#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 3.31 -0.16 4.31 0.00 -1.26 -0.17 121.76 127.79 2cvl s ALA 3 Ca 0.00 0.63 -0.07 0.00 0.00 0.00 0.00 51.96 52.52 2cvl s ALA 3 Cb 0.00 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 2cvl s ALA 3 CO 0.00 0.15 0.08 0.08 0.00 0.00 0.00 175.76 176.08 2cvl s VAL 4 N -1.28 4.99 -0.03 0.00 1.01 0.49 -4.92 120.40 120.65 2cvl s VAL 4 Ca 0.44 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.45 2cvl s VAL 4 Cb -0.25 -3.22 0.03 0.00 0.00 0.00 0.00 36.38 32.93 2cvl s VAL 4 CO 0.31 0.50 -0.01 -0.54 0.00 0.00 0.00 175.10 175.37 2cvl s LYS 5 N -0.02 0.39 -0.10 2.72 1.02 -1.26 -3.87 119.74 118.61 2cvl s LYS 5 Ca 0.07 0.05 -0.14 0.00 0.02 0.00 0.00 55.97 55.97 2cvl s LYS 5 Cb -0.12 -0.55 0.03 0.00 -0.52 0.00 0.00 37.83 36.68 2cvl s LYS 5 CO 0.01 -0.13 0.36 -0.08 -0.92 0.00 0.00 175.35 174.59 2cvl s THR 6 N 1.02 0.02 -2.19 2.17 -1.32 -1.26 -5.02 115.64 109.06 2cvl s THR 6 Ca -0.10 -0.13 0.29 0.00 -1.21 0.00 0.00 61.69 60.54 2cvl s THR 6 Cb -0.14 -0.56 0.73 0.00 -1.51 0.00 0.00 72.50 71.03 2cvl s THR 6 CO -0.01 -0.07 1.99 -0.90 -2.21 0.00 0.00 174.62 173.41 2cvl n ASP 7 N 2.38 0.62 -0.41 8.08 5.68 -1.26 -3.33 116.55 128.30 2cvl n ASP 7 Ca -0.16 -1.24 0.11 0.00 -0.50 0.00 0.00 54.79 53.00 2cvl n ASP 7 Cb 0.57 -0.00 0.44 0.00 -1.14 0.00 0.00 41.12 40.99 2cvl n ASP 7 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2cvl n ARG 8 N -0.50 1.55 -4.04 0.11 1.74 -1.26 -4.81 116.66 109.45 2cvl n ARG 8 Ca 0.21 -0.82 -0.08 0.00 -0.77 0.00 0.00 57.85 56.39 2cvl n ARG 8 Cb 0.21 -1.38 -0.11 0.00 -1.02 0.00 0.00 32.46 30.16 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 -1.86 0.35 0.59 7.54 0.00 -1.21 -4.77 121.76 122.41 2cvl s ALA 9 Ca 0.32 -0.91 -0.20 0.00 0.00 0.00 0.00 51.96 51.18 2cvl s ALA 9 Cb 0.17 0.20 -0.03 0.00 0.00 0.00 0.00 23.12 23.46 2cvl s ALA 9 CO 0.26 -0.25 1.30 -2.14 0.00 0.00 0.00 175.76 174.93 2cvl s PRO 10 N -2.67 2.89 0.57 0.00 0.02 -1.26 -4.74 135.00 129.81 2cvl s PRO 10 Ca -0.04 2.08 -0.18 0.00 0.02 0.00 0.00 61.00 62.88 2cvl s PRO 10 Cb -0.01 -2.04 -0.05 0.00 0.02 0.00 0.00 34.50 32.42 2cvl s PRO 10 CO -0.05 -1.34 1.12 0.00 -0.33 0.00 0.00 177.00 176.39 2cvl s ALA 11 N -1.39 2.66 0.52 -1.55 0.00 -1.26 -4.95 121.76 115.79 2cvl s ALA 11 Ca 0.77 0.74 -0.23 0.00 0.00 0.00 0.00 51.96 53.24 2cvl s ALA 11 Cb -0.37 -3.34 -0.06 0.00 0.00 0.00 0.00 23.12 19.35 2cvl s ALA 11 CO 0.42 -0.85 1.37 0.00 0.00 0.00 0.00 175.76 176.69 2cvl n ALA 12 N -1.54 1.66 -0.99 0.00 0.00 -1.26 -4.89 120.51 113.48 2cvl n ALA 12 Ca 0.11 0.16 0.06 0.00 0.00 0.00 0.00 53.44 53.77 2cvl n ALA 12 Cb 0.51 -2.36 0.31 0.00 0.00 0.00 0.00 19.45 17.92 2cvl n ALA 12 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2cvl n ILE 13 N -0.83 2.55 -3.85 0.00 -5.35 -1.26 -4.97 119.36 105.65 2cvl n ILE 13 Ca 0.09 -1.73 -0.09 0.00 -0.27 0.00 0.00 62.75 60.75 2cvl n ILE 13 Cb 0.44 -0.28 0.01 0.00 -1.74 0.00 0.00 39.64 38.06 2cvl n ILE 13 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2cvl s GLY 14 N -1.47 0.39 -1.00 3.28 0.00 -1.26 -5.06 107.32 102.20 2cvl s GLY 14 Ca 0.48 -0.74 -0.16 0.00 0.00 0.00 0.00 44.72 44.30 2cvl s GLY 14 CO 0.11 -0.34 2.09 -1.55 0.00 0.00 0.00 173.10 173.41 2cvl n PRO 15 N -0.51 2.04 -3.67 2.90 -0.04 -1.26 -4.84 135.00 129.61 2cvl n PRO 15 Ca -0.06 -1.94 -0.13 0.00 -0.04 0.00 0.00 63.50 61.32 2cvl n PRO 15 Cb 0.60 -2.89 -0.07 0.00 -0.04 0.00 0.00 33.50 31.10 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 4.12 -0.28 0.27 0.54 -0.85 -1.26 -5.16 117.35 114.74 2cvl s TYR 16 Ca 0.52 0.30 -0.13 0.00 -0.52 0.00 0.00 57.07 57.25 2cvl s TYR 16 Cb 0.14 0.21 -0.08 0.00 0.38 0.00 0.00 41.96 42.60 2cvl s TYR 16 CO 0.03 -0.54 0.65 0.00 -1.52 0.00 0.00 175.55 174.17 2cvl s ALA 17 N -2.14 3.44 0.32 9.51 0.00 -1.26 -4.67 121.76 126.96 2cvl s ALA 17 Ca -0.07 -0.10 0.05 0.00 0.00 0.00 0.00 51.96 51.84 2cvl s ALA 17 