0.00 0.00 -0.71 0.00 0.00 54.79 53.09 2cvl n ASP 37 Cb 0.85 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.62 2cvl n ASP 37 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2cvl n GLY 38 N 0.69 0.96 3.77 6.12 0.00 0.11 -5.02 105.19 111.82 2cvl n GLY 38 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 2cvl n GLY 38 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cvl s SER 39 N -3.00 7.18 0.29 1.61 1.04 -1.25 -4.72 113.70 114.85 2cvl s SER 39 Ca 0.00 1.99 -0.29 0.00 0.48 0.00 0.00 55.95 58.13 2cvl s SER 39 Cb 0.00 -2.59 -0.10 0.00 0.10 0.00 0.00 66.02 63.43 2cvl s SER 39 CO 0.00 -0.18 1.12 -0.22 0.98 0.00 0.00 173.24 174.94 2cvl s LEU 40 N -2.01 4.53 -0.46 2.42 1.98 -1.26 -0.22 118.68 123.67 2cvl s LEU 40 Ca 0.50 2.31 -0.10 0.00 -2.89 0.00 0.00 54.13 53.95 2cvl s LEU 40 Cb -0.23 -3.64 0.10 0.00 0.66 0.00 0.00 46.19 43.08 2cvl s LEU 40 CO 0.29 -0.19 0.33 -0.69 -1.89 0.00 0.00 176.35 174.20 2cvl s VAL 41 N -1.17 4.36 0.61 1.68 1.01 0.22 -4.86 120.40 122.26 2cvl s VAL 41 Ca 0.45 -1.57 -0.05 0.00 0.00 0.00 0.00 61.98 60.81 2cvl s VAL 41 Cb -0.33 -3.78 0.02 0.00 0.00 0.00 0.00 36.38 32.30 2cvl s VAL 41 CO 0.42 -0.67 0.91 -1.61 0.00 0.00 0.00 175.10 174.15 2cvl s GLU 42 N 1.42 2.71 0.00 2.72 0.41 -1.26 -4.72 118.70 119.98 2cvl s GLU 42 Ca 0.04 -0.15 0.00 0.00 -0.41 0.00 0.00 54.97 54.46 2cvl s GLU 42 Cb -0.25 -2.27 0.00 0.00 -1.78 0.00 0.00 34.13 29.82 2cvl s GLU 42 CO 0.01 -0.82 0.00 0.41 -0.49 0.00 0.00 175.26 174.37 2cvl n GLY 43 N -2.63 0.79 3.69 -1.39 0.00 -1.26 -4.78 105.19 99.61 2cvl n GLY 43 Ca 0.05 -2.05 -0.30 0.00 0.00 0.00 0.00 46.02 43.72 2cvl n GLY 43 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2cvl s ASP 44 N -3.09 1.22 0.38 1.61 1.47 -1.26 -4.71 116.67 112.29 2cvl s ASP 44 Ca 0.00 0.39 0.06 0.00 1.18 0.00 0.00 52.55 54.18 2cvl s ASP 44 Cb 0.00 -0.46 0.74 0.00 -0.34 0.00 0.00 42.92 42.86 2cvl s ASP 44 CO 0.00 -3.91 1.98 -0.29 0.68 0.00 0.00 175.17 173.63 2cvl h ILE 45 N -2.44 1.15 -0.49 2.11 6.09 -1.96 -1.63 117.51 120.33 2cvl h ILE 45 Ca -0.43 -0.45 -0.11 0.00 -1.37 0.00 0.00 64.86 62.50 2cvl h ILE 45 Cb 1.26 0.68 -0.02 0.00 0.47 0.00 0.00 36.82 39.22 2cvl h ILE 45 CO 0.29 0.17 -0.13 0.03 -3.07 0.00 0.00 178.15 175.45 2cvl h ARG 46 N 0.54 0.96 -0.23 2.19 3.08 -1.92 0.93 114.38 119.92 2cvl h ARG 46 Ca 0.13 -0.37 -0.07 0.00 0.07 0.00 0.00 59.98 59.75 2cvl h ARG 46 Cb 0.10 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 2cvl h ARG 46 CO -0.01 1.04 -0.11 0.28 -1.07 0.00 0.00 179.97 180.09 2cvl h VAL 47 N 0.82 1.30 -0.17 2.04 2.07 -1.83 -2.18 116.25 118.30 2cvl h VAL 47 Ca 0.12 -1.19 -0.13 0.00 0.82 0.00 0.00 66.70 66.33 2cvl h VAL 47 Cb 0.69 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 2cvl h VAL 47 CO 0.05 0.37 -0.46 1.56 0.02 0.00 0.00 177.57 179.11 2cvl h GLN 48 N 0.20 0.43 -0.29 1.57 4.20 -1.27 -2.89 