#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 4.12 0.23 0.00 -0.14 -1.26 -4.94 119.74 117.75 2fva s LYS 2 Ca 0.00 0.91 -0.08 0.00 -1.36 0.00 0.00 55.97 55.44 2fva s LYS 2 Cb 0.00 -2.29 0.20 0.00 -1.68 0.00 0.00 37.83 34.06 2fva s LYS 2 CO 0.00 0.05 1.87 0.87 -0.76 0.00 0.00 175.35 177.38 2fva h LYS 3 N 2.05 1.21 -0.44 1.68 1.57 -2.02 -0.56 116.57 120.05 2fva h LYS 3 Ca -0.48 -0.12 0.05 0.00 -1.87 0.00 0.00 60.65 58.23 2fva h LYS 3 Cb 1.18 -0.25 -0.05 0.00 0.08 0.00 0.00 32.23 33.19 2fva h LYS 3 CO 0.63 0.86 0.17 1.05 -0.57 0.00 0.00 179.45 181.58 2fva h GLU 4 N 1.22 0.33 -0.34 3.15 4.11 -2.00 0.99 114.58 122.04 2fva h GLU 4 Ca 0.32 -0.02 -0.11 0.00 0.07 0.00 0.00 59.36 59.62 2fva h GLU 4 Cb -0.03 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2fva h GLU 4 CO -0.06 0.22 -0.20 1.15 0.07 0.00 0.00 179.01 180.19 2fva h THR 5 N 0.34 1.29 -0.58 -1.06 2.02 -1.87 -2.80 112.91 110.25 2fva h THR 5 Ca 0.21 -1.34 0.02 0.00 0.77 0.00 0.00 66.41 66.07 2fva h THR 5 Cb 0.19 1.42 -0.04 0.00 -1.74 0.00 0.00 68.15 67.98 2fva h THR 5 CO -0.20 0.44 0.36 0.40 0.37 0.00 0.00 175.52 176.88 2fva h ILE 6 N 0.51 1.08 -0.99 3.11 2.04 -0.61 -0.26 117.51 122.39 2fva h ILE 6 Ca 0.07 -0.24 0.02 0.00 1.00 0.00 0.00 64.86 65.71 2fva h ILE 6 Cb 0.75 0.30 -0.05 0.00 -0.74 0.00 0.00 36.82 37.08 2fva h ILE 6 CO 0.06 0.13 0.65 -0.78 0.00 0.00 0.00 178.15 178.21 2fva h ASP 7 N 0.71 1.11 -0.16 1.72 3.58 -0.77 -0.21 116.42 122.41 2fva h ASP 7 Ca 0.23 -0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.64 2fva h ASP 7 Cb 0.01 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 40.78 2fva h ASP 7 CO -0.09 0.79 0.01 0.11 -2.88 0.00 0.00 179.24 177.17 2fva h LYS 8 N 1.30 0.28 -0.40 0.28 1.79 -1.08 -0.92 116.57 117.82 2fva h LYS 8 Ca 0.38 -0.09 0.02 0.00 -2.18 0.00 0.00 60.65 58.78 2fva h LYS 8 Cb -0.09 -0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.51 2fva h LYS 8 CO -0.10 0.49 0.23 0.28 -1.08 0.00 0.00 179.45 179.27 2fva h VAL 9 N 0.03 1.04 -0.87 0.50 2.07 -0.67 -1.23 116.25 117.12 2fva h VAL 9 Ca 0.05 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 2fva h VAL 9 Cb 0.36 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 2fva h VAL 9 CO 0.01 0.09 0.51 0.77 0.02 0.00 0.00 177.57 178.97 2fva h SER 10 N 0.47 1.06 -0.71 0.57 4.64 -0.99 -2.25 113.55 116.33 2fva h SER 10 Ca 0.16 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 2fva h SER 10 Cb 0.01 -0.27 -0.04 0.00 -0.31 0.00 0.00 62.40 61.80 2fva h SER 10 CO -0.08 0.82 0.40 0.44 -0.87 0.00 0.00 176.83 177.55 2fva h ASP 11 N 1.20 0.90 -0.36 4.97 3.32 -0.42 -1.99 116.42 124.04 2fva h ASP 11 Ca 0.31 -0.07 0.04 0.00 0.02 0.00 0.00 57.03 57.33 2fva h ASP 11 Cb -0.03 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.26 