Cb -0.02 -2.61 0.69 0.00 0.00 0.00 0.00 23.12 21.18 2cvl s ALA 17 CO 0.00 0.41 1.86 1.96 0.00 0.00 0.00 175.76 179.99 2cvl h GLN 18 N 2.46 0.82 -2.52 0.00 4.20 -1.94 -3.40 115.11 114.72 2cvl h GLN 18 Ca -0.47 -0.05 0.04 0.00 0.06 0.00 0.00 58.65 58.23 2cvl h GLN 18 Cb 1.17 -0.18 -0.15 0.00 0.30 0.00 0.00 27.48 28.62 2cvl h GLN 18 CO 0.67 0.54 0.36 0.00 -0.67 0.00 0.00 178.83 179.73 2cvl s ALA 19 N -5.81 -1.73 -0.04 3.87 0.00 -1.25 -1.11 121.76 115.69 2cvl s ALA 19 Ca -0.11 0.85 0.02 0.00 0.00 0.00 0.00 51.96 52.72 2cvl s ALA 19 Cb 0.22 0.53 0.01 0.00 0.00 0.00 0.00 23.12 23.88 2cvl s ALA 19 CO 0.80 -0.68 -0.08 0.08 0.00 0.00 0.00 175.76 175.87 2cvl s VAL 20 N -3.16 0.75 -0.20 0.00 1.01 0.09 -0.38 120.40 118.50 2cvl s VAL 20 Ca 0.02 -0.30 -0.11 0.00 0.00 0.00 0.00 61.98 61.59 2cvl s VAL 20 Cb -0.01 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.63 2cvl s VAL 20 CO -0.09 0.25 0.18 -0.54 0.00 0.00 0.00 175.10 174.90 2cvl s LYS 21 N 0.44 4.18 -0.26 2.72 1.02 0.76 -0.41 119.74 128.20 2cvl s LYS 21 Ca -0.07 -0.15 -0.26 0.00 0.02 0.00 0.00 55.97 55.51 2cvl s LYS 21 Cb -0.11 -3.45 0.12 0.00 -0.52 0.00 0.00 37.83 33.87 2cvl s LYS 21 CO 0.01 0.22 0.99 0.00 -0.92 0.00 0.00 175.35 175.66 2cvl s ALA 22 N 0.57 -1.95 -1.51 5.17 0.00 -0.05 -2.50 121.76 121.50 2cvl s ALA 22 Ca 0.10 1.83 0.00 0.00 0.00 0.00 0.00 51.96 53.89 2cvl s ALA 22 Cb -0.12 -1.27 0.00 0.00 0.00 0.00 0.00 23.12 21.72 2cvl s ALA 22 CO 0.01 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 175.92 2cvl n GLY 23 N 2.00 0.29 1.28 0.00 0.00 -1.26 -1.21 105.19 106.29 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 -0.67 0.74 3.51 -0.02 0.00 -1.26 -5.05 105.19 102.45 2cvl n GLY 24 Ca -0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.72 2.21 -0.16 1.61 0.40 -0.35 -0.53 117.98 118.45 2cvl s PHE 25 Ca 0.00 -0.69 0.00 0.00 -0.60 0.00 0.00 56.93 55.64 2cvl s PHE 25 Cb 0.00 -1.39 0.03 0.00 0.51 0.00 0.00 43.02 42.17 2cvl s PHE 25 CO 0.00 0.35 -0.12 0.08 0.70 0.00 0.00 175.22 176.22 2cvl s VAL 26 N -2.89 1.56 -0.35 -0.44 1.01 0.10 -0.87 120.40 118.52 2cvl s VAL 26 Ca 0.33 -0.73 -0.15 0.00 0.00 0.00 0.00 61.98 61.43 2cvl s VAL 26 Cb 0.06 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.90 2cvl s VAL 26 CO 0.15 0.36 0.32 -0.36 0.00 0.00 0.00 175.10 175.57 2cvl s PHE 27 N 1.47 3.22 -0.19 5.22 0.08 0.45 -1.23 117.98 127.00 2cvl s PHE 27 Ca 0.03 -0.15 -0.08 0.00 0.12 0.00 0.00 56.93 56.85 2cvl s PHE 27 Cb -0.14 -2.62 -0.04 0.00 -0.57 0.00 0.00 43.02 39.65 2cvl s PHE 27 CO -0.10 -0.44 0.09 0.08 -0.10 0.00 0.00 175.22 174.75 2cvl s VAL 28 N 1.91 4.98 0.85 -0.44 1.01 -0.18 -0.73 120.40 127.80 2cvl s VAL 28 Ca 0.09 0.04 -0.11 0.00 0.00 0.00 0.00 61.98 62.00 2cvl s VAL 28 Cb -0.17 -3.26 0.11 0.00 0.00 0.00 0.00 36.38 33.06 2cvl s VAL 28 CO 0.11 0.45 1.14 -0.44 0.00 0.00 0.00 175.10 176.36 2cvl s SER 29 N 0.42 3.50 0.09 3.32 0.01 -0.27 -2.80 113.70 117.97 2cvl s SER 29 Ca 0.05 2.12 -0.31 0.00 1.31 0.00 0.00 55.95 59.12 2cvl s SER 29 Cb -0.12 -2.56 -0.09 0.00 0.21 0.00 0.00 66.02 63.46 2cvl s SER 29 CO -0.00 -2.72 1.76 -0.83 0.41 0.00 0.00 173.24 171.86 2cvl s GLY 30 N -2.77 1.45 -0.06 3.44 0.00 -1.26 -4.49 107.32 103.63 2cvl s GLY 30 Ca 0.66 1.31 -0.10 0.00 0.00 0.00 0.00 44.72 46.60 2cvl s GLY 30 CO 0.56 3.05 0.26 1.20 0.00 0.00 0.00 173.10 178.17 2cvl s GLN 31 N 2.87 3.64 0.39 2.90 -1.52 0.94 -4.82 119.66 124.07 2cvl s GLN 31 Ca 0.78 0.09 0.07 0.00 -1.95 0.00 0.00 55.36 54.35 2cvl s GLN 31 Cb -0.43 -3.19 -0.08 0.00 -0.22 0.00 0.00 33.01 29.10 2cvl s GLN 31 CO 0.35 0.73 0.01 0.96 -0.25 0.00 0.00 175.29 177.08 2cvl s ILE 32 N -1.08 1.93 -0.19 1.08 -4.36 -1.26 -1.55 121.20 115.76 2cvl s ILE 32 Ca 0.20 -2.02 -0.03 0.00 -0.26 0.00 0.00 60.65 58.55 2cvl s ILE 32 Cb -0.14 -2.94 -0.07 0.00 1.25 0.00 0.00 42.46 40.56 2cvl s ILE 32 CO 0.09 -0.02 1.60 -2.65 0.24 0.00 0.00 174.94 174.20 2cvl n PRO 33 N -0.92 0.88 -4.24 0.37 -0.02 -1.26 -4.50 135.00 125.31 2cvl n PRO 33 Ca -0.05 -0.60 -0.34 0.00 -2.02 0.00 0.00 63.50 60.49 2cvl n PRO 33 Cb 0.67 -1.88 -0.10 0.00 -0.02 0.00 0.00 33.50 32.17 2cvl n PRO 33 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2cvl s LEU 34 N 0.02 3.58 0.63 2.45 1.43 -1.26 0.23 118.68 125.76 2cvl s LEU 34 Ca 0.23 0.04 -0.13 0.00 -1.03 0.00 0.00 54.13 53.24 2cvl s LEU 34 Cb 0.09 -1.86 -0.02 0.00 0.03 0.00 0.00 46.19 44.43 2cvl s LEU 34 CO -0.01 0.24 1.05 0.00 0.23 0.00 0.00 176.35 177.86 2cvl s ALA 35 N -0.05 2.76 0.55 4.21 0.00 -0.06 -4.56 121.76 124.61 2cvl s ALA 35 Ca 0.04 0.21 0.31 0.00 0.00 0.00 0.00 51.96 52.52 2cvl s ALA 35 Cb -0.13 -3.19 1.47 0.00 0.00 0.00 0.00 23.12 21.28 2cvl s ALA 35 CO 0.02 -0.93 1.88 -1.35 0.00 0.00 0.00 175.76 175.37 2cvl h PRO 36 N -0.07 0.00 0.00 0.00 0.11 -1.86 0.18 132.00 130.36 2cvl h PRO 36 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2cvl h PRO 36 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2cvl h PRO 36 CO 0.58 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.97 2cvl n ASP 37 N -4.11 0.00 0.00 -2.05 5.68 -1.26 -4.30 116.55 110.52 2cvl n ASP 37 Ca 0.16 -0.93 0.00 0.00 -0.50 0.00 0.00 54.79 53.53 2cvl n ASP 37 Cb 0.91 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.89 2cvl n ASP 37 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2cvl n GLY 38 N 0.67 0.75 3.77 6.12 0.00 0.64 -5.05 105.19 112.08 2cvl n GLY 38 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 2cvl n GLY 38 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cvl s SER 39 N -3.00 6.79 0.17 1.61 0.15 -1.25 -4.82 113.70 113.34 2cvl s SER 39 Ca 0.00 0.94 -0.31 0.00 0.70 0.00 0.00 55.95 57.28 2cvl s SER 39 Cb 0.00 -2.29 -0.09 0.00 -1.71 0.00 0.00 66.02 61.94 2cvl s SER 39 CO 0.00 0.15 1.37 -0.22 1.20 0.00 0.00 173.24 175.73 2cvl s LEU 40 N -0.21 4.39 -0.42 3.45 1.98 -1.26 -0.88 118.68 125.74 2cvl s LEU 40 Ca 0.26 2.40 -0.24 0.00 -2.89 0.00 0.00 54.13 53.66 2cvl s LEU 40 Cb -0.16 -3.60 0.02 0.00 0.66 0.00 0.00 46.19 43.11 2cvl s LEU 40 CO 0.13 -0.61 0.86 -0.69 -1.89 0.00 0.00 176.35 174.15 2cvl s VAL 41 N 0.56 4.60 0.47 1.68 1.01 0.14 -4.88 120.40 123.97 2cvl s VAL 41 Ca 0.61 0.79 -0.04 0.00 0.00 0.00 0.00 61.98 63.34 2cvl s VAL 41 Cb -0.37 -4.33 -0.03 0.00 0.00 0.00 0.00 36.38 31.64 2cvl s VAL 41 CO 0.35 -0.65 0.75 -1.61 0.00 0.00 0.00 175.10 173.94 2cvl s GLU 42 N 3.43 3.46 0.00 2.72 0.41 -1.26 -4.73 118.70 122.73 2cvl s GLU 42 Ca 0.34 0.06 0.00 0.00 -0.41 0.00 0.00 54.97 54.96 2cvl s GLU 42 Cb -0.12 -2.43 0.00 0.00 -1.78 0.00 0.00 34.13 29.81 2cvl s GLU 42 CO 0.22 -0.19 0.00 0.41 -0.49 0.00 0.00 175.26 175.21 2cvl n GLY 43 N -2.20 0.91 3.45 -1.39 0.00 -1.26 -4.79 105.19 99.91 2cvl n GLY 43 Ca -0.00 -1.97 -0.27 0.00 0.00 0.00 0.00 46.02 43.77 2cvl n GLY 43 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2cvl n ASP 44 N 2.57 -0.57 -0.08 1.61 5.68 -1.26 -4.74 116.55 119.76 2cvl n ASP 44 Ca 0.00 -1.34 0.12 0.00 -0.50 0.00 0.00 54.79 53.07 2cvl n ASP 44 Cb 0.00 -0.93 0.50 0.00 -1.14 0.00 0.00 41.12 39.55 2cvl n ASP 44 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 2cvl h ILE 45 N -2.00 0.90 -0.18 2.12 6.09 -1.97 -2.21 117.51 120.26 2cvl h ILE 45 Ca -0.39 -0.14 -0.04 0.00 -1.37 0.00 0.00 64.86 62.92 2cvl h ILE 45 Cb 1.11 0.45 -0.01 0.00 0.47 0.00 0.00 36.82 38.85 2cvl h ILE 45 CO 0.27 0.08 -0.03 0.03 -3.07 0.00 0.00 178.15 175.42 2cvl h ARG 46 N 0.41 0.34 -0.34 2.19 3.08 -1.92 0.50 114.38 118.64 2cvl h ARG 46 Ca 0.28 -0.13 -0.05 0.00 0.07 0.00 0.00 59.98 60.15 2cvl h ARG 46 Cb 0.54 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 2cvl h ARG 46 CO -0.08 0.59 0.00 0.28 -1.07 0.00 0.00 179.97 179.70 2cvl h VAL 47 N 0.06 1.26 -0.58 2.04 2.07 -1.85 -2.12 116.25 117.12 2cvl h VAL 47 Ca 0.05 -0.96 -0.09 0.00 0.82 0.00 0.00 66.70 66.52 2cvl h VAL 47 Cb 0.46 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 