115.11 117.07 2cvl h GLN 48 Ca 0.05 -0.23 -0.13 0.00 0.06 0.00 0.00 58.65 58.40 2cvl h GLN 48 Cb 0.61 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 2cvl h GLN 48 CO 0.03 0.81 -0.35 1.15 -0.67 0.00 0.00 178.83 179.80 2cvl h THR 49 N 0.35 1.29 -0.77 -0.54 2.02 -0.79 -2.08 112.91 112.38 2cvl h THR 49 Ca 0.02 -1.48 0.00 0.00 0.77 0.00 0.00 66.41 65.72 2cvl h THR 49 Cb 0.94 1.44 -0.04 0.00 -1.74 0.00 0.00 68.15 68.76 2cvl h THR 49 CO 0.08 0.48 0.50 -0.08 0.37 0.00 0.00 175.52 176.86 2cvl h GLU 50 N 0.53 1.03 -0.66 6.66 4.81 -1.27 -2.17 114.58 123.52 2cvl h GLU 50 Ca 0.06 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2cvl h GLU 50 Cb 0.85 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.97 2cvl h GLU 50 CO 0.07 0.70 0.31 -0.09 -0.73 0.00 0.00 179.01 179.27 2cvl h ARG 51 N 1.05 0.95 -1.09 1.92 9.65 -1.29 -1.01 114.38 124.57 2cvl h ARG 51 Ca 0.28 -0.14 0.00 0.00 -1.10 0.00 0.00 59.98 59.02 2cvl h ARG 51 Cb -0.09 -0.17 0.00 0.00 -1.39 0.00 0.00 29.97 28.32 2cvl h ARG 51 CO -0.06 0.76 0.00 0.28 2.80 0.00 0.00 179.97 183.75 2cvl n VAL 52 N -4.47 0.09 0.00 0.20 0.31 -0.81 -1.62 118.33 112.04 2cvl n VAL 52 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 2cvl n VAL 52 Cb 0.13 -0.36 0.00 0.00 -0.91 0.00 0.00 33.84 32.70 2cvl n VAL 52 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2cvl n GLU 54 N 0.69 0.00 -0.09 5.55 -0.58 -0.38 -1.00 120.64 124.82 2cvl n GLU 54 Ca 0.00 0.00 -0.11 0.00 -0.42 0.00 0.00 57.16 56.63 2cvl n GLU 54 Cb 0.07 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 30.90 2cvl n GLU 54 CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 2cvl h ASN 55 N 0.00 0.49 -0.15 1.62 2.35 -1.56 -0.81 115.58 117.52 2cvl h ASN 55 Ca 0.00 -0.33 0.02 0.00 -0.55 0.00 0.00 56.30 55.44 2cvl h ASN 55 Cb 0.00 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 2cvl h ASN 55 CO 0.00 0.70 0.02 -0.07 -1.65 0.00 0.00 177.43 176.43 2cvl h LEU 56 N 0.27 -0.01 -0.49 1.61 3.38 -1.34 -1.10 115.31 117.62 2cvl h LEU 56 Ca 0.08 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.12 2cvl h LEU 56 Cb 0.46 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 2cvl h LEU 56 CO 0.02 0.02 0.23 0.50 0.09 0.00 0.00 178.44 179.29 2cvl h LYS 57 N 0.08 0.43 -0.51 1.13 3.64 -1.79 -0.23 116.57 119.31 2cvl h LYS 57 Ca 0.07 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.39 2cvl h LYS 57 Cb 0.06 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 2cvl h LYS 57 CO -0.10 0.29 0.21 0.00 -2.27 0.00 0.00 179.45 177.58 2cvl h ALA 58 N 1.29 0.67 -0.46 5.00 0.00 -0.81 -0.88 119.26 124.06 2cvl h ALA 58 Ca 0.22 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2cvl h ALA 58 Cb 0.17 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2cvl h ALA 58 CO -0.18 0.27 0.02 0.28 0.00 0.00 0.00 179.25 179.64 2cvl h VAL 59 N 0.69 1.26 -0.50 0.00 2.07 -0.89 -1.77 116.25 117.11 2cvl h VAL 59 Ca 0.17 -1.