#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fva s LYS 2 N 0.00 4.01 0.25 0.00 1.02 -1.26 -4.93 119.74 118.84 2fva s LYS 2 Ca 0.00 1.19 -0.05 0.00 0.02 0.00 0.00 55.97 57.12 2fva s LYS 2 Cb 0.00 -2.14 0.28 0.00 -0.52 0.00 0.00 37.83 35.45 2fva s LYS 2 CO 0.00 -0.23 1.87 0.87 -0.92 0.00 0.00 175.35 176.95 2fva h LYS 3 N 1.61 1.17 -0.44 1.68 1.57 -2.02 -1.07 116.57 119.09 2fva h LYS 3 Ca -0.49 -0.14 0.05 0.00 -1.87 0.00 0.00 60.65 58.20 2fva h LYS 3 Cb 1.20 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 33.23 2fva h LYS 3 CO 0.60 0.86 0.19 1.05 -0.57 0.00 0.00 179.45 181.58 2fva h GLU 4 N 1.18 0.37 -0.37 3.15 4.11 -1.99 0.20 114.58 121.23 2fva h GLU 4 Ca 0.30 -0.02 -0.10 0.00 0.07 0.00 0.00 59.36 59.61 2fva h GLU 4 Cb 0.04 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 2fva h GLU 4 CO -0.05 0.24 -0.16 1.15 0.07 0.00 0.00 179.01 180.27 2fva h THR 5 N 0.38 1.28 -0.59 -1.06 2.02 -1.87 -2.46 112.91 110.62 2fva h THR 5 Ca 0.20 -1.27 -0.00 0.00 0.77 0.00 0.00 66.41 66.10 2fva h THR 5 Cb 0.15 1.33 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 2fva h THR 5 CO -0.17 0.42 0.36 0.40 0.37 0.00 0.00 175.52 176.90 2fva h ILE 6 N 0.55 1.17 -0.66 3.11 2.04 -0.75 -0.17 117.51 122.80 2fva h ILE 6 Ca 0.08 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 2fva h ILE 6 Cb 0.69 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 2fva h ILE 6 CO 0.05 0.17 0.28 -0.78 0.00 0.00 0.00 178.15 177.87 2fva h ASP 7 N 0.79 0.87 -0.20 1.72 3.58 -0.56 -1.32 116.42 121.30 2fva h ASP 7 Ca 0.21 -0.11 -0.04 0.00 0.42 0.00 0.00 57.03 57.52 2fva h ASP 7 Cb -0.03 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.79 2fva h ASP 7 CO -0.04 0.77 -0.01 0.11 -2.88 0.00 0.00 179.24 177.18 2fva h LYS 8 N 0.94 0.36 -0.37 0.28 1.79 -0.90 -1.80 116.57 116.88 2fva h LYS 8 Ca 0.23 -0.12 0.00 0.00 -2.18 0.00 0.00 60.65 58.57 2fva h LYS 8 Cb 0.15 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.76 2fva h LYS 8 CO -0.02 0.58 0.23 0.28 -1.08 0.00 0.00 179.45 179.43 2fva h VAL 9 N 0.11 1.11 -0.69 0.50 2.07 -0.77 -2.57 116.25 116.02 2fva h VAL 9 Ca 0.06 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.34 2fva h VAL 9 Cb 0.42 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 2fva h VAL 9 CO 0.01 0.11 0.44 0.28 0.02 0.00 0.00 177.57 178.44 2fva h SER 10 N 0.49 0.80 -0.59 0.57 0.02 -1.22 -2.74 113.55 110.87 2fva h SER 10 Ca 0.13 -0.03 0.08 0.00 -0.84 0.00 0.00 61.79 61.13 2fva h SER 10 Cb -0.02 -0.20 -0.07 0.00 0.14 0.00 0.00 62.40 62.25 2fva h SER 10 CO -0.03 0.59 0.24 -0.78 -1.14 0.00 0.00 176.83 175.71 2fva h ASP 11 N 0.93 0.26 -0.69 3.07 3.58 -0.94 -0.85 116.42 121.78 2fva h ASP 11 Ca 0.25 0.07 0.13 0.00 0.42 0.00 0.00 57.03 57.90 2fva h ASP 11 Cb -0.08 0.04 -0.09 0.00 1.72 0.00 