2cvl h VAL 47 CO 0.02 0.32 0.00 1.56 0.02 0.00 0.00 177.57 179.48 2cvl h GLN 48 N 0.41 1.03 -0.43 1.57 4.20 -1.41 -2.96 115.11 117.52 2cvl h GLN 48 Ca 0.10 -0.33 -0.08 0.00 0.06 0.00 0.00 58.65 58.40 2cvl h GLN 48 Cb 0.44 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 2cvl h GLN 48 CO 0.02 1.01 -0.07 1.15 -0.67 0.00 0.00 178.83 180.27 2cvl h THR 49 N 0.92 1.25 -0.65 -0.54 2.02 -0.84 -2.11 112.91 112.95 2cvl h THR 49 Ca 0.17 -1.08 0.04 0.00 0.77 0.00 0.00 66.41 66.31 2cvl h THR 49 Cb 0.55 0.99 -0.05 0.00 -1.74 0.00 0.00 68.15 67.90 2cvl h THR 49 CO 0.03 0.37 0.39 -0.08 0.37 0.00 0.00 175.52 176.60 2cvl h GLU 50 N 0.69 0.72 -0.38 6.66 4.81 -1.23 -2.18 114.58 123.67 2cvl h GLU 50 Ca 0.13 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.20 2cvl h GLU 50 Cb 0.52 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2cvl h GLU 50 CO 0.03 0.48 -0.23 -0.09 -0.73 0.00 0.00 179.01 178.46 2cvl h ARG 51 N 0.74 0.77 -0.33 1.92 9.65 -1.35 -0.81 114.38 124.97 2cvl h ARG 51 Ca 0.28 -0.31 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 2cvl h ARG 51 Cb 0.09 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.63 2cvl h ARG 51 CO -0.14 0.92 0.00 0.28 2.80 0.00 0.00 179.97 183.84 2cvl n VAL 52 N -4.11 0.01 0.00 0.20 0.31 -0.82 -0.62 118.33 113.30 2cvl n VAL 52 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2cvl n VAL 52 Cb 0.44 -0.11 0.00 0.00 -0.91 0.00 0.00 33.84 33.26 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 0.52 0.00 -0.10 5.55 -0.58 -0.31 -0.99 120.64 124.74 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 0.02 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 30.86 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 0.48 -0.21 1.62 2.35 -1.13 -1.50 115.58 117.19 2cvl h ASN 55 Ca 0.00 -0.26 0.03 0.00 -0.55 0.00 0.00 56.30 55.51 2cvl h ASN 55 Cb 0.00 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.21 2cvl h ASN 55 CO 0.00 0.63 0.04 -0.07 -1.65 0.00 0.00 177.43 176.38 2cvl h LEU 56 N 0.33 0.02 -0.53 1.61 3.38 -1.32 -1.26 115.31 117.53 2cvl h LEU 56 Ca 0.09 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.14 2cvl h LEU 56 Cb 0.35 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 2cvl h LEU 56 CO 0.01 0.04 0.26 0.50 0.09 0.00 0.00 178.44 179.34 2cvl h LYS 57 N 0.13 0.48 -0.23 1.13 3.64 -1.80 -0.23 116.57 119.70 2cvl h LYS 57 Ca 0.09 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2cvl h LYS 57 Cb 0.09 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2cvl h LYS 57 CO -0.12 0.32 0.15 0.00 -2.27 0.00 0.00 179.45 177.52 2cvl h ALA 58 N 1.30 0.29 -0.45 5.00 0.00 -0.85 -1.13 119.26 123.41 2cvl h ALA 58 Ca 0.24 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 2cvl h ALA 58 Cb 0.17 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2cvl h ALA 58 CO -0.18 -0.23 0.13 0.28 0.00 0.00 0.00 179.25 179.26 2cvl h VAL 59 N 0.30 1.23 -0.53 0.00 2.07 -0.93 -1.30 116.25 117.09 2cvl h VAL 59 Ca 0.08 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.84 2cvl h VAL 59 Cb -0.02 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 2cvl h VAL 59 CO -0.02 0.27 0.35 -0.07 0.02 0.00 0.00 177.57 178.12 2cvl h LEU 60 N 0.60 0.61 -0.97 2.57 3.38 -0.85 -1.61 115.31 119.04 2cvl h LEU 60 Ca 0.15 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 2cvl h LEU 60 Cb 0.28 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2cvl h LEU 60 CO -0.00 0.45 -0.45 -0.33 0.09 0.00 0.00 178.44 178.19 2cvl h GLU 61 N 0.72 0.14 0.00 1.13 5.08 -1.10 0.18 114.58 120.73 2cvl h GLU 61 Ca 0.19 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 2cvl h GLU 61 Cb -0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 2cvl h GLU 61 CO -0.04 0.57 -0.28 0.00 -1.00 0.00 0.00 179.01 178.25 2cvl h ALA 62 N 1.43 1.20 -0.01 3.43 0.00 -0.71 -1.80 119.26 122.80 2cvl h ALA 62 Ca 0.01 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2cvl