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 2cvl h VAL 59 Cb 0.19 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 2cvl h VAL 59 CO -0.02 0.35 0.24 -0.07 0.02 0.00 0.00 177.57 178.10 2cvl h LEU 60 N 0.64 0.65 -0.83 2.57 3.38 -0.88 -1.76 115.31 119.07 2cvl h LEU 60 Ca 0.13 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2cvl h LEU 60 Cb 0.46 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 2cvl h LEU 60 CO 0.02 0.59 0.37 -0.33 0.09 0.00 0.00 178.44 179.17 2cvl h GLU 61 N 0.66 1.22 0.00 1.13 5.08 -1.05 0.15 114.58 121.77 2cvl h GLU 61 Ca 0.17 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 2cvl h GLU 61 Cb 0.11 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2cvl h GLU 61 CO -0.02 0.96 -0.19 0.00 -1.00 0.00 0.00 179.01 178.76 2cvl h ALA 62 N 1.20 1.44 -0.01 3.43 0.00 -0.98 -1.22 119.26 123.11 2cvl h ALA 62 Ca 0.28 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2cvl h ALA 62 Cb 0.17 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2cvl h ALA 62 CO -0.03 0.23 -0.04 0.00 0.00 0.00 0.00 179.25 179.42 2cvl n ALA 63 N -2.39 2.68 -0.67 0.00 0.00 -0.69 -4.88 120.51 114.55 2cvl n ALA 63 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2cvl n ALA 63 Cb 0.27 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2cvl n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cvl n GLY 64 N 1.15 0.65 0.00 0.00 0.00 -0.46 -5.03 105.19 101.49 2cvl n GLY 64 Ca 0.19 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2cvl n GLY 64 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2cvl n SER 65 N 0.28 0.53 -3.62 1.61 2.88 0.44 -4.77 113.62 110.98 2cvl n SER 65 Ca 0.00 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.55 2cvl n SER 65 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 2cvl n SER 65 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2cvl s GLY 66 N -0.14 -0.39 0.38 0.46 0.00 -1.25 -3.73 107.32 102.65 2cvl s GLY 66 Ca 0.00 0.78 0.08 0.00 0.00 0.00 0.00 44.72 45.59 2cvl s GLY 66 CO 0.00 0.17 1.96 1.41 0.00 0.00 0.00 173.10 176.63 2cvl h LEU 67 N 2.00 0.58 -0.08 0.66 3.38 -1.92 -1.01 115.31 118.92 2cvl h LEU 67 Ca -0.27 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2cvl h LEU 67 Cb 1.20 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2cvl h LEU 67 CO 0.28 0.36 0.00 -1.54 0.09 0.00 0.00 178.44 177.63 2cvl n SER 68 N -4.49 0.09 -0.61 -0.43 3.41 -1.26 -2.21 113.62 108.12 2cvl n SER 68 Ca 0.11 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.36 2cvl n SER 68 Cb 0.29 -0.54 0.12 0.00 -0.26 0.00 0.00 64.21 63.82 2cvl n SER 68 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2cvl n ARG 69 N -1.60 1.57 -2.28 4.33 5.12 -0.39 -4.93 116.66 118.48 2cvl n ARG 69 Ca 0.04 -1.23 -0.42 0.00 -1.93 0.00 0.00 57.85 54.30 2cvl n ARG 69 Cb 0.20 -1.47 -0.03 0.00 -1.16 0.00 0.00 