#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 3.73 0.28 0.00 1.02 -1.26 -4.97 119.74 118.54 2fva s LYS 2 Ca 0.00 0.14 -0.03 0.00 0.02 0.00 0.00 55.97 56.10 2fva s LYS 2 Cb 0.00 -2.70 0.38 0.00 -0.52 0.00 0.00 37.83 35.00 2fva s LYS 2 CO 0.00 0.34 1.94 0.87 -0.92 0.00 0.00 175.35 177.58 2fva h LYS 3 N 2.46 1.14 -0.46 1.68 1.57 -2.02 0.03 116.57 120.97 2fva h LYS 3 Ca -0.47 -0.08 0.03 0.00 -1.87 0.00 0.00 60.65 58.26 2fva h LYS 3 Cb 1.17 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 33.20 2fva h LYS 3 CO 0.69 0.77 0.25 1.05 -0.57 0.00 0.00 179.45 181.65 2fva h GLU 4 N 1.16 0.48 -0.28 3.15 4.11 -1.99 0.24 114.58 121.46 2fva h GLU 4 Ca 0.31 -0.03 -0.15 0.00 0.07 0.00 0.00 59.36 59.56 2fva h GLU 4 Cb -0.10 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.04 2fva h GLU 4 CO -0.06 0.32 -0.41 1.15 0.07 0.00 0.00 179.01 180.08 2fva h THR 5 N 0.50 1.30 -0.52 -1.06 2.02 -1.84 -2.55 112.91 110.76 2fva h THR 5 Ca 0.19 -1.60 -0.01 0.00 0.77 0.00 0.00 66.41 65.76 2fva h THR 5 Cb 0.06 1.65 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 2fva h THR 5 CO -0.11 0.52 0.30 0.40 0.37 0.00 0.00 175.52 176.99 2fva h ILE 6 N 0.52 1.17 -0.76 3.11 2.04 -0.66 -0.51 117.51 122.42 2fva h ILE 6 Ca 0.03 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.44 2fva h ILE 6 Cb 1.01 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 2fva h ILE 6 CO 0.10 0.18 0.37 -0.78 0.00 0.00 0.00 178.15 178.02 2fva h ASP 7 N 0.70 0.97 -0.24 1.72 3.58 -0.52 -1.22 116.42 121.40 2fva h ASP 7 Ca 0.18 -0.10 -0.03 0.00 0.42 0.00 0.00 57.03 57.51 2fva h ASP 7 Cb 0.03 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.82 2fva h ASP 7 CO -0.03 0.81 0.05 0.11 -2.88 0.00 0.00 179.24 177.29 2fva h LYS 8 N 1.07 0.40 -0.37 0.28 1.79 -0.98 -2.03 116.57 116.73 2fva h LYS 8 Ca 0.26 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 2fva h LYS 8 Cb 0.09 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.67 2fva h LYS 8 CO -0.04 0.52 0.23 0.28 -1.08 0.00 0.00 179.45 179.36 2fva h VAL 9 N 0.21 1.11 -0.47 0.50 2.07 -0.76 -2.10 116.25 116.81 2fva h VAL 9 Ca 0.07 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.40 2fva h VAL 9 Cb 0.31 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 2fva h VAL 9 CO 0.00 0.11 0.25 0.77 0.02 0.00 0.00 177.57 178.72 2fva h SER 10 N 0.49 0.37 -0.71 0.57 4.64 -1.15 -2.16 113.55 115.60 2fva h SER 10 Ca 0.13 0.02 0.07 0.00 -0.47 0.00 0.00 61.79 61.54 2fva h SER 10 Cb -0.02 -0.05 -0.06 0.00 -0.31 0.00 0.00 62.40 61.95 2fva h SER 10 CO -0.03 0.26 0.39 -0.78 -0.87 0.00 0.00 176.83 175.81 2fva h ASP 11 N 0.49 0.58 -0.47 4.97 1.82 -1.03 -0.45 116.42 122.33 2fva h ASP 11 Ca 0.20 0.03 0.05 0.00 -0.39 0.00 0.00 57.03 56.93 2fva h ASP 11 Cb 0.08 -0.08 -0.05 0.00 0.68 0.00 0.00 39.33 39.97 2fva h ASP 11 CO -0.13 0.37 0.19 0.40 -1.61 0.00 0.00 179.24 178.46 2fva h ILE 12 N 0.71 0.89 -0.46 2.25 5.03 -0.76 -0.26 117.51 124.91 2fva h ILE 12 Ca 0.32 -0.13 -0.05 0.00 -0.12 0.00 0.00 64.86 64.88 2fva h ILE 12 Cb 0.22 0.47 -0.02 0.00 -3.03 0.00 0.00 36.82 34.46 2fva h ILE 12 CO -0.20 0.07 0.10 0.58 -0.68 0.00 0.00 178.15 178.03 2fva h VAL 13 N 0.39 1.24 -0.84 1.67 2.07 -0.84 -2.91 116.25 117.03 2fva h VAL 13 Ca 0.22 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 2fva h VAL 13 Cb 0.19 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 2fva h VAL 13 CO -0.20 0.30 0.47 0.11 0.02 0.00 0.00 177.57 178.27 2fva h LYS 14 N 0.62 1.16 0.00 1.57 1.57 -0.60 -1.49 116.57 119.40 2fva h LYS 14 Ca 0.14 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2fva h LYS 14 Cb 0.34 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 