2fva h ASP 11 CO -0.06 0.72 0.13 0.40 -1.72 0.00 0.00 179.24 178.72 2fva h ILE 12 N 1.01 0.91 -0.41 0.35 5.03 -0.64 0.25 117.51 124.01 2fva h ILE 12 Ca 0.26 -0.10 -0.05 0.00 -0.12 0.00 0.00 64.86 64.86 2fva h ILE 12 Cb 0.02 0.60 -0.02 0.00 -3.03 0.00 0.00 36.82 34.39 2fva h ILE 12 CO -0.04 0.05 0.08 0.58 -0.68 0.00 0.00 178.15 178.14 2fva h VAL 13 N 0.28 1.24 -0.61 1.67 2.07 -1.30 -3.04 116.25 116.56 2fva h VAL 13 Ca 0.16 -0.84 -0.05 0.00 0.82 0.00 0.00 66.70 66.78 2fva h VAL 13 Cb 0.13 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 2fva h VAL 13 CO -0.16 0.29 0.18 0.11 0.02 0.00 0.00 177.57 178.01 2fva h LYS 14 N 0.53 0.96 0.00 1.57 1.57 -0.99 -2.13 116.57 118.09 2fva h LYS 14 Ca 0.13 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2fva h LYS 14 Cb 0.35 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.52 2fva h LYS 14 CO 0.01 0.86 0.16 0.93 -0.57 0.00 0.00 179.45 180.83 2fva h GLU 15 N 0.88 0.00 -0.54 3.15 4.39 -0.41 1.27 114.58 123.32 2fva h GLU 15 Ca 0.20 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.83 2fva h GLU 15 Cb 0.31 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 2fva h GLU 15 CO -0.00 0.00 0.07 0.87 -1.16 0.00 0.00 179.01 178.78 2fva h LYS 16 N 0.00 0.91 -0.01 2.33 1.79 -1.33 -3.19 116.57 117.07 2fva h LYS 16 Ca 0.00 -0.26 0.00 0.00 -2.18 0.00 0.00 60.65 58.21 2fva h LYS 16 Cb 0.31 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 2fva h LYS 16 CO 0.00 0.89 -0.04 1.47 -1.08 0.00 0.00 179.45 180.70 2fva n LEU 17 N -4.34 1.62 -1.75 2.94 -0.00 -0.24 -5.03 117.00 110.19 2fva n LEU 17 Ca 0.02 -0.95 -0.00 0.00 -0.00 0.00 0.00 56.01 55.07 2fva n LEU 17 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.70 2fva n LEU 17 CO 0.42 0.32 0.05 0.00 -0.00 0.00 0.00 177.39 178.17 2fva n ALA 18 N 0.34 -1.94 -3.59 1.47 0.00 0.42 -5.10 120.51 112.11 2fva n ALA 18 Ca 0.05 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2fva n ALA 18 Cb 0.22 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.34 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 -0.99 0.00 0.00 0.00 4.32 -0.42 -4.90 117.00 115.01 2fva n LEU 19 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2fva n LEU 19 Cb 0.41 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.21 2fva n LEU 19 CO 0.08 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.86 2fva n GLY 20 N 3.10 0.93 0.00 -0.72 0.00 -1.26 -4.63 105.19 102.61 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 -1.86 0.00 1.01 4.61 0.00 -1.26 -4.70 120.51 118.31 2fva n ALA 21 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 2fva n ALA 21 Cb 0.00 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.61 2fva n ALA 21 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2fva