32.46 30.00 2cvl n ARG 69 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2cvl s VAL 70 N -2.29 3.71 -0.23 1.55 1.01 -0.94 -0.88 120.40 122.34 2cvl s VAL 70 Ca 0.24 1.19 0.12 0.00 0.00 0.00 0.00 61.98 63.53 2cvl s VAL 70 Cb 0.19 -3.76 -0.17 0.00 0.00 0.00 0.00 36.38 32.64 2cvl s VAL 70 CO 0.46 0.06 0.36 1.33 0.00 0.00 0.00 175.10 177.32 2cvl n VAL 71 N 4.16 0.00 -3.68 2.92 0.24 -0.27 -4.32 118.33 117.38 2cvl n VAL 71 Ca 0.11 -0.26 -0.12 0.00 -2.04 0.00 0.00 64.34 62.03 2cvl n VAL 71 Cb 0.44 0.52 -0.09 0.00 -1.47 0.00 0.00 33.84 33.24 2cvl n VAL 71 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2cvl s GLN 72 N -2.58 0.60 0.07 7.34 0.74 -0.99 -0.76 119.66 124.08 2cvl s GLN 72 Ca -0.01 0.85 0.07 0.00 0.05 0.00 0.00 55.36 56.32 2cvl s GLN 72 Cb 0.08 0.21 -0.03 0.00 1.10 0.00 0.00 33.01 34.38 2cvl s GLN 72 CO 0.51 -0.11 -0.18 0.95 -0.55 0.00 0.00 175.29 175.91 2cvl s THR 73 N 0.76 1.48 -0.26 -0.34 -4.23 -0.43 -0.77 115.64 111.86 2cvl s THR 73 Ca -0.04 -1.34 0.02 0.00 -1.18 0.00 0.00 61.69 59.16 2cvl s THR 73 Cb -0.05 -1.35 0.06 0.00 1.34 0.00 0.00 72.50 72.51 2cvl s THR 73 CO -0.06 -0.03 -0.07 -0.89 -0.54 0.00 0.00 174.62 173.04 2cvl s THR 74 N -1.06 1.86 -0.14 3.99 2.01 -0.25 -2.51 115.64 119.54 2cvl s THR 74 Ca 0.04 -1.50 -0.02 0.00 0.31 0.00 0.00 61.69 60.52 2cvl s THR 74 Cb -0.09 -2.08 -0.02 0.00 0.01 0.00 0.00 72.50 70.31 2cvl s THR 74 CO 0.03 -0.12 -0.08 0.00 -0.69 0.00 0.00 174.62 173.76 2cvl s PHE 76 N 0.29 2.11 0.04 0.00 0.40 0.01 -1.25 117.98 119.58 2cvl s PHE 76 Ca -0.06 -0.67 0.06 0.00 -0.60 0.00 0.00 56.93 55.66 2cvl s PHE 76 Cb -0.15 -1.41 -0.02 0.00 0.51 0.00 0.00 43.02 41.95 2cvl s PHE 76 CO 0.04 -0.23 -0.18 -0.51 0.70 0.00 0.00 175.22 175.04 2cvl s LEU 77 N 0.04 2.17 0.35 -0.37 1.02 -0.62 -1.17 118.68 120.09 2cvl s LEU 77 Ca -0.07 -0.49 0.24 0.00 0.02 0.00 0.00 54.13 53.84 2cvl s LEU 77 Cb -0.14 -0.81 0.51 0.00 0.02 0.00 0.00 46.19 45.77 2cvl s LEU 77 CO 0.04 0.11 1.66 0.00 0.02 0.00 0.00 176.35 178.17 2cvl h ALA 78 N 4.91 0.99 -3.04 4.21 0.00 -1.55 0.31 119.26 125.08 2cvl h ALA 78 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2cvl h ALA 78 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2cvl h ALA 78 CO 0.44 0.00 0.00 -3.47 0.00 0.00 0.00 179.25 176.22 2cvl n ASP 79 N -2.77 0.37 0.00 0.00 -0.08 -1.26 -4.59 116.55 108.21 2cvl n ASP 79 Ca 0.05 -0.25 0.00 0.00 -1.51 0.00 0.00 54.79 53.08 2cvl n ASP 79 Cb 0.49 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.95 2cvl n ASP 79 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2cvl n GLU 81 N 0.00 0.00 0.00 -0.67 -0.58 -1.26 -4.09 120.64 114.04 2cvl n GLU 81 Ca 0.00 0.00 0.14 0.00 -0.42 0.00 0.00 57.16 56.88 2cvl n GLU 81 Cb 0.00 0.00 0.59 0.00 -0.57 0.00 0.00 31.44 31.46 2cvl n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2cvl n ASP 82 N 0.00 0.73 -0.18 1.62 