h ALA 62 Cb 0.84 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2cvl h ALA 62 CO 0.06 0.35 0.00 0.00 0.00 0.00 0.00 179.25 179.67 2cvl n ALA 63 N -2.33 2.62 -0.71 0.00 0.00 -0.65 -4.88 120.51 114.55 2cvl n ALA 63 Ca -0.01 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.08 2cvl n ALA 63 Cb 0.39 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.54 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 1.11 0.64 0.00 0.00 0.00 -0.68 -5.03 105.19 101.23 2cvl n GLY 64 Ca 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 0.12 0.44 -3.63 1.61 2.88 0.57 -4.82 113.62 110.78 2cvl n SER 65 Ca 0.00 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.56 2cvl n SER 65 Cb 0.00 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.46 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 -0.17 -0.38 0.28 0.46 0.00 -1.25 -3.67 107.32 102.59 2cvl s GLY 66 Ca 0.00 0.63 -0.00 0.00 0.00 0.00 0.00 44.72 45.34 2cvl s GLY 66 CO 0.00 0.78 1.86 1.41 0.00 0.00 0.00 173.10 177.15 2cvl h LEU 67 N 2.00 0.98 -0.33 0.66 3.38 -1.91 -0.82 115.31 119.27 2cvl h LEU 67 Ca -0.30 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2cvl h LEU 67 Cb 1.20 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2cvl h LEU 67 CO 0.29 0.58 0.00 -1.54 0.09 0.00 0.00 178.44 177.86 2cvl n SER 68 N -4.55 0.25 -0.69 -0.43 3.41 -1.26 -1.94 113.62 108.41 2cvl n SER 68 Ca 0.17 0.57 0.12 0.00 -0.26 0.00 0.00 58.87 59.47 2cvl n SER 68 Cb 0.27 -0.62 0.14 0.00 -0.26 0.00 0.00 64.21 63.74 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 -1.79 1.76 -2.32 4.33 5.12 -0.32 -4.93 116.66 118.52 2cvl n ARG 69 Ca 0.02 -1.39 -0.42 0.00 -1.93 0.00 0.00 57.85 54.13 2cvl n ARG 69 Cb 0.16 -1.47 -0.03 0.00 -1.16 0.00 0.00 32.46 29.96 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 -2.20 3.84 -0.26 1.55 1.01 -0.82 -0.88 120.40 122.64 2cvl s VAL 70 Ca 0.26 1.27 0.12 0.00 0.00 0.00 0.00 61.98 63.63 2cvl s VAL 70 Cb 0.19 -3.81 -0.17 0.00 0.00 0.00 0.00 36.38 32.59 2cvl s VAL 70 CO 0.41 0.04 0.38 1.33 0.00 0.00 0.00 175.10 177.27 2cvl n VAL 71 N 4.33 0.00 -3.67 2.92 0.24 -0.27 -4.25 118.33 117.63 2cvl n VAL 71 Ca 0.11 -0.25 -0.11 0.00 -2.04 0.00 0.00 64.34 62.04 2cvl n VAL 71 Cb 0.45 0.56 -0.08 0.00 -1.47 0.00 0.00 33.84 33.29 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 -2.56 0.66 0.06 7.34 0.74 -0.98 -1.05 119.66 123.87 2cvl s GLN 72 Ca -0.01 0.93 0.06 0.00 0.05 0.00 0.00 55.36 56.40 2cvl s GLN 72 Cb 0.09 0.23 -0.03 0.00 1.10 0.00 0.00 33.01 34.40 2cvl s GLN 72 CO 0.51 -0.11 -0.16 0.95 -0.55 0.00 0.00 175.29 175.93 2cvl s THR 73 N 0.84 1.32 -0.24 -0.34 -4.23 -0.43 -0.69 115.64 111.86 2cvl s THR 73 Ca -0.04 -1.25 0.01 0.00 -1.18 0.00 0.00 61.69 59.23 2cvl s THR 73 Cb -0.05 -1.21 0.06 0.00 1.34 0.00 0.00 72.50 72.64 2cvl s THR 73 CO -0.07 -0.06 -0.05 -0.89 -0.54 0.00 0.00 174.62 173.01 2cvl s THR 74 N -1.06 1.59 -0.11 3.99 2.01 0.10 -2.53 115.64 119.64 2cvl s THR 74 Ca 0.02 -1.29 -0.01 0.00 0.31 0.00 0.00 61.69 60.72 2cvl s THR 74 Cb -0.09 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.54 2cvl s THR 74 CO 0.02 -0.12 -0.08 0.00 -0.69 0.00 0.00 174.62 173.76 2cvl s PHE 76 N -0.13 1.93 0.03 0.00 0.40 0.25 -1.67 117.98 118.80 2cvl s PHE 76 Ca 0.01 -0.55 0.09 0.00 -0.60 0.00 0.00 56.93 55.88 2cvl s PHE 76 Cb -0.13 -1.29 -0.03 0.00 0.51 0.00 0.00 43.02 42.08 2cvl s PHE 76 CO 0.03 -0.17 -0.26 -0.51 0.70 0.00 0.00 175.22 175.01 2cvl s LEU 77 N -0.05 2.17 0.24 -0.37 1.43 -0.55 -1.33 118.68 120.21 2cvl s LEU 77 Ca -0.03 -0.55 0.16 0.00 -1.03 0.00 0.00 54.13 52.67 2cvl s LEU 77 Cb -0.12 -1.31 0.03 0.00 0.03 0.00 0.00 46.19 44.82 2cvl s LEU 77 CO 0.02 0.27 1.33 0.00 0.23 0.00 0.00 176.35 178.21 2cvl h ALA 78 N 4.94 0.67 -3.12 4.21 0.00 -1.55 0.14 119.26 124.55 2cvl h ALA 78 Ca -0.46 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 53.94 2cvl h ALA 78 Cb 1.14 