n ASP 22 N -0.68 2.86 -4.73 0.00 8.00 -1.26 -4.91 116.55 115.82 2fva n ASP 22 Ca 0.00 -1.94 -0.38 0.00 0.71 0.00 0.00 54.79 53.17 2fva n ASP 22 Cb 0.00 -0.02 -0.06 0.00 -0.02 0.00 0.00 41.12 41.03 2fva n ASP 22 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2fva s VAL 23 N -1.96 5.13 0.27 2.53 1.01 -1.26 -5.04 120.40 121.07 2fva s VAL 23 Ca 0.30 1.10 -0.29 0.00 0.00 0.00 0.00 61.98 63.08 2fva s VAL 23 Cb 0.20 -3.88 -0.09 0.00 0.00 0.00 0.00 36.38 32.61 2fva s VAL 23 CO 0.30 0.32 1.19 0.54 0.00 0.00 0.00 175.10 177.45 2fva s VAL 24 N 0.57 3.29 -0.12 2.92 0.11 -1.26 -4.55 120.40 121.35 2fva s VAL 24 Ca 0.29 1.23 -0.00 0.00 -2.93 0.00 0.00 61.98 60.56 2fva s VAL 24 Cb -0.16 -3.78 -0.02 0.00 -1.53 0.00 0.00 36.38 30.89 2fva s VAL 24 CO 0.13 0.26 -0.11 -0.69 -3.33 0.00 0.00 175.10 171.37 2fva s VAL 25 N -0.82 3.30 0.18 2.04 1.01 -1.26 -5.06 120.40 119.78 2fva s VAL 25 Ca 0.48 -0.59 -0.00 0.00 0.00 0.00 0.00 61.98 61.87 2fva s VAL 25 Cb -0.34 -2.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 2fva s VAL 25 CO 0.43 0.53 0.07 0.42 0.00 0.00 0.00 175.10 176.56 2fva s THR 26 N 0.08 0.23 -0.02 3.92 -4.23 -1.26 -5.06 115.64 109.31 2fva s THR 26 Ca -0.04 -1.96 -0.01 0.00 -1.18 0.00 0.00 61.69 58.49 2fva s THR 26 Cb -0.14 -2.28 -0.27 0.00 1.34 0.00 0.00 72.50 71.15 2fva s THR 26 CO 0.04 -0.26 0.78 0.00 -0.54 0.00 0.00 174.62 174.64 2fva h ALA 27 N 2.69 0.35 0.00 3.99 0.00 -1.97 -3.29 119.26 121.04 2fva h ALA 27 Ca -0.36 -1.18 0.00 0.00 0.00 0.00 0.00 54.91 53.37 2fva h ALA 27 Cb 1.22 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2fva h ALA 27 CO 0.58 1.22 0.00 -3.47 0.00 0.00 0.00 179.25 177.58 2fva n ASP 28 N -3.41 0.00 -4.55 0.00 -0.08 -1.26 -2.03 116.55 105.22 2fva n ASP 28 Ca -0.18 -0.89 -0.41 0.00 -1.51 0.00 0.00 54.79 51.80 2fva n ASP 28 Cb 1.04 -0.04 -0.03 0.00 2.34 0.00 0.00 41.12 44.44 2fva n ASP 28 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2fva s SER 29 N -2.07 6.29 -0.19 1.67 0.15 -1.24 -4.89 113.70 113.43 2fva s SER 29 Ca 0.45 -0.85 -0.41 0.00 0.70 0.00 0.00 55.95 55.85 2fva s SER 29 Cb 0.22 -2.56 -0.18 0.00 -1.71 0.00 0.00 66.02 61.79 2fva s SER 29 CO 0.38 -1.71 1.50 -0.62 1.20 0.00 0.00 173.24 174.00 2fva n GLU 30 N 9.18 0.72 -2.15 5.44 1.02 -1.26 -4.37 120.64 129.22 2fva n GLU 30 Ca 0.15 0.26 -0.41 0.00 -0.02 0.00 0.00 57.16 57.14 2fva n GLU 30 Cb 0.50 -1.87 -0.03 0.00 -0.02 0.00 0.00 31.44 30.02 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 2.08 3.14 -1.45 -0.32 -0.12 -1.26 -2.78 117.98 117.26 2fva s PHE 31 Ca 0.95 1.29 -0.11 0.00 -0.05 0.00 0.00 56.93 59.02 2fva s PHE 31 Cb -1.16 -3.66 0.05 0.00 -0.63 0.00 0.00 43.02 37.62 2fva s PHE 31 CO 0.63 -1.95 1.01 -1.13 -0.05 0.00 0.00 