8.00 -1.26 -4.35 116.55 121.11 2cvl n ASP 82 Ca 0.00 -0.88 -0.02 0.00 0.71 0.00 0.00 54.79 54.60 2cvl n ASP 82 Cb 0.00 -0.01 0.08 0.00 -0.02 0.00 0.00 41.12 41.17 2cvl n ASP 82 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 2cvl h PHE 83 N 0.99 0.40 -0.14 1.24 -1.00 -2.00 -1.55 116.94 114.88 2cvl h PHE 83 Ca 0.00 0.03 0.02 0.00 2.81 0.00 0.00 57.97 60.82 2cvl h PHE 83 Cb 0.37 -0.10 -0.02 0.00 3.61 0.00 0.00 35.95 39.82 2cvl h PHE 83 CO 0.00 0.14 0.02 -1.35 -1.61 0.00 0.00 178.31 175.51 2cvl h PRO 84 N 0.42 0.08 -0.67 1.51 0.11 -1.97 -0.24 132.00 131.25 2cvl h PRO 84 Ca 0.26 -0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.30 2cvl h PRO 84 Cb 0.27 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.33 2cvl h PRO 84 CO -0.24 0.05 0.16 0.78 -0.21 0.00 0.00 178.00 178.53 2cvl h GLY 85 N 0.08 1.14 0.99 -0.55 0.00 -1.83 -1.77 103.07 101.13 2cvl h GLY 85 Ca 0.06 -0.71 0.00 0.00 0.00 0.00 0.00 47.33 46.69 2cvl h GLY 85 CO -0.08 0.66 0.01 -2.75 0.00 0.00 0.00 176.54 174.38 2cvl h PHE 86 N 1.01 0.03 -0.93 5.60 3.04 -1.01 -2.50 116.94 122.17 2cvl h PHE 86 Ca 0.21 0.00 0.03 0.00 3.98 0.00 0.00 57.97 62.19 2cvl h PHE 86 Cb 0.36 -0.01 -0.05 0.00 2.56 0.00 0.00 35.95 38.81 2cvl h PHE 86 CO 0.03 0.03 0.61 -0.91 -2.02 0.00 0.00 178.31 176.04 2cvl h ASN 87 N 0.02 1.01 0.19 0.41 -0.26 -0.82 0.34 115.58 116.47 2cvl h ASN 87 Ca 0.01 -0.01 -0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2cvl h ASN 87 Cb 0.01 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 37.03 2cvl h ASN 87 CO -0.00 0.70 -0.13 -0.08 -1.06 0.00 0.00 177.43 176.86 2cvl h GLU 88 N 1.18 -0.31 -0.58 0.81 4.81 -1.04 -0.68 114.58 118.77 2cvl h GLU 88 Ca 0.37 0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.52 2cvl h GLU 88 Cb -0.01 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2cvl h GLU 88 CO -0.12 -0.20 -0.04 0.28 -0.73 0.00 0.00 179.01 178.20 2cvl h VAL 89 N -0.32 1.26 -0.83 0.32 2.07 -1.24 -2.62 116.25 114.89 2cvl h VAL 89 Ca -0.01 -1.18 0.10 0.00 0.82 0.00 0.00 66.70 66.42 2cvl h VAL 89 Cb 0.28 0.85 -0.07 0.00 -1.52 0.00 0.00 31.29 30.83 2cvl h VAL 89 CO 0.00 0.42 0.47 0.22 0.02 0.00 0.00 177.57 178.71 2cvl h TYR 90 N 0.94 0.85 0.00 1.57 3.20 -0.72 -0.22 116.97 122.59 2cvl h TYR 90 Ca 0.16 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.06 2cvl h TYR 90 Cb 0.59 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.60 2cvl h TYR 90 CO 0.04 0.34 0.00 0.00 -1.64 0.00 0.00 178.16 176.90 2cvl n ALA 91 N -2.38 1.58 0.12 1.82 0.00 -0.28 -1.56 120.51 119.81 2cvl n ALA 91 Ca 0.14 -0.04 0.09 0.00 0.00 0.00 0.00 53.44 53.62 2cvl n ALA 91 Cb 0.29 -1.20 0.03 0.00 0.00 0.00 0.00 19.45 18.57 2cvl n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cvl h ARG 92 N 0.00 0.00 0.00 0.00 3.08 -0.97 -3.38 114.38 113.10 2cvl h ARG 92 Ca 0.00 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.80 