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2cvl h ALA 78 CO 0.45 0.66 0.00 -3.47 0.00 0.00 0.00 179.25 176.88 2cvl n ASP 79 N -3.15 0.83 0.00 0.00 -0.08 -1.26 -4.63 116.55 108.25 2cvl n ASP 79 Ca -0.00 -0.28 0.00 0.00 -1.51 0.00 0.00 54.79 53.00 2cvl n ASP 79 Cb 0.75 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.21 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 0.66 0.00 -0.57 0.00 0.00 31.44 31.53 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 0.52 -0.14 1.62 8.00 -1.26 -4.31 116.55 120.98 2cvl n ASP 82 Ca 0.00 -0.76 -0.05 0.00 0.71 0.00 0.00 54.79 54.70 2cvl n ASP 82 Cb 0.00 -0.05 0.02 0.00 -0.02 0.00 0.00 41.12 41.06 2cvl n ASP 82 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 2cvl h PHE 83 N 0.70 -0.51 -0.43 1.24 3.57 -2.00 -0.58 116.94 118.93 2cvl h PHE 83 Ca 0.00 0.05 0.06 0.00 3.53 0.00 0.00 57.97 61.61 2cvl h PHE 83 Cb 0.32 0.29 -0.05 0.00 2.79 0.00 0.00 35.95 39.30 2cvl h PHE 83 CO 0.00 -0.29 0.13 -1.35 -2.23 0.00 0.00 178.31 174.57 2cvl h PRO 84 N -0.11 0.27 -0.64 6.41 0.11 -1.97 -1.04 132.00 135.03 2cvl h PRO 84 Ca 0.21 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.23 2cvl h PRO 84 Cb 0.44 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.47 2cvl h PRO 84 CO -0.52 0.18 0.09 0.78 -0.21 0.00 0.00 178.00 178.33 2cvl h GLY 85 N 0.28 1.15 0.82 -0.55 0.00 -1.74 -2.68 103.07 100.34 2cvl h GLY 85 Ca 0.20 -0.77 0.00 0.00 0.00 0.00 0.00 47.33 46.77 2cvl h GLY 85 CO -0.23 0.71 -0.14 -2.75 0.00 0.00 0.00 176.54 174.14 2cvl h PHE 86 N 0.98 -0.35 -0.90 5.60 3.04 -0.66 -2.79 116.94 121.86 2cvl h PHE 86 Ca 0.19 0.00 0.07 0.00 3.98 0.00 0.00 57.97 62.22 2cvl h PHE 86 Cb 0.45 0.14 -0.06 0.00 2.56 0.00 0.00 35.95 39.04 2cvl h PHE 86 CO 0.03 -0.21 0.58 -0.91 -2.02 0.00 0.00 178.31 175.79 2cvl h ASN 87 N -0.30 0.88 -0.04 0.41 2.35 -1.14 0.62 115.58 118.36 2cvl h ASN 87 Ca 0.01 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2cvl h ASN 87 Cb 0.29 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 2cvl h ASN 87 CO -0.04 0.55 0.02 -0.08 -1.65 0.00 0.00 177.43 176.24 2cvl h GLU 88 N 0.99 0.05 -0.20 0.81 4.81 -1.24 -0.60 114.58 119.20 2cvl h GLU 88 Ca 0.39 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.56 2cvl h GLU 88 Cb 0.25 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.61 2cvl h GLU 88 CO -0.15 0.05 -0.12 0.28 -0.73 0.00 0.00 179.01 178.34 2cvl h VAL 89 N 0.03 1.31 -0.67 0.32 2.07 -1.21 -3.10 116.25 115.01 2cvl h VAL 89 Ca 0.01 -1.21 0.13 0.00 0.82 0.00 0.00 66.70 66.45 2cvl h VAL 89 Cb 0.01 1.67 -0.09 0.00 -1.52 0.00 0.00 31.29 31.36 2cvl h VAL 89 CO -0.00 0.37 0.18 0.22 0.02 0.00 0.00 177.57 178.35 2cvl h TYR 90 N 0.13 0.29 0.00 1.57 3.20 -0.78 -0.29 116.97 121.08 2cvl h TYR 90 Ca 0.04 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 2cvl h TYR 90 Cb 0.62 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.87 2cvl h TYR 90 CO 0.07 -0.02 -0.01 0.00 -1.64 0.00 0.00 178.16 176.56 2cvl h ALA 91 N 1.52 1.68 0.00 1.82 0.00 -1.03 -2.20 119.26 121.05 2cvl h ALA 91 Ca 0.36 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 2cvl h ALA 91 Cb 0.55 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2cvl h ALA 91 CO -0.43 0.01 -0.10 0.00 0.00 0.00 0.00 179.25 178.73 2cvl h ARG 92 N 0.00 0.00 0.00 0.00 3.08 -1.01 -3.14 114.38 113.31 2cvl h ARG 92 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2cvl h ARG 92 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2cvl h ARG 92 CO 0.00 0.10 -1.08 0.66 -1.07 0.00 0.00 179.97 178.59 2cvl n TYR 93 N -3.35 0.12 -4.52 3.04 4.02 -0.83 -4.98 117.16 110.66 2cvl n TYR 93 Ca -0.01 0.03 -0.25 0.00 -0.01 0.00 0.00 57.90 57.67 2cvl n TYR 93 Cb 0.29 -0.28 -0.10 0.00 -0.02 0.00 0.00 39.34 39.23 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 -3.15 2.31 -0.02 -0.72 0.40 -1.19 -4.83 117.98 110.79 2cvl s PHE 94 Ca 0.04 -0.54 -0.18 0.00 -0.60 0.00 0.00 56.93 55.66 2cvl