175.22 173.73 2fva n SER 32 N 1.71 -4.72 -0.25 1.98 3.41 -1.26 -4.87 113.62 109.63 2fva n SER 32 Ca 0.03 -0.72 -0.06 0.00 -0.26 0.00 0.00 58.87 57.86 2fva n SER 32 Cb 0.42 -4.24 0.05 0.00 -0.26 0.00 0.00 64.21 60.17 2fva n SER 32 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2fva h LYS 33 N -2.22 0.99 -0.64 4.33 3.64 -1.89 -2.76 116.57 118.02 2fva h LYS 33 Ca -0.58 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 58.63 2fva h LYS 33 Cb 1.37 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 32.98 2fva h LYS 33 CO 0.63 0.79 0.34 -0.07 -2.27 0.00 0.00 179.45 178.86 2fva h LEU 34 N 0.96 0.81 0.00 5.20 4.07 -1.89 -3.46 115.31 121.00 2fva h LEU 34 Ca 0.24 -0.11 0.00 0.00 0.08 0.00 0.00 57.88 58.09 2fva h LEU 34 Cb 0.13 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 41.66 2fva h LEU 34 CO -0.03 0.68 0.00 0.61 -1.08 0.00 0.00 178.44 178.62 2fva n GLY 35 N -1.03 0.49 0.20 0.83 0.00 -1.04 -4.87 105.19 99.77 2fva n GLY 35 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 2fva n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fva h ALA 36 N 0.00 0.53 0.00 4.61 0.00 -1.89 -2.49 119.26 120.02 2fva h ALA 36 Ca 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 2fva h ALA 36 Cb 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2fva h ALA 36 CO 0.00 0.14 -0.24 -0.44 0.00 0.00 0.00 179.25 178.71 2fva h ASP 37 N 0.52 0.00 -6.46 0.00 3.32 -1.97 -3.47 116.42 108.36 2fva h ASP 37 Ca 0.14 0.00 -0.46 0.00 0.02 0.00 0.00 57.03 56.72 2fva h ASP 37 Cb 0.19 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.78 2fva h ASP 37 CO -0.01 0.24 -0.93 -0.24 -1.72 0.00 0.00 179.24 176.58 2fva n SER 38 N -3.25 -5.07 -4.76 6.45 2.88 -0.94 -4.87 113.62 104.06 2fva n SER 38 Ca 0.02 -1.04 -0.41 0.00 -1.33 0.00 0.00 58.87 56.11 2fva n SER 38 Cb 0.53 -2.75 -0.03 0.00 -0.75 0.00 0.00 64.21 61.21 2fva n SER 38 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2fva s LEU 39 N -6.42 4.48 0.36 2.46 1.43 -1.26 -4.98 118.68 114.73 2fva s LEU 39 Ca 0.39 2.51 -0.27 0.00 -1.03 0.00 0.00 54.13 55.73 2fva s LEU 39 Cb -0.17 -3.64 -0.09 0.00 0.03 0.00 0.00 46.19 42.32 2fva s LEU 39 CO 0.89 -0.37 1.15 -1.81 0.23 0.00 0.00 176.35 176.44 2fva s ASP 40 N -0.61 6.81 0.43 2.29 1.01 -1.26 -4.92 116.67 120.42 2fva s ASP 40 Ca 0.47 2.33 0.13 0.00 0.71 0.00 0.00 52.55 56.19 2fva s ASP 40 Cb -0.36 -2.62 0.95 0.00 1.01 0.00 0.00 42.92 41.90 2fva s ASP 40 CO 0.48 -0.47 1.98 0.74 0.21 0.00 0.00 175.17 178.10 2fva h THR 41 N 2.63 1.14 -0.31 -1.27 2.02 -1.95 -1.99 112.91 113.18 2fva h THR 41 Ca -0.48 -0.65 -0.05 0.00 0.77 0.00 0.00 66.41 66.00 2fva h THR 41 Cb 1.22 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 68.91 2fva h THR 41 CO 0.64 0.19 -0.02 0.58 0.37 