2cvl h ARG 92 Cb 0.21 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.21 2cvl h ARG 92 CO 0.00 0.10 -1.95 0.66 -1.07 0.00 0.00 179.97 177.70 2cvl n TYR 93 N -2.87 0.00 -4.17 3.04 4.02 -0.86 -4.94 117.16 111.37 2cvl n TYR 93 Ca -0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.54 2cvl n TYR 93 Cb 0.61 -0.68 -0.13 0.00 -0.02 0.00 0.00 39.34 39.12 2cvl n TYR 93 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 2cvl s PHE 94 N -2.34 3.01 0.20 -0.72 0.40 -0.60 -4.84 117.98 113.10 2cvl s PHE 94 Ca -0.09 -0.49 0.09 0.00 -0.60 0.00 0.00 56.93 55.84 2cvl s PHE 94 Cb 0.04 -2.04 -0.04 0.00 0.51 0.00 0.00 43.02 41.49 2cvl s PHE 94 CO 0.55 -0.23 -0.18 -0.08 0.70 0.00 0.00 175.22 175.97 2cvl s THR 95 N 0.87 2.00 0.26 0.64 -1.32 -1.26 -4.53 115.64 112.30 2cvl s THR 95 Ca -0.00 -2.10 -0.30 0.00 -1.21 0.00 0.00 61.69 58.07 2cvl s THR 95 Cb -0.14 -2.02 -0.13 0.00 -1.51 0.00 0.00 72.50 68.70 2cvl s THR 95 CO 0.02 -0.38 1.36 -2.65 -2.21 0.00 0.00 174.62 170.76 2cvl n PRO 96 N -0.06 2.01 -2.33 7.08 -0.02 -1.26 -3.43 135.00 137.00 2cvl n PRO 96 Ca -0.10 0.71 -0.42 0.00 -2.02 0.00 0.00 63.50 61.67 2cvl n PRO 96 Cb 0.58 -2.34 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 2cvl n PRO 96 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2cvl s PRO 97 N -0.78 4.34 0.61 0.52 0.04 -1.26 -5.15 135.00 133.33 2cvl s PRO 97 Ca 0.65 1.85 -0.14 0.00 0.04 0.00 0.00 61.00 63.40 2cvl s PRO 97 Cb -0.64 -3.48 -0.03 0.00 0.04 0.00 0.00 34.50 30.39 2cvl s PRO 97 CO 0.53 -0.45 1.04 0.71 0.04 0.00 0.00 177.00 178.87 2cvl s TYR 98 N 1.92 3.18 0.79 0.56 4.12 -1.22 -5.04 117.35 121.66 2cvl s TYR 98 Ca 0.60 1.45 -0.11 0.00 0.02 0.00 0.00 57.07 59.04 2cvl s TYR 98 Cb -0.30 -2.90 0.07 0.00 -1.52 0.00 0.00 41.96 37.31 2cvl s TYR 98 CO 0.26 -0.97 1.09 -2.14 0.02 0.00 0.00 175.55 173.81 2cvl s PRO 99 N -4.49 2.10 0.56 -1.71 0.02 -1.26 -4.99 135.00 125.22 2cvl s PRO 99 Ca 0.60 0.89 -0.17 0.00 0.02 0.00 0.00 61.00 62.34 2cvl s PRO 99 Cb -0.14 -1.90 -0.05 0.00 0.02 0.00 0.00 34.50 32.43 2cvl s PRO 99 CO 0.43 -1.68 1.06 0.00 -0.33 0.00 0.00 177.00 176.48 2cvl s ALA 100 N -3.01 2.77 -0.02 -1.55 0.00 0.06 -4.86 121.76 115.15 2cvl s ALA 100 Ca 0.61 0.48 -0.16 0.00 0.00 0.00 0.00 51.96 52.89 2cvl s ALA 100 Cb -0.16 -3.25 0.03 0.00 0.00 0.00 0.00 23.12 19.74 2cvl s ALA 100 CO 0.56 -0.67 0.34 0.50 0.00 0.00 0.00 175.76 176.48 2cvl s ARG 101 N -3.79 0.70 -0.11 0.00 3.52 -1.26 -1.31 118.95 116.69 2cvl s ARG 101 Ca 0.65 -0.16 -0.00 0.00 -0.13 0.00 0.00 55.73 56.09 2cvl s ARG 101 Cb -0.17 0.31 0.02 0.00 -1.56 0.00 0.00 34.95 33.56 2cvl s ARG 101 CO 0.32 -0.19 -0.08 0.00 -0.81 0.00 0.00 175.30 174.53 2cvl s ALA 102 N -1.31 1.33 -0.20 6.12 0.00 -1.04 -5.00 121.76 121.66 2cvl s ALA 102 Ca -0.13 -0.54 0.01 0.00 0.00 0.00 0.00 51.96 51.29 2cvl s ALA 102 Cb -0.05 -0.89 0.04 0.00 0.00 0.00 