0.00 39.33 40.91 2fva h ASP 11 CO -0.05 0.16 0.23 0.40 -2.88 0.00 0.00 179.24 177.10 2fva h ILE 12 N 0.43 0.65 -0.12 2.25 5.03 -1.16 1.20 117.51 125.78 2fva h ILE 12 Ca 0.29 -0.13 -0.01 0.00 -0.12 0.00 0.00 64.86 64.89 2fva h ILE 12 Cb 0.33 0.25 -0.01 0.00 -3.03 0.00 0.00 36.82 34.37 2fva h ILE 12 CO -0.28 0.07 0.03 0.58 -0.68 0.00 0.00 178.15 177.87 2fva h VAL 13 N 0.37 1.20 -0.58 1.67 2.07 -1.17 -2.69 116.25 117.12 2fva h VAL 13 Ca 0.37 -0.62 -0.08 0.00 0.82 0.00 0.00 66.70 67.19 2fva h VAL 13 Cb 0.56 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 2fva h VAL 13 CO -0.41 0.18 0.04 0.11 0.02 0.00 0.00 177.57 177.52 2fva h LYS 14 N -0.00 0.99 -0.92 1.57 1.57 -0.25 -2.88 116.57 116.65 2fva h LYS 14 Ca 0.04 -0.29 0.13 0.00 -1.87 0.00 0.00 60.65 58.66 2fva h LYS 14 Cb 0.26 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 32.39 2fva h LYS 14 CO 0.00 0.96 0.59 0.93 -0.57 0.00 0.00 179.45 181.36 2fva h GLU 15 N 0.88 0.77 -0.80 3.15 4.39 0.15 0.92 114.58 124.04 2fva h GLU 15 Ca 0.17 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.85 2fva h GLU 15 Cb 0.49 -0.17 -0.05 0.00 -0.10 0.00 0.00 28.75 28.92 2fva h GLU 15 CO 0.02 0.51 0.52 0.87 -1.16 0.00 0.00 179.01 179.77 2fva h LYS 16 N 0.79 1.00 -0.01 2.33 1.57 -1.25 -0.96 116.57 120.04 2fva h LYS 16 Ca 0.46 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 2fva h LYS 16 Cb 0.62 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.70 2fva h LYS 16 CO -0.22 0.66 -0.14 1.28 -0.57 0.00 0.00 179.45 180.46 2fva n LEU 17 N -4.57 1.34 -1.19 2.94 4.32 -0.02 -4.91 117.00 114.92 2fva n LEU 17 Ca 0.09 -0.41 -0.11 0.00 -0.02 0.00 0.00 56.01 55.56 2fva n LEU 17 Cb 0.06 -0.06 -0.01 0.00 -1.62 0.00 0.00 43.42 41.79 2fva n LEU 17 CO 0.35 0.24 -0.13 0.00 -1.22 0.00 0.00 177.39 176.62 2fva n ALA 18 N -0.19 -0.30 -1.84 -1.18 0.00 0.26 -5.02 120.51 112.24 2fva n ALA 18 Ca 0.15 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.69 2fva n ALA 18 Cb 0.37 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.45 2fva n ALA 18 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2fva n LEU 19 N -1.51 0.00 0.00 0.00 4.32 0.19 -4.69 117.00 115.31 2fva n LEU 19 Ca -0.13 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.86 2fva n LEU 19 Cb 0.57 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.37 2fva n LEU 19 CO 0.15 -0.33 0.00 0.61 -1.22 0.00 0.00 177.39 176.60 2fva n GLY 20 N 5.00 0.60 0.00 -0.72 0.00 -1.26 -4.47 105.19 104.34 2fva n GLY 20 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2fva n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fva n ALA 21 N -1.43 0.00 -1.42 4.61 0.00 -1.26 -4.63 120.51 116.38 2fva n ALA 21 Ca 0.00 -0.05 0.03 0.00 0.00 0.00 0.00 53.44 53.43 2fva n ALA 21 Cb 0.00 0.00 0.20 0.00 0.00 0.00 0.00 