0.00 0.00 175.52 177.28 2fva h VAL 42 N 0.06 1.19 0.00 3.16 2.07 -1.95 0.24 116.25 121.03 2fva h VAL 42 Ca 0.01 -0.79 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 2fva h VAL 42 Cb 0.32 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2fva h VAL 42 CO 0.02 0.27 -0.00 -0.33 0.02 0.00 0.00 177.57 177.55 2fva h GLU 43 N 0.46 -0.00 -0.04 1.57 5.08 -1.75 -2.24 114.58 117.65 2fva h GLU 43 Ca 0.10 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2fva h GLU 43 Cb 0.34 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 2fva h GLU 43 CO 0.01 0.63 0.02 0.82 -1.00 0.00 0.00 179.01 179.49 2fva h ILE 44 N -0.63 1.15 -0.50 3.13 1.08 -1.37 -1.03 117.51 119.34 2fva h ILE 44 Ca -0.00 -0.46 0.00 0.00 -0.39 0.00 0.00 64.86 64.02 2fva h ILE 44 Cb 0.63 1.38 -0.02 0.00 -3.07 0.00 0.00 36.82 35.73 2fva h ILE 44 CO 0.00 0.13 0.33 1.62 -0.69 0.00 0.00 178.15 179.53 2fva h VAL 45 N -0.11 1.14 -0.66 1.67 3.04 -1.07 -2.02 116.25 118.24 2fva h VAL 45 Ca 0.01 -0.26 -0.04 0.00 -1.01 0.00 0.00 66.70 65.41 2fva h VAL 45 Cb 0.19 0.41 -0.03 0.00 -2.01 0.00 0.00 31.29 29.85 2fva h VAL 45 CO -0.00 0.13 0.26 -0.03 -1.01 0.00 0.00 177.57 176.92 2fva h MET 46 N 0.68 0.97 -0.15 4.17 1.85 -1.33 0.20 114.93 121.33 2fva h MET 46 Ca 0.18 -0.16 -0.00 0.00 -0.61 0.00 0.00 59.70 59.11 2fva h MET 46 Cb -0.06 -0.16 -0.01 0.00 0.43 0.00 0.00 31.60 31.79 2fva h MET 46 CO -0.04 0.80 0.08 -0.97 -0.40 0.00 0.00 176.91 176.38 2fva h ASN 47 N 0.95 0.19 -0.12 1.39 -0.00 -0.68 0.41 115.58 117.73 2fva h ASN 47 Ca 0.22 -0.10 -0.02 0.00 -0.00 0.00 0.00 56.30 56.40 2fva h ASN 47 Cb 0.19 -0.05 -0.00 0.00 -0.00 0.00 0.00 38.32 38.46 2fva h ASN 47 CO -0.02 0.24 0.01 -0.07 -0.00 0.00 0.00 177.43 177.60 2fva h LEU 48 N 0.13 0.20 -1.40 0.34 3.38 -1.15 0.55 115.31 117.35 2fva h LEU 48 Ca 0.05 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 2fva h LEU 48 Cb 0.10 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2fva h LEU 48 CO -0.01 0.43 0.22 -0.08 0.09 0.00 0.00 178.44 179.09 2fva h GLU 49 N -0.05 0.62 0.00 1.13 4.81 -0.87 0.20 114.58 120.44 2fva h GLU 49 Ca 0.03 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2fva h GLU 49 Cb 0.32 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.58 2fva h GLU 49 CO 0.00 0.49 -0.05 1.49 -0.73 0.00 0.00 179.01 180.21 2fva h GLU 50 N 0.63 0.03 0.59 1.92 4.57 0.04 0.15 114.58 122.51 2fva h GLU 50 Ca 0.16 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.28 2fva h GLU 50 Cb 0.06 0.01 0.01 0.00 -0.16 0.00 0.00 28.75 28.67 2fva h GLU 50 CO -0.02 0.87 -0.28 1.49 -1.18 0.00 0.00 179.01 179.89 2fva h GLU 51 N -0.80 -0.76 -0.25 1.92 4.57 0.29 -2.92 114.58 116.64 2fva h GLU 51 Ca -0.01 0.05 -0.10 0.00 -1.18 0.00 0.00 59.36 58.12 2fva h GLU 51 Cb 