0.00 23.12 22.22 2cvl s ALA 102 CO 0.05 -0.38 -0.11 0.99 0.00 0.00 0.00 175.76 176.31 2cvl s THR 103 N 1.63 1.71 -0.00 0.00 2.01 -1.26 -0.37 115.64 119.36 2cvl s THR 103 Ca 0.04 -1.06 0.03 0.00 0.31 0.00 0.00 61.69 61.00 2cvl s THR 103 Cb -0.13 -1.77 -0.01 0.00 0.01 0.00 0.00 72.50 70.60 2cvl s THR 103 CO -0.07 0.17 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.24 2cvl s VAL 104 N 1.37 0.73 -0.07 3.82 1.01 -0.38 -5.02 120.40 121.86 2cvl s VAL 104 Ca -0.02 -0.45 -0.23 0.00 0.00 0.00 0.00 61.98 61.28 2cvl s VAL 104 Cb -0.16 -0.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 2cvl s VAL 104 CO -0.08 0.17 0.69 0.00 0.00 0.00 0.00 175.10 175.87 2cvl s ALA 105 N -0.29 3.34 0.46 5.51 0.00 -1.26 -1.60 121.76 127.92 2cvl s ALA 105 Ca 0.03 0.12 0.03 0.00 0.00 0.00 0.00 51.96 52.13 2cvl s ALA 105 Cb -0.04 -2.94 -0.02 0.00 0.00 0.00 0.00 23.12 20.12 2cvl s ALA 105 CO -0.00 -0.09 0.07 0.14 0.00 0.00 0.00 175.76 175.87 2cvl s VAL 106 N 0.77 0.89 -0.03 0.00 -7.23 0.11 -4.91 120.40 110.00 2cvl s VAL 106 Ca 0.37 -2.00 -0.26 0.00 -1.81 0.00 0.00 61.98 58.28 2cvl s VAL 106 Cb -0.18 -2.28 -0.21 0.00 0.56 0.00 0.00 36.38 34.28 2cvl s VAL 106 CO 0.18 0.00 1.22 0.50 -0.31 0.00 0.00 175.10 176.69 2cvl h LYS 107 N 1.58 0.02 -2.87 4.82 3.64 -1.86 -3.39 116.57 118.52 2cvl h LYS 107 Ca -0.39 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 58.89 2cvl h LYS 107 Cb 1.29 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 32.94 2cvl h LYS 107 CO 0.65 0.56 -0.08 0.00 -2.27 0.00 0.00 179.45 178.31 2cvl s ALA 108 N -4.05 -1.10 0.30 5.00 0.00 -1.26 -4.93 121.76 115.72 2cvl s ALA 108 Ca -0.16 0.48 0.08 0.00 0.00 0.00 0.00 51.96 52.35 2cvl s ALA 108 Cb 0.01 0.26 -0.06 0.00 0.00 0.00 0.00 23.12 23.33 2cvl s ALA 108 CO 0.68 -0.42 -0.07 -0.51 0.00 0.00 0.00 175.76 175.45 2cvl s LEU 109 N -1.77 2.57 0.37 0.00 1.43 -1.26 -5.03 118.68 114.98 2cvl s LEU 109 Ca -0.08 -1.20 -0.27 0.00 -1.03 0.00 0.00 54.13 51.56 2cvl s LEU 109 Cb -0.02 -0.77 -0.12 0.00 0.03 0.00 0.00 46.19 45.32 2cvl s LEU 109 CO 0.01 -0.30 1.24 -2.65 0.23 0.00 0.00 176.35 174.88 2cvl n PRO 110 N -0.66 1.97 -1.23 1.29 -0.02 -1.26 -1.14 135.00 133.94 2cvl n PRO 110 Ca -0.05 0.69 -0.08 0.00 -2.02 0.00 0.00 63.50 62.04 2cvl n PRO 110 Cb 0.63 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.79 2cvl n PRO 110 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2cvl n ARG 111 N 0.40 -1.80 -1.95 -0.52 5.12 -1.26 -2.64 116.66 114.00 2cvl n ARG 111 Ca 0.06 0.78 -0.17 0.00 -1.93 0.00 0.00 57.85 56.58 2cvl n ARG 111 Cb 0.37 -5.23 -0.04 0.00 -1.16 0.00 0.00 32.46 26.40 2cvl n ARG 111 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2cvl n GLY 112 N 0.48 0.57 3.73 -0.13 0.00 -0.30 -4.99 105.19 104.55 2cvl n GLY 112 Ca -0.08 -0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.47 2cvl n GLY 112 