s PHE 94 Cb 0.15 -1.33 0.03 0.00 0.51 0.00 0.00 43.02 42.39 2cvl s PHE 94 CO 0.83 0.53 0.38 0.99 0.70 0.00 0.00 175.22 178.64 2cvl s THR 95 N -2.69 0.05 0.22 0.64 2.01 -1.26 -4.92 115.64 109.70 2cvl s THR 95 Ca 0.32 -0.40 -0.31 0.00 0.31 0.00 0.00 61.69 61.61 2cvl s THR 95 Cb 0.03 -0.71 -0.15 0.00 0.01 0.00 0.00 72.50 71.68 2cvl s THR 95 CO 0.16 -0.22 1.17 -2.65 -0.69 0.00 0.00 174.62 172.39 2cvl n PRO 96 N 1.15 1.43 -2.58 4.92 -0.02 -1.26 -3.77 135.00 134.86 2cvl n PRO 96 Ca -0.21 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.36 2cvl n PRO 96 Cb 0.56 -2.00 -0.03 0.00 -0.02 0.00 0.00 33.50 32.01 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 -0.75 4.54 0.56 0.52 0.04 -1.26 -5.16 135.00 133.49 2cvl s PRO 97 Ca 0.68 1.59 -0.15 0.00 0.04 0.00 0.00 61.00 63.16 2cvl s PRO 97 Cb -0.76 -3.38 -0.06 0.00 0.04 0.00 0.00 34.50 30.34 2cvl s PRO 97 CO 0.54 -0.06 1.01 0.71 0.04 0.00 0.00 177.00 179.24 2cvl s TYR 98 N 0.68 3.44 0.72 0.56 1.51 -1.25 -5.04 117.35 117.97 2cvl s TYR 98 Ca 0.53 1.42 -0.11 0.00 -1.01 0.00 0.00 57.07 57.90 2cvl s TYR 98 Cb -0.26 -2.80 0.02 0.00 -0.11 0.00 0.00 41.96 38.82 2cvl s TYR 98 CO 0.30 -0.55 1.07 -2.14 -1.11 0.00 0.00 175.55 173.12 2cvl s PRO 99 N -4.39 2.70 0.64 -1.71 0.02 -1.26 -5.00 135.00 126.00 2cvl s PRO 99 Ca 0.58 1.07 -0.15 0.00 0.02 0.00 0.00 61.00 62.52 2cvl s PRO 99 Cb -0.11 -1.96 -0.01 0.00 0.02 0.00 0.00 34.50 32.44 2cvl s PRO 99 CO 0.38 -1.29 1.09 0.00 -0.33 0.00 0.00 177.00 176.86 2cvl s ALA 100 N -2.92 2.56 -0.00 -1.55 0.00 -0.22 -4.87 121.76 114.76 2cvl s ALA 100 Ca 0.60 0.50 -0.17 0.00 0.00 0.00 0.00 51.96 52.90 2cvl s ALA 100 Cb -0.16 -3.29 0.03 0.00 0.00 0.00 0.00 23.12 19.70 2cvl s ALA 100 CO 0.53 -1.11 0.35 0.50 0.00 0.00 0.00 175.76 176.03 2cvl s ARG 101 N -4.08 0.75 -0.05 0.00 3.52 -1.26 -1.32 118.95 116.51 2cvl s ARG 101 Ca 0.66 -0.21 -0.00 0.00 -0.13 0.00 0.00 55.73 56.05 2cvl s ARG 101 Cb -0.19 0.33 0.03 0.00 -1.56 0.00 0.00 34.95 33.56 2cvl s ARG 101 CO 0.40 -0.22 -0.01 0.00 -0.81 0.00 0.00 175.30 174.66 2cvl s ALA 102 N -1.58 0.52 -0.09 6.12 0.00 -1.05 -4.99 121.76 120.69 2cvl s ALA 102 Ca -0.11 0.02 0.01 0.00 0.00 0.00 0.00 51.96 51.87 2cvl s ALA 102 Cb -0.04 -0.51 0.02 0.00 0.00 0.00 0.00 23.12 22.59 2cvl s ALA 102 CO 0.03 -0.22 -0.11 0.99 0.00 0.00 0.00 175.76 176.46 2cvl s THR 103 N 1.39 1.17 0.03 0.00 2.01 -1.26 -0.68 115.64 118.30 2cvl s THR 103 Ca -0.04 -0.44 0.01 0.00 0.31 0.00 0.00 61.69 61.53 2cvl s THR 103 Cb -0.13 -1.11 -0.02 0.00 0.01 0.00 0.00 72.50 71.25 2cvl s THR 103 CO -0.02 0.38 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.53 2cvl s VAL 104 N 1.13 0.36 -0.19 3.82 1.01 -0.67 -5.02 120.40 120.84 2cvl s VAL 104 Ca -0.05 -0.94 -0.16 0.00 0.00 0.00 0.00 61.98 60.83 2cvl s VAL 104 Cb -0.14 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 2cvl s VAL 104 CO -0.02 -0.39 0.40 0.00 0.00 0.00 0.00 175.10 175.09 2cvl s ALA 105 N -1.30 3.55 0.55 5.51 0.00 -1.26 -1.48 121.76 127.34 2cvl s ALA 105 Ca -0.11 -0.50 0.04 0.00 0.00 0.00 0.00 51.96 51.39 2cvl s ALA 105 Cb -0.09 -2.62 0.04 0.00 0.00 0.00 0.00 23.12 20.44 2cvl s ALA 105 CO -0.00 -0.26 0.32 0.14 0.00 0.00 0.00 175.76 175.95 2cvl s VAL 106 N 1.22 1.41 -0.03 0.00 -7.23 0.49 -4.92 120.40 111.33 2cvl s VAL 106 Ca 0.19 -1.62 -0.24 0.00 -1.81 0.00 0.00 61.98 58.51 2cvl s VAL 106 Cb -0.15 -2.02 -0.22 0.00 0.56 0.00 0.00 36.38 34.55 2cvl s VAL 106 CO 0.08 0.00 1.10 0.50 -0.31 0.00 0.00 175.10 176.47 2cvl h LYS 107 N 0.84 0.18 -2.69 4.82 3.64 -1.88 -3.42 116.57 118.07 2cvl h LYS 107 Ca -0.38 -0.16 -0.10 0.00 -1.27 0.00 0.00 60.65 58.74 2cvl h LYS 107 Cb 1.31 0.04 -0.20 0.00 -0.41 0.00 0.00 32.23 32.98 2cvl h LYS 107 CO 0.61 0.85 -0.12 0.00 -2.27 0.00 0.00 179.45 178.52 2cvl s ALA 108 N -3.42 -1.12 0.33 5.00 0.00 -1.26 -4.99 121.76 116.30 2cvl s ALA 108 Ca -0.16 0.66 0.10 0.00 0.00 0.00 0.00 51.96 52.56 2cvl s ALA 108 Cb 