0.89 0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.64 2fva h GLU 51 CO 0.01 -0.50 -0.29 0.74 -1.18 0.00 0.00 179.01 177.79 2fva h PHE 52 N -0.81 0.55 -0.98 0.92 0.04 -0.75 -3.47 116.94 112.44 2fva h PHE 52 Ca -0.08 -0.13 0.00 0.00 2.80 0.00 0.00 57.97 60.56 2fva h PHE 52 Cb 0.61 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.63 2fva h PHE 52 CO -0.03 0.73 0.00 0.41 -0.60 0.00 0.00 178.31 178.82 2fva n GLY 53 N -0.30 0.93 0.00 -1.45 0.00 0.41 -5.06 105.19 99.71 2fva n GLY 53 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.18 0.00 -3.73 -0.61 -5.35 -0.50 -4.92 119.36 102.08 2fva n ILE 54 Ca 0.00 0.00 -0.27 0.00 -0.27 0.00 0.00 62.75 62.21 2fva n ILE 54 Cb 0.46 -0.21 -0.17 0.00 -1.74 0.00 0.00 39.64 37.99 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 0.44 2.74 -0.15 7.28 6.03 -1.26 -4.80 114.94 125.22 2fva s ASN 55 Ca 0.00 -0.74 -0.03 0.00 -1.03 0.00 0.00 52.86 51.07 2fva s ASN 55 Cb 0.00 -0.55 -0.02 0.00 -3.03 0.00 0.00 41.25 37.65 2fva s ASN 55 CO 0.00 -0.30 -0.07 -0.69 -2.03 0.00 0.00 177.10 174.01 2fva s VAL 56 N 1.90 3.64 0.43 3.54 1.01 -1.26 -4.84 120.40 124.82 2fva s VAL 56 Ca -0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.50 2fva s VAL 56 Cb -0.17 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 2fva s VAL 56 CO -0.08 0.50 0.69 -0.62 0.00 0.00 0.00 175.10 175.60 2fva s ASP 57 N 0.34 6.28 0.23 3.32 2.15 -1.26 -4.96 116.67 122.77 2fva s ASP 57 Ca -0.06 0.74 -0.05 0.00 0.43 0.00 0.00 52.55 53.61 2fva s ASP 57 Cb -0.15 -2.16 0.24 0.00 -0.30 0.00 0.00 42.92 40.55 2fva s ASP 57 CO 0.04 -0.47 1.74 -0.33 -0.17 0.00 0.00 175.17 175.98 2fva h GLU 58 N 0.43 0.95 0.00 4.34 3.07 -2.00 -0.87 114.58 120.50 2fva h GLU 58 Ca -0.48 -0.24 0.00 0.00 -0.50 0.00 0.00 59.36 58.14 2fva h GLU 58 Cb 1.21 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 29.00 2fva h GLU 58 CO 0.62 0.89 0.00 0.22 -1.40 0.00 0.00 179.01 179.33 2fva h ASP 59 N 0.90 0.00 0.40 1.42 3.58 -2.01 -2.36 116.42 118.34 2fva h ASP 59 Ca 0.18 0.00 -0.29 0.00 0.42 0.00 0.00 57.03 57.35 2fva h ASP 59 Cb 0.41 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.41 2fva h ASP 59 CO 0.01 0.00 -1.83 1.17 -2.88 0.00 0.00 179.24 175.71 2fva n LYS 60 N -2.73 0.64 -2.20 0.28 3.00 -0.66 -4.31 118.16 112.19 2fva n LYS 60 Ca 0.00 0.21 -0.33 0.00 -0.00 0.00 0.00 58.31 58.19 2fva n LYS 60 Cb 0.22 -1.73 0.02 0.00 0.00 0.00 0.00 35.03 33.54 2fva n LYS 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2fva n ALA 61 N -2.57 5.72 -0.01 3.14 0.00 -0.42 -4.53 120.51 121.84 2fva n ALA 61 Ca -0.19 -4.21 -0.01 0.00 0.00 0.00 0.00 53.44 49.03 2fva n ALA 61 Cb 1.04 -1.19 -0.02 0.00 0.00 0.00 0.00 19.45 19.27 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 -0.52 