19.45 19.65 2fva n ALA 21 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2fva n ASP 22 N -2.06 2.24 -4.32 0.00 2.03 -1.26 -5.00 116.55 108.18 2fva n ASP 22 Ca 0.00 -3.67 -0.32 0.00 0.52 0.00 0.00 54.79 51.32 2fva n ASP 22 Cb 0.00 -0.55 -0.15 0.00 -0.72 0.00 0.00 41.12 39.69 2fva n ASP 22 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2fva s VAL 23 N -3.15 2.50 0.52 5.18 1.01 -1.26 -5.11 120.40 120.08 2fva s VAL 23 Ca 0.40 -0.89 -0.21 0.00 0.00 0.00 0.00 61.98 61.28 2fva s VAL 23 Cb 0.37 -1.97 -0.06 0.00 0.00 0.00 0.00 36.38 34.71 2fva s VAL 23 CO -0.02 0.56 1.17 -0.69 0.00 0.00 0.00 175.10 176.12 2fva s VAL 24 N -0.01 2.99 -0.07 2.92 1.01 -1.26 -4.57 120.40 121.41 2fva s VAL 24 Ca -0.06 0.67 0.04 0.00 0.00 0.00 0.00 61.98 62.63 2fva s VAL 24 Cb -0.15 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2fva s VAL 24 CO 0.05 -0.08 -0.19 0.54 0.00 0.00 0.00 175.10 175.42 2fva s VAL 25 N -1.62 1.62 0.11 2.92 0.11 -1.26 -5.02 120.40 117.26 2fva s VAL 25 Ca 0.70 -0.78 0.02 0.00 -2.93 0.00 0.00 61.98 58.99 2fva s VAL 25 Cb -0.28 -1.41 -0.04 0.00 -1.53 0.00 0.00 36.38 33.12 2fva s VAL 25 CO 0.32 0.46 -0.07 0.42 -3.33 0.00 0.00 175.10 172.90 2fva s THR 26 N 0.31 0.80 -1.62 5.04 -4.23 -1.26 -5.03 115.64 109.66 2fva s THR 26 Ca -0.12 -1.96 0.30 0.00 -1.18 0.00 0.00 61.69 58.73 2fva s THR 26 Cb -0.15 -1.72 0.60 0.00 1.34 0.00 0.00 72.50 72.57 2fva s THR 26 CO 0.05 -0.85 2.05 0.00 -0.54 0.00 0.00 174.62 175.34 2fva n ALA 27 N -0.08 2.59 -0.84 3.99 0.00 -1.26 -3.07 120.51 121.84 2fva n ALA 27 Ca -0.12 -0.19 0.08 0.00 0.00 0.00 0.00 53.44 53.22 2fva n ALA 27 Cb 0.61 -1.46 0.12 0.00 0.00 0.00 0.00 19.45 18.72 2fva n ALA 27 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2fva n ASP 28 N -1.13 2.39 0.15 0.00 5.68 -1.26 -0.92 116.55 121.47 2fva n ASP 28 Ca 0.17 -2.86 0.13 0.00 -0.50 0.00 0.00 54.79 51.73 2fva n ASP 28 Cb 0.22 -0.35 0.52 0.00 -1.14 0.00 0.00 41.12 40.37 2fva n ASP 28 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2fva h SER 29 N 0.15 0.00 -3.38 -1.12 0.02 -1.96 -3.47 113.55 103.80 2fva h SER 29 Ca 0.00 0.00 0.28 0.00 -0.84 0.00 0.00 61.79 61.23 2fva h SER 29 Cb 0.93 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.31 2fva h SER 29 CO 0.01 0.00 -1.15 -0.62 -1.14 0.00 0.00 176.83 173.94 2fva n GLU 30 N -2.37 -3.16 -3.63 3.45 1.02 -1.26 -4.83 120.64 109.85 2fva n GLU 30 Ca 0.02 2.58 -0.28 0.00 -0.02 0.00 0.00 57.16 59.46 2fva n GLU 30 Cb 0.24 -3.66 -0.11 0.00 -0.02 0.00 0.00 31.44 27.89 2fva n GLU 30 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 2fva s PHE 31 N -4.54 2.23 0.18 -0.32 -0.12 -1.26 -4.89 117.98 109.26 2fva s PHE 31 Ca 0.00 -2.79 -0.21 0.00 -0.05 0.00 0.00 56.93 53.88 2fva s PHE 31 Cb 0.00 -1.74 0.05 0.00 -0.63 0.00 0.00 43.02 40.70 