0.02 0.05 -0.06 0.00 0.00 0.00 0.00 23.12 23.13 2cvl s ALA 108 CO 0.74 -0.30 -0.11 -0.51 0.00 0.00 0.00 175.76 175.58 2cvl s LEU 109 N -1.29 2.74 0.19 0.00 1.43 -1.26 -5.05 118.68 115.43 2cvl s LEU 109 Ca -0.13 -1.13 -0.33 0.00 -1.03 0.00 0.00 54.13 51.52 2cvl s LEU 109 Cb -0.03 -1.07 -0.15 0.00 0.03 0.00 0.00 46.19 44.96 2cvl s LEU 109 CO 0.06 -0.15 1.26 -2.65 0.23 0.00 0.00 176.35 175.10 2cvl n PRO 110 N -0.77 1.45 -2.58 1.29 -0.02 -1.26 -1.71 135.00 131.39 2cvl n PRO 110 Ca -0.05 0.52 -0.13 0.00 -2.02 0.00 0.00 63.50 61.82 2cvl n PRO 110 Cb 0.63 -2.08 -0.00 0.00 -0.02 0.00 0.00 33.50 32.02 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 1.93 -2.48 -2.31 -0.52 1.74 -1.26 -2.66 116.66 111.10 2cvl n ARG 111 Ca 0.14 0.54 -0.20 0.00 -0.77 0.00 0.00 57.85 57.56 2cvl n ARG 111 Cb 0.26 -5.15 -0.02 0.00 -1.02 0.00 0.00 32.46 26.54 2cvl n ARG 111 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cvl n GLY 112 N -0.84 -0.24 3.84 -0.13 0.00 -0.69 -5.01 105.19 102.12 2cvl n GLY 112 Ca -0.12 -0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.98 2.19 -0.23 1.61 -7.23 -1.09 -4.95 120.40 107.71 2cvl s VAL 113 Ca 0.00 0.06 0.21 0.00 -1.81 0.00 0.00 61.98 60.44 2cvl s VAL 113 Cb 0.00 -2.92 0.01 0.00 0.56 0.00 0.00 36.38 34.04 2cvl s VAL 113 CO 0.00 -0.08 1.08 0.03 -0.31 0.00 0.00 175.10 175.82 2cvl h ARG 114 N -1.25 0.00 -2.88 4.82 3.08 -1.94 -3.42 114.38 112.79 2cvl h ARG 114 Ca -0.48 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.45 2cvl h ARG 114 Cb 1.32 0.00 -0.22 0.00 0.08 0.00 0.00 29.97 31.15 2cvl h ARG 114 CO 0.63 0.07 -0.26 0.54 -1.07 0.00 0.00 179.97 179.88 2cvl s VAL 115 N -3.26 0.02 -0.02 2.04 0.11 -1.26 -1.62 120.40 116.41 2cvl s VAL 115 Ca 0.00 -0.20 0.00 0.00 -2.93 0.00 0.00 61.98 58.85 2cvl s VAL 115 Cb 0.09 -0.58 0.03 0.00 -1.53 0.00 0.00 36.38 34.38 2cvl s VAL 115 CO 0.78 -0.11 0.02 -0.70 -3.33 0.00 0.00 175.10 171.76 2cvl s GLU 116 N -0.51 -0.00 -0.06 1.54 2.12 -0.44 -4.22 118.70 117.12 2cvl s GLU 116 Ca -0.06 0.16 0.00 0.00 0.36 0.00 0.00 54.97 55.44 2cvl s GLU 116 Cb -0.04 -0.26 0.02 0.00 0.26 0.00 0.00 34.13 34.12 2cvl s GLU 116 CO 0.03 -0.15 -0.04 0.08 -0.54 0.00 0.00 175.26 174.63 2cvl s VAL 117 N 1.00 0.61 0.29 3.70 1.01 -0.60 -0.58 120.40 125.83 2cvl s VAL 117 Ca -0.08 -0.11 0.10 0.00 0.00 0.00 0.00 61.98 61.88 2cvl s VAL 117 Cb -0.12 -0.65 -0.05 0.00 0.00 0.00 0.00 36.38 35.55 2cvl s VAL 117 CO -0.03 0.26 -0.09 0.00 0.00 0.00 0.00 175.10 175.24 2cvl s ALA 118 N 1.24 2.98 0.29 5.51 0.00 -0.60 -0.04 121.76 131.14 2cvl s ALA 118 Ca -0.06 -1.85 -0.16 0.00 0.00 0.00 0.00 51.96 49.89 2cvl s ALA 118 Cb -0.14 -0.41 0.01 0.00 0.00 0.00 0.00 23.12 22.59 2cvl s ALA 118 CO -0.02 0.21 0.62 0.00 0.00 0.00 0.00 175.76 176.58 2cvl s VAL 120 N -3.68 0.84 0.15 0.00 1.01 0.14 -1.01 120.40 117.84 2cvl s VAL 120 Ca 0.17 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 61.85 2cvl s VAL 120 Cb -0.04 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 2cvl s VAL 120 CO 0.09 0.28 -0.05 0.00 0.00 0.00 0.00 175.10 175.42 2cvl s ALA 121 N 0.62 1.32 0.31 5.51 0.00 -0.37 -1.11 121.76 128.04 2cvl s ALA 121 Ca -0.11 -1.51 -0.28 0.00 0.00 0.00 0.00 51.96 50.06 2cvl s ALA 121 Cb -0.14 0.26 -0.09 0.00 0.00 0.00 0.00 23.12 23.15 2cvl s ALA 121 CO 0.02 -0.21 1.09 -0.51 0.00 0.00 0.00 175.76 176.15 2cvl s LEU 122 N -3.15 4.46 0.20 0.00 1.43 -0.06 0.01 118.68 121.57 2cvl s LEU 122 Ca 0.18 2.23 -0.01 0.00 -1.03 0.00 0.00 54.13 55.50 2cvl s LEU 122 Cb 0.05 -3.75 0.13 0.00 0.03 0.00 0.00 46.19 42.65 2cvl s LEU 122 CO 0.01 -0.23 1.50 0.00 0.23 0.00 0.00 176.35 177.86 2cvl h ALA 123 N 3.52 0.70 -0.02 4.21 0.00 -1.06 -3.43 119.26 123.19 2cvl h ALA 123 Ca -0.47 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 53.90 2cvl h ALA 123 Cb 1.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2cvl h ALA 123 CO 0.66 0.71 0.00 0.39 0.00 0.00 0.00 179.25 181.00