3.46 -3.00 0.00 10.64 -1.03 -4.86 117.38 122.06 2fva n GLN 62 Ca 0.46 -0.00 -0.14 0.00 -1.83 0.00 0.00 57.00 55.49 2fva n GLN 62 Cb 0.48 -1.07 0.02 0.00 -0.86 0.00 0.00 30.24 28.81 2fva n GLN 62 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 2fva n ASP 63 N -2.12 -0.33 -4.71 2.61 -0.08 -1.26 -5.11 116.55 105.55 2fva n ASP 63 Ca -0.05 -3.23 -0.39 0.00 -1.51 0.00 0.00 54.79 49.61 2fva n ASP 63 Cb 0.59 0.32 -0.05 0.00 2.34 0.00 0.00 41.12 44.32 2fva n ASP 63 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2fva s ILE 64 N -1.45 5.09 0.05 5.18 -1.09 -1.26 -5.07 121.20 122.66 2fva s ILE 64 Ca 0.33 1.24 -0.01 0.00 -2.23 0.00 0.00 60.65 59.98 2fva s ILE 64 Cb 0.33 -3.95 0.01 0.00 -1.58 0.00 0.00 42.46 37.28 2fva s ILE 64 CO -0.07 0.26 0.04 -0.24 -1.23 0.00 0.00 174.94 173.70 2fva n SER 65 N 3.91 -1.64 -3.22 3.58 2.88 -1.26 -4.95 113.62 112.91 2fva n SER 65 Ca -0.03 -0.24 -0.04 0.00 -1.33 0.00 0.00 58.87 57.23 2fva n SER 65 Cb 0.51 -0.04 0.03 0.00 -0.75 0.00 0.00 64.21 63.97 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 -2.89 0.00 -0.33 2.46 5.66 -1.26 -4.30 114.28 113.61 2fva n THR 66 Ca 0.01 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 60.99 2fva n THR 66 Cb 0.02 -0.12 0.11 0.00 -1.55 0.00 0.00 70.33 68.80 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 -1.76 1.18 -0.86 1.09 2.04 -1.72 -2.52 117.51 114.96 2fva h ILE 67 Ca -0.05 -0.40 0.11 0.00 1.00 0.00 0.00 64.86 65.52 2fva h ILE 67 Cb 0.16 -0.10 -0.13 0.00 -0.74 0.00 0.00 36.82 36.01 2fva h ILE 67 CO 0.03 0.21 -0.47 1.56 0.00 0.00 0.00 178.15 179.48 2fva h GLN 68 N 1.17 -0.08 -0.33 2.37 1.08 -1.71 0.95 115.11 118.57 2fva h GLN 68 Ca 0.35 0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.51 2fva h GLN 68 Cb -0.05 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.38 2fva h GLN 68 CO -0.10 -0.05 0.03 1.96 -0.95 0.00 0.00 178.83 179.72 2fva h GLN 69 N -0.08 0.57 -0.51 1.46 1.08 -1.78 -1.97 115.11 113.88 2fva h GLN 69 Ca 0.23 -0.17 0.07 0.00 -1.45 0.00 0.00 58.65 57.34 2fva h GLN 69 Cb 0.53 -0.06 -0.06 0.00 -0.05 0.00 0.00 27.48 27.84 2fva h GLN 69 CO -0.87 0.67 0.18 0.00 -0.95 0.00 0.00 178.83 177.85 2fva h ALA 70 N 0.87 0.63 -0.69 3.87 0.00 -0.40 0.29 119.26 123.83 2fva h ALA 70 Ca 0.10 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 2fva h ALA 70 Cb 0.40 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2fva h ALA 70 CO 0.01 -0.22 0.27 0.00 0.00 0.00 0.00 179.25 179.30 2fva h ALA 71 N 1.35 0.90 -0.60 0.00 0.00 0.91 -1.32 119.26 120.49 2fva h ALA 71 Ca 0.25 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 2fva h ALA 71 Cb 0.28 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2fva h ALA 71 CO -0.26 0.53 0.08 0.22 0.00 0.00 0.00 179.25 