2fva s PHE 31 CO 0.00 -0.70 0.59 -1.54 -0.05 0.00 0.00 175.22 173.52 2fva s SER 32 N -0.62 -0.45 -0.11 1.98 1.04 -1.26 -5.02 113.70 109.27 2fva s SER 32 Ca 0.29 -0.19 -0.09 0.00 0.48 0.00 0.00 55.95 56.43 2fva s SER 32 Cb -0.01 0.61 0.03 0.00 0.10 0.00 0.00 66.02 66.75 2fva s SER 32 CO -0.18 -1.04 0.28 -0.75 0.98 0.00 0.00 173.24 172.53 2fva s LYS 33 N -3.80 0.32 -0.10 4.02 2.20 -1.26 -5.15 119.74 115.97 2fva s LYS 33 Ca 0.04 0.40 -0.10 0.00 -0.36 0.00 0.00 55.97 55.94 2fva s LYS 33 Cb -0.02 0.14 -0.05 0.00 -1.51 0.00 0.00 37.83 36.40 2fva s LYS 33 CO -0.08 -0.05 0.23 -0.51 -0.36 0.00 0.00 175.35 174.59 2fva s LEU 34 N 0.21 4.37 0.00 5.43 1.43 -1.26 -4.08 118.68 124.78 2fva s LEU 34 Ca -0.01 0.58 0.00 0.00 -1.03 0.00 0.00 54.13 53.68 2fva s LEU 34 Cb -0.02 -2.25 0.00 0.00 0.03 0.00 0.00 46.19 43.94 2fva s LEU 34 CO -0.00 0.32 0.00 0.61 0.23 0.00 0.00 176.35 177.50 2fva n GLY 35 N 2.31 0.71 3.77 -3.19 0.00 -1.26 -5.03 105.19 102.50 2fva n GLY 35 Ca -0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 2fva n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fva s ALA 36 N -2.48 2.92 0.20 4.61 0.00 -1.26 -4.94 121.76 120.81 2fva s ALA 36 Ca 0.00 0.96 -0.10 0.00 0.00 0.00 0.00 51.96 52.83 2fva s ALA 36 Cb 0.00 -3.40 0.13 0.00 0.00 0.00 0.00 23.12 19.85 2fva s ALA 36 CO 0.00 -0.75 1.78 -0.44 0.00 0.00 0.00 175.76 176.35 2fva h ASP 37 N 1.88 0.96 -5.03 0.00 3.32 -1.95 -3.45 116.42 112.14 2fva h ASP 37 Ca -0.50 -0.15 -0.08 0.00 0.02 0.00 0.00 57.03 56.32 2fva h ASP 37 Cb 1.26 -0.25 -0.17 0.00 0.22 0.00 0.00 39.33 40.39 2fva h ASP 37 CO 0.59 0.84 -0.15 -0.55 -1.72 0.00 0.00 179.24 178.26 2fva s SER 38 N -6.18 -0.25 0.30 6.45 0.15 -1.26 -5.15 113.70 107.76 2fva s SER 38 Ca -0.13 -0.02 -0.29 0.00 0.70 0.00 0.00 55.95 56.21 2fva s SER 38 Cb 0.15 0.40 -0.09 0.00 -1.71 0.00 0.00 66.02 64.76 2fva s SER 38 CO 0.81 -0.63 1.10 -0.76 1.20 0.00 0.00 173.24 174.97 2fva s LEU 39 N -1.94 4.50 0.00 3.45 1.43 -1.26 -4.93 118.68 119.93 2fva s LEU 39 Ca -0.06 2.27 0.18 0.00 -1.03 0.00 0.00 54.13 55.49 2fva s LEU 39 Cb -0.01 -3.69 0.52 0.00 0.03 0.00 0.00 46.19 43.03 2fva s LEU 39 CO -0.02 -0.21 1.42 0.47 0.23 0.00 0.00 176.35 178.24 2fva n ASP 40 N 1.02 2.51 -0.33 2.29 8.00 -1.26 -4.31 116.55 124.47 2fva n ASP 40 Ca -0.00 -1.92 0.11 0.00 0.71 0.00 0.00 54.79 53.69 2fva n ASP 40 Cb 0.45 -0.26 0.29 0.00 -0.02 0.00 0.00 41.12 41.59 2fva n ASP 40 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2fva h THR 41 N 2.97 0.69 -0.52 -3.53 2.02 -1.95 1.44 112.91 114.04 2fva h THR 41 Ca 0.00 -0.24 -0.04 0.00 0.77 0.00 0.00 66.41 66.90 2fva h THR 41 Cb 0.67 -0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 2fva h THR 41 CO 0.00 0.13 0.18 0.58 0.37 0.00 0.00 175.52 176.78 2fva h VAL 42 N 0.70 1.23 -0.04 3.16 2.07 -1.94 0.10 116.25 121.54 2fva h VAL 42 Ca 0.55 -0.74 -0.22 0.00 0.82 0.00 0.00 66.70 67.10 2fva h VAL 42 Cb 0.85 0.73 0.02 0.00 -1.52 0.00 0.00 31.29 31.37 2fva h VAL 42 CO -0.39 0.28 -0.85 -0.08 0.02 0.00 0.00 177.57 176.54 2fva h GLU 43 N 0.71 0.64 -0.36 1.57 4.57 -1.23 -3.10 114.58 117.38 2fva h GLU 43 Ca 0.17 -0.64 -0.04 0.00 -1.18 0.00 0.00 59.36 57.66 2fva h GLU 43 Cb 0.25 0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.99 2fva h GLU 43 CO -0.01 1.25 0.06 0.82 -1.18 0.00 0.00 179.01 179.95 2fva h ILE 44 N 0.29 1.24 -0.78 2.32 1.08 0.20 -1.87 117.51 119.98 2fva h ILE 44 Ca -0.10 -0.84 -0.01 0.00 -0.39 0.00 0.00 64.86 63.52 2fva h ILE 44 Cb 1.52 1.09 -0.04 0.00 -3.07 0.00 0.00 36.82 36.32 2fva h ILE 44 CO 0.17 0.28 0.45 1.62 -0.69 0.00 0.00 178.15 179.99 2fva h VAL 45 N 0.44 1.23 -0.71 1.67 3.04 -0.90 -1.99 116.25 119.03 2fva h VAL 45 Ca 0.11 -0.53 -0.07 0.00 -1.01 0.00 0.00 66.70 65.21 2fva h VAL 45 Cb 0.36 0.16 -0.03 0.00 -2.01 0.00 0.00 31.29 29.77 2fva h VAL 45 CO 0.01 0.24 0.18 0.24 -1.01 0.00 0.00 177.57 177.23 2fva h MET 46 N 1.08 1.12 -0.50 4.17 2.86 -1.45 0.40 114.93 122.62 2fva h MET 46 Ca 0.28 -0.26 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2fva h MET 46 Cb -0.01 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.48 2fva h MET 46 CO -0.05 0.98 0.29 -0.91 1.06 0.00 0.00 176.91 178.28 2fva h ASN 47 N 1.07 0.60 -0.14 1.22 4.21 -0.81 1.13 115.58 122.85 2fva h ASN 47 Ca 0.22 -0.06 -0.08 0.00 1.21 0.00 0.00 56.30 57.59 2fva h ASN 47 Cb 0.35 -0.15 -0.00 0.00 -1.12 0.00 0.00 38.32 37.40 2fva h ASN 47 CO -0.00 0.49 -0.22 -0.07 -1.29 0.00 0.00 177.43 176.33 2fva h LEU 48 N 0.66 0.44 -0.69 1.61 3.38 -1.10 0.29 115.31 119.91 2fva h LEU 48 Ca 0.18 -0.53 -0.05 0.00 0.09 0.00 0.00 57.88 57.57 2fva h LEU 48 Cb 0.00 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 2fva h LEU 48 CO -0.03 0.89 0.25 -0.08 0.09 0.00 0.00 178.44 179.55 2fva h GLU 49 N 0.01 1.05 -0.17 1.13 4.81 0.00 0.21 114.58 121.63 2fva h GLU 49 Ca 0.01 -0.21 -0.10 0.00 -0.13 0.00 0.00 59.36 58.93 2fva h GLU 49 Cb 0.80 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.01 2fva h GLU 49 CO 0.05 0.89 -0.28 1.49 -0.73 0.00 0.00 179.01 180.43 2fva h GLU 50 N 1.00 0.49 0.71 1.92 4.57 0.14 0.50 114.58 123.91 2fva h GLU 50 Ca 0.23 -0.30 -0.03 0.00 -1.18 0.00 0.00 59.36 58.07 2fva h GLU 50 Cb 0.26 0.03 0.01 0.00 -0.16 0.00 0.00 28.75 28.88 2fva h GLU 50 CO -0.01 0.90 -0.34 1.49 -1.18 0.00 0.00 179.01 179.87 2fva h GLU 51 N 0.13 -0.92 -0.34 1.92 4.57 -0.24 -3.14 114.58 116.57 2fva h GLU 51 Ca 0.01 0.06 -0.07 0.00 -1.18 0.00 0.00 59.36 58.18 2fva h GLU 51 Cb 0.86 0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 29.64 2fva h GLU 51 CO 0.06 -0.59 -0.10 0.74 -1.18 0.00 0.00 179.01 