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2cvl s VAL 113 N -2.75 2.07 -0.24 1.61 -7.23 -1.08 -4.90 120.40 107.89 2cvl s VAL 113 Ca 0.00 0.02 0.19 0.00 -1.81 0.00 0.00 61.98 60.38 2cvl s VAL 113 Cb 0.00 -2.64 0.08 0.00 0.56 0.00 0.00 36.38 34.38 2cvl s VAL 113 CO 0.00 -0.03 1.29 0.03 -0.31 0.00 0.00 175.10 176.08 2cvl h ARG 114 N -1.69 0.00 -2.80 4.82 3.08 -1.94 -3.41 114.38 112.44 2cvl h ARG 114 Ca -0.52 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.41 2cvl h ARG 114 Cb 1.33 0.00 -0.22 0.00 0.08 0.00 0.00 29.97 31.16 2cvl h ARG 114 CO 0.60 0.24 -0.21 0.54 -1.07 0.00 0.00 179.97 180.07 2cvl s VAL 115 N -3.09 0.03 -0.03 2.04 0.11 -1.26 -1.80 120.40 116.40 2cvl s VAL 115 Ca 0.03 -0.22 0.00 0.00 -2.93 0.00 0.00 61.98 58.86 2cvl s VAL 115 Cb 0.07 -0.64 0.03 0.00 -1.53 0.00 0.00 36.38 34.31 2cvl s VAL 115 CO 0.75 -0.12 0.00 -0.70 -3.33 0.00 0.00 175.10 171.70 2cvl s GLU 116 N -0.66 0.32 -0.09 1.54 2.12 -0.32 -4.28 118.70 117.34 2cvl s GLU 116 Ca -0.08 0.07 -0.01 0.00 0.36 0.00 0.00 54.97 55.32 2cvl s GLU 116 Cb -0.04 -0.50 0.03 0.00 0.26 0.00 0.00 34.13 33.88 2cvl s GLU 116 CO 0.03 -0.14 -0.04 0.08 -0.54 0.00 0.00 175.26 174.66 2cvl s VAL 117 N 1.05 0.69 0.33 3.70 1.01 -0.61 -0.81 120.40 125.76 2cvl s VAL 117 Ca -0.09 -0.08 0.08 0.00 0.00 0.00 0.00 61.98 61.88 2cvl s VAL 117 Cb -0.14 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 2cvl s VAL 117 CO -0.02 0.31 0.19 0.00 0.00 0.00 0.00 175.10 175.58 2cvl s ALA 118 N 1.79 3.61 0.26 5.51 0.00 -0.58 -0.36 121.76 131.99 2cvl s ALA 118 Ca 0.04 -1.74 -0.21 0.00 0.00 0.00 0.00 51.96 50.05 2cvl s ALA 118 Cb -0.12 -0.91 0.02 0.00 0.00 0.00 0.00 23.12 22.11 2cvl s ALA 118 CO -0.06 0.05 0.69 0.00 0.00 0.00 0.00 175.76 176.44 2cvl s VAL 120 N -3.91 1.15 0.14 0.00 1.01 0.05 -0.97 120.40 117.88 2cvl s VAL 120 Ca 0.10 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.57 2cvl s VAL 120 Cb -0.05 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 2cvl s VAL 120 CO 0.05 0.35 -0.03 0.00 0.00 0.00 0.00 175.10 175.46 2cvl s ALA 121 N 0.30 1.22 0.24 5.51 0.00 -0.45 -1.11 121.76 127.47 2cvl s ALA 121 Ca -0.07 -1.49 -0.30 0.00 0.00 0.00 0.00 51.96 50.10 2cvl s ALA 121 Cb -0.12 0.35 -0.09 0.00 0.00 0.00 0.00 23.12 23.26 2cvl s ALA 121 CO 0.02 -0.27 1.01 -0.51 0.00 0.00 0.00 175.76 176.01 2cvl s LEU 122 N -3.12 4.59 0.42 0.00 1.43 -0.06 -0.16 118.68 121.79 2cvl s LEU 122 Ca 0.19 2.05 0.14 0.00 -1.03 0.00 0.00 54.13 55.48 2cvl s LEU 122 Cb 0.05 -3.61 0.90 0.00 0.03 0.00 0.00 46.19 43.56 2cvl s LEU 122 CO 0.00 0.01 1.93 0.00 0.23 0.00 0.00 176.35 178.53 2cvl h ALA 123 N 4.23 1.59 0.00 4.21 0.00 -1.16 -3.43 119.26 124.70 2cvl h ALA 123 Ca -0.45 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2cvl h ALA 123 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2cvl h ALA 123 CO 0.68 0.31 0.00 0.39 0.00 0.00 0.00 179.25 180.63