179.81 2fva h ASP 72 N 0.98 0.98 -0.54 0.00 1.82 -0.50 -1.84 116.42 117.32 2fva h ASP 72 Ca 0.23 -0.27 -0.04 0.00 -0.39 0.00 0.00 57.03 56.56 2fva h ASP 72 Cb 0.22 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 39.95 2fva h ASP 72 CO -0.02 1.00 0.18 0.58 -1.61 0.00 0.00 179.24 179.37 2fva h VAL 73 N 0.92 1.23 -0.56 2.25 2.07 -0.20 -2.89 116.25 119.07 2fva h VAL 73 Ca 0.18 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 66.91 2fva h VAL 73 Cb 0.45 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 2fva h VAL 73 CO 0.02 0.29 0.26 0.40 0.02 0.00 0.00 177.57 178.55 2fva h ILE 74 N 0.74 1.21 -0.64 4.57 2.04 -1.08 -2.80 117.51 121.54 2fva h ILE 74 Ca 0.17 -0.59 0.14 0.00 1.00 0.00 0.00 64.86 65.58 2fva h ILE 74 Cb 0.26 0.57 -0.11 0.00 -0.74 0.00 0.00 36.82 36.80 2fva h ILE 74 CO -0.01 0.23 -0.06 -0.33 0.00 0.00 0.00 178.15 177.99 2fva h GLU 75 N 0.75 0.06 0.00 2.37 5.08 -1.12 0.65 114.58 122.37 2fva h GLU 75 Ca 0.19 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.52 2fva h GLU 75 Cb 0.13 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 2fva h GLU 75 CO -0.02 0.04 -0.13 0.78 -1.00 0.00 0.00 179.01 178.68 2fva h GLY 76 N 0.07 0.00 1.78 -3.84 0.00 -1.41 -0.40 103.07 99.26 2fva h GLY 76 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 2fva h GLY 76 CO -0.60 0.00 -0.12 1.04 0.00 0.00 0.00 176.54 176.86 2fva n LEU 77 N -4.18 0.26 0.06 3.11 4.77 0.20 -3.19 117.00 118.03 2fva n LEU 77 Ca -0.02 0.41 0.11 0.00 -0.03 0.00 0.00 56.01 56.48 2fva n LEU 77 Cb 0.21 -0.41 -0.03 0.00 -2.33 0.00 0.00 43.42 40.86 2fva n LEU 77 CO 0.34 -0.01 -0.15 0.18 -1.33 0.00 0.00 177.39 176.42 2fva n LEU 78 N -1.66 0.59 0.21 2.23 4.77 0.27 -3.64 117.00 119.77 2fva n LEU 78 Ca 0.06 0.17 -0.17 0.00 -0.03 0.00 0.00 56.01 56.04 2fva n LEU 78 Cb 0.36 -0.06 -0.10 0.00 -2.33 0.00 0.00 43.42 41.29 2fva n LEU 78 CO 0.29 -0.09 0.52 -0.33 -1.33 0.00 0.00 177.39 176.46 2fva h GLU 79 N 0.00 -0.85 0.00 3.23 4.39 -1.41 -3.43 114.58 116.52 2fva h GLU 79 Ca 0.00 0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.76 2fva h GLU 79 Cb 0.93 0.19 0.00 0.00 -0.10 0.00 0.00 28.75 29.77 2fva h GLU 79 CO 0.00 -0.56 0.00 0.36 -1.16 0.00 0.00 179.01 177.65 2fva n LYS 80 N -5.41 0.00 -2.93 2.33 -0.00 -1.26 -5.11 118.16 105.79 2fva n LYS 80 Ca -0.10 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 57.80 2fva n LYS 80 Cb 0.43 0.00 -0.04 0.00 -0.00 0.00 0.00 35.03 35.42 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 0.00 4.37 0.00 -1.58 -0.14 -1.24 -5.13 119.74 116.01 2fva s LYS 81 Ca 0.00 1.00 0.00 0.00 -1.36 0.00 0.00 55.97 55.61 2fva s LYS 81 Cb 0.00 -3.52 0.00 0.00 -1.68 0.00 0.00 37.83 32.63 2fva s LYS 81 CO 0.00 -0.17 0.00 0.00 -0.76 0.00 0.00 175.35 174.42