177.95 2fva h PHE 52 N -1.15 0.63 -0.47 0.92 0.04 -0.70 -3.47 116.94 112.74 2fva h PHE 52 Ca -0.10 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.58 2fva h PHE 52 Cb 0.76 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.74 2fva h PHE 52 CO -0.00 0.67 0.00 0.41 -0.60 0.00 0.00 178.31 178.79 2fva n GLY 53 N -0.61 0.86 0.00 -1.45 0.00 0.17 -5.06 105.19 99.09 2fva n GLY 53 Ca 0.01 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.42 2fva n GLY 53 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2fva n ILE 54 N -2.57 0.00 -3.69 -0.61 -5.35 -0.63 -5.01 119.36 101.50 2fva n ILE 54 Ca 0.00 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.20 2fva n ILE 54 Cb 0.40 -0.49 -0.16 0.00 -1.74 0.00 0.00 39.64 37.65 2fva n ILE 54 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2fva s ASN 55 N -0.12 2.92 -0.18 7.28 6.03 -1.26 -4.79 114.94 124.81 2fva s ASN 55 Ca 0.00 -0.87 -0.07 0.00 -1.03 0.00 0.00 52.86 50.89 2fva s ASN 55 Cb 0.00 -0.52 -0.04 0.00 -3.03 0.00 0.00 41.25 37.66 2fva s ASN 55 CO 0.00 -0.33 0.04 -0.69 -2.03 0.00 0.00 177.10 174.09 2fva s VAL 56 N 1.92 4.53 0.31 3.54 1.01 -1.26 -5.03 120.40 125.42 2fva s VAL 56 Ca 0.01 -0.12 -0.05 0.00 0.00 0.00 0.00 61.98 61.81 2fva s VAL 56 Cb -0.17 -3.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 2fva s VAL 56 CO -0.11 0.45 0.59 -1.81 0.00 0.00 0.00 175.10 174.22 2fva s ASP 57 N 0.50 6.44 0.35 3.32 1.01 -1.26 -4.95 116.67 122.08 2fva s ASP 57 Ca 0.02 0.76 0.03 0.00 0.71 0.00 0.00 52.55 54.07 2fva s ASP 57 Cb -0.13 -2.17 0.67 0.00 1.01 0.00 0.00 42.92 42.30 2fva s ASP 57 CO 0.01 -0.24 1.99 1.05 0.21 0.00 0.00 175.17 178.20 2fva h GLU 58 N 1.53 0.81 0.00 8.23 4.11 -1.99 0.62 114.58 127.89 2fva h GLU 58 Ca -0.48 -0.05 -0.02 0.00 0.07 0.00 0.00 59.36 58.88 2fva h GLU 58 Cb 1.19 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 2fva h GLU 58 CO 0.65 0.54 -0.11 -0.44 0.07 0.00 0.00 179.01 179.72 2fva h ASP 59 N 0.83 0.00 0.62 3.06 3.32 -2.01 -2.67 116.42 119.57 2fva h ASP 59 Ca 0.26 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 57.05 2fva h ASP 59 Cb 0.02 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.52 2fva h ASP 59 CO -0.07 0.11 -1.54 0.50 -1.72 0.00 0.00 179.24 176.53 2fva h LYS 60 N 0.00 0.00 -1.64 3.56 1.63 -1.35 -3.37 116.57 115.40 2fva h LYS 60 Ca -0.00 0.00 -0.68 0.00 -0.85 0.00 0.00 60.65 59.12 2fva h LYS 60 Cb 0.55 0.00 -0.34 0.00 -0.60 0.00 0.00 32.23 31.85 2fva h LYS 60 CO 0.01 0.57 0.30 0.00 -3.45 0.00 0.00 179.45 176.89 2fva n ALA 61 N -2.50 5.90 -0.02 5.00 0.00 -0.11 -4.51 120.51 124.28 2fva n ALA 61 Ca -0.13 -4.10 -0.02 0.00 0.00 0.00 0.00 53.44 49.19 2fva n ALA 61 Cb 1.01 -1.36 -0.02 0.00 0.00 0.00 0.00 19.45 19.09 2fva n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fva n GLN 62 N -0.57 0.70 -2.91 0.00 10.64 -1.08 -4.85 117.38 119.30 2fva n GLN 62 Ca 0.49 0.02 -0.17 0.00 -1.83 0.00 0.00 57.00 55.51 2fva n GLN 62 Cb 0.48 -1.07 -0.01 0.00 -0.86 0.00 0.00 30.24 28.78 2fva n GLN 62 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 2fva n ASP 63 N -2.51 1.85 -4.70 2.61 8.00 -1.26 -5.09 116.55 115.44 2fva n ASP 63 Ca -0.06 -3.06 -0.39 0.00 0.71 0.00 0.00 54.79 51.99 2fva n ASP 63 Cb 0.57 -0.57 -0.05 0.00 -0.02 0.00 0.00 41.12 41.05 2fva n ASP 63 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2fva s ILE 64 N -3.20 5.07 0.40 0.53 -1.09 -1.26 -5.06 121.20 116.58 2fva s ILE 64 Ca 0.37 1.25 -0.07 0.00 -2.23 0.00 0.00 60.65 59.98 2fva s ILE 64 Cb 0.38 -3.96 0.10 0.00 -1.58 0.00 0.00 42.46 37.40 2fva s ILE 64 CO -0.06 0.23 0.31 -0.24 -1.23 0.00 0.00 174.94 173.96 2fva n SER 65 N 4.12 -1.72 -3.14 3.58 2.88 -1.26 -4.96 113.62 113.11 2fva n SER 65 Ca -0.03 -0.58 -0.02 0.00 -1.33 0.00 0.00 58.87 56.91 2fva n SER 65 Cb 0.51 -0.31 0.02 0.00 -0.75 0.00 0.00 64.21 63.69 2fva n SER 65 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2fva n THR 66 N -3.41 0.00 -0.21 2.46 5.66 -1.26 -4.23 114.28 113.30 2fva n THR 66 Ca 0.05 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 61.00 2fva n THR 66 Cb 0.18 -0.08 0.05 0.00 -1.55 0.00 0.00 70.33 68.94 2fva n THR 66 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 2fva h ILE 67 N -1.62 1.08 -1.29 1.09 2.04 -1.89 -1.32 117.51 115.59 2fva h ILE 67 Ca -0.03 -0.25 0.41 0.00 1.00 0.00 0.00 64.86 65.98 2fva h ILE 67 Cb 0.11 0.29 -0.12 0.00 -0.74 0.00 0.00 36.82 36.36 2fva h ILE 67 CO 0.02 0.13 0.85 1.56 0.00 0.00 0.00 178.15 180.71 2fva h GLN 68 N 0.73 0.13 0.09 2.37 1.08 -1.34 0.40 115.11 118.56 2fva h GLN 68 Ca 0.24 -0.01 -0.15 0.00 -1.45 0.00 0.00 58.65 57.28 2fva h GLN 68 Cb 0.01 -0.03 0.01 0.00 -0.05 0.00 0.00 27.48 27.42 2fva h GLN 68 CO -0.10 0.08 -0.72 0.37 -0.95 0.00 0.00 178.83 177.52 2fva h GLN 69 N 0.13 0.19 -0.65 1.46 5.75 -1.49 -3.10 115.11 117.39 2fva h GLN 69 Ca 0.77 -0.32 0.05 0.00 -0.15 0.00 0.00 58.65 59.00 2fva h GLN 69 Cb 2.42 0.12 -0.05 0.00 1.07 0.00 0.00 27.48 31.04 2fva h GLN 69 CO -0.36 1.15 0.37 0.00 -2.65 0.00 0.00 178.83 177.35 2fva h ALA 70 N -0.00 0.86 -0.28 3.38 0.00 0.16 0.24 119.26 123.62 2fva h ALA 70 Ca -0.14 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 2fva h ALA 70 Cb 1.46 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 2fva h ALA 70 CO 0.07 0.07 0.17 0.00 0.00 0.00 0.00 179.25 179.56 2fva h ALA 71 N 1.32 0.35 -0.65 0.00 0.00 -0.56 0.10 119.26 119.83 2fva h ALA 71 Ca 0.28 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 2fva h ALA 71 Cb 0.14 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2fva h ALA 71 CO -0.16 -0.15 0.21 0.22 0.00 0.00 0.00 179.25 179.37 2fva h ASP 72 N 0.36 0.93 -0.50 0.00 1.82 -1.33 -1.61 116.42 116.09 2fva h ASP 72 Ca 0.10 -0.20 -0.01 0.00 -0.39 0.00 0.00 57.03 56.52 2fva h ASP 72 Cb -0.00 -0.24 -0.02 0.00 0.68 0.00 0.00 39.33 39.74 2fva h ASP 72 CO -0.02 0.89 0.25 0.58 -1.61 0.00 0.00 179.24 179.33 2fva h VAL 73 N 0.93 1.19 -0.56 2.25 2.07 -0.23 -2.80 116.25 119.09 2fva h VAL 73 Ca 0.21 -0.50 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 2fva h VAL 73 Cb 0.28 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 2fva h VAL 73 CO -0.01 0.20 0.29 0.40 0.02 0.00 0.00 177.57 178.48 2fva h ILE 74 N 0.66 1.19 -1.09 4.57 2.04 -0.75 -2.01 117.51 122.12 2fva h ILE 74 Ca 0.17 -0.51 0.30 0.00 1.00 0.00 0.00 64.86 65.83 2fva h ILE 74 Cb 0.09 0.51 -0.06 0.00 -0.74 0.00 0.00 36.82 36.61 2fva h ILE 74 CO -0.02 0.21 0.76 -0.33 0.00 0.00 0.00 178.15 178.76 2fva h GLU 75 N 0.75 0.14 0.00 2.37 5.08 -1.03 1.16 114.58 123.05 2fva h GLU 75 Ca 0.20 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 2fva h GLU 75 Cb 0.07 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2fva h GLU 75 CO -0.03 0.09 -0.48 0.78 -1.00 0.00 0.00 179.01 178.37 2fva h GLY 76 N 0.14 0.00 1.23 -3.84 0.00 -1.31 -3.20 103.07 96.10 2fva h GLY 76 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.89 2fva h GLY 76 CO -0.12 0.00 -0.49 1.04 0.00 0.00 0.00 176.54 176.98 2fva n LEU 77 N -3.18 0.56 -0.08 3.11 4.77 0.37 -3.29 117.00 119.26 2fva n LEU 77 Ca 0.02 0.19 0.14 0.00 -0.03 0.00 0.00 56.01 56.33 2fva n LEU 77 Cb 0.71 -0.25 0.51 0.00 -2.33 0.00 0.00 43.42 42.06 2fva n LEU 77 CO 0.40 0.01 0.78 0.18 -1.33 0.00 0.00 177.39 177.42 2fva n LEU 78 N -1.84 0.43 -0.05 2.23 4.77 0.45 -4.29 117.00 118.70 2fva n LEU 78 Ca 0.05 0.08 -0.06 0.00 -0.03 0.00 0.00 56.01 56.05 2fva n LEU 78 Cb 0.39 -0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 41.21 2fva n LEU 78 CO 0.35 0.09 -0.44 -0.62 -1.33 0.00 0.00 177.39 175.43 2fva n GLU 79 N -1.16 0.34 -0.93 3.23 1.02 -1.23 -4.90 120.64 117.02 2fva n GLU 79 Ca 0.11 0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 2fva n GLU 79 Cb 0.31 -1.09 0.00 0.00 -0.02 0.00 0.00 31.44 30.64 2fva n GLU 79 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2fva n LYS 80 N -3.94 -1.18 -3.96 3.49 -0.00 -1.21 -4.73 118.16 106.65 2fva n LYS 80 Ca -0.09 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 57.91 2fva n LYS 80 Cb 0.34 -1.92 -0.15 0.00 -0.00 0.00 0.00 35.03 33.30 2fva n LYS 80 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2fva s LYS 81 N -1.58 1.32 0.00 -1.58 1.02 -1.26 -5.16 119.74 112.50 2fva s LYS 81 Ca 0.00 -1.68 0.00 0.00 0.02 0.00 0.00 55.97 54.31 2fva s LYS 81 Cb 0.00 -2.93 0.00 0.00 -0.52 0.00 0.00 37.83 34.38 2fva s LYS 81 CO 0.00 -0.94 0.00 0.00 -0.92 0.00 0.00 175.35 173.49