2fva h LYS 14 CO 0.00 0.84 -0.02 0.93 -0.57 0.00 0.00 179.45 180.63 2fva h GLU 15 N 1.17 0.00 -0.47 3.15 5.08 -0.86 0.62 114.58 123.26 2fva h GLU 15 Ca 0.30 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.62 2fva h GLU 15 Cb 0.01 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2fva h GLU 15 CO -0.05 0.02 0.14 0.87 -1.00 0.00 0.00 179.01 178.99 2fva h LYS 16 N 0.00 0.74 -0.26 2.33 1.79 -1.20 -2.92 116.57 117.06 2fva h LYS 16 Ca -0.00 -0.16 0.00 0.00 -2.18 0.00 0.00 60.65 58.31 2fva h LYS 16 Cb 0.10 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2fva h LYS 16 CO 0.00 0.71 0.00 1.47 -1.08 0.00 0.00 179.45 180.55 2fva n LEU 17 N -4.52 2.97 -2.22 2.94 -0.00 -0.88 -4.99 117.00 110.31 2fva n LEU 17 Ca 0.01 -1.42 -0.05 0.00 -0.00 0.00 0.00 56.01 54.55 2fva n LEU 17 Cb 0.19 -0.16 0.02 0.00 -0.00 0.00 0.00 43.42 43.48 2fva n LEU 17 CO 0.39 0.63 0.03 0.00 -0.00 0.00 0.00 177.39 178.44 2fva n ALA 18 N 1.11 -1.42 -3.49 1.47 0.00 0.10 -5.08 120.51 113.21 2fva n ALA 18 Ca 0.14 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2fva n ALA 18 Cb 0.50 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.54 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 -2.09 0.00 0.00 0.00 4.32 0.18 -4.89 117.00 114.52 2fva n LEU 19 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.97 2fva n LEU 19 Cb 0.54 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.34 2fva n LEU 19 CO 0.24 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.02 2fva n GLY 20 N 4.69 0.90 0.00 -0.72 0.00 -1.26 -4.51 105.19 104.30 2fva n GLY 20 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.46 0.00 -0.56 4.61 0.00 -1.26 -4.76 120.51 117.08 2fva n ALA 21 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 2fva n ALA 21 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.56 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 -0.51 2.51 -4.74 0.00 8.00 -1.26 -5.01 116.55 115.54 2fva n ASP 22 Ca 0.00 -2.55 -0.39 0.00 0.71 0.00 0.00 54.79 52.57 2fva n ASP 22 Cb 0.00 -0.27 -0.05 0.00 -0.02 0.00 0.00 41.12 40.78 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 -1.95 5.04 0.44 2.53 1.01 -1.26 -5.04 120.40 121.17 2fva s VAL 23 Ca 0.21 1.20 -0.25 0.00 0.00 0.00 0.00 61.98 63.13 2fva s VAL 23 Cb 0.17 -3.92 -0.08 0.00 0.00 0.00 0.00 36.38 32.55 2fva s VAL 23 CO 0.04 0.34 1.34 -0.69 0.00 0.00 0.00 175.10 176.14 2fva s VAL 24 N 0.34 2.42 -0.08 2.92 1.01 -1.26 -4.76 120.40 120.99 2fva s VAL 24 Ca 0.31 0.36 0.04 0.00 0.00 0.00 0.00 61.98 62.70 2fva s VAL 24 Cb -0.17 -3.21 -0.00 0.00 0.00 0.00 0.00 36.38 33.00 2fva s VAL 24 CO 0.15 0.04 -0.23 0.54 0.00 0.00 0.00 175.10 175.61 2fva s VAL 25 N -1.27 1.91 0.03 2.92 0.11 -1.26 -5.08 120.40 117.77 2fva s VAL 25 Ca 0.60 -0.95 -0.01 0.00 -2.93 0.00 0.00 61.98 58.69 2fva s VAL 25 Cb -0.39 -1.65 -0.03 0.00 -1.53 0.00 0.00 36.38 32.78 2fva s VAL 25 CO 0.50 0.53 -0.03 0.42 -3.33 0.00 0.00 175.10 173.20 2fva s THR 26 N 0.23 0.15 0.18 5.04 -4.23 -1.26 -5.03 115.64 110.72 2fva s THR 26 Ca -0.14 -1.25 0.25 0.00 -1.18 0.00 0.00 61.69 59.37 2fva s THR 26 Cb -0.16 -0.75 0.24 0.00 1.34 0.00 0.00 72.50 73.17 2fva s THR 26 CO 0.07 -0.69 1.86 0.00 -0.54 0.00 0.00 174.62 175.32 2fva h ALA 27 N 4.06 1.06 -0.52 3.99 0.00 -1.97 -2.56 119.26 123.31 2fva h ALA 27 Ca -0.33 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2fva h ALA 27 Cb 1.18 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2fva h ALA 27 CO 0.51 0.26 0.00 -0.40 0.00 0.00 0.00 179.25 179.62 2fva n ASP 28 N -3.43 5.14 0.07 0.00 5.68 -1.26 -1.56 116.55 121.19 2fva n ASP 28 Ca -0.00 -2.85 0.08 0.00 -0.50 0.00 0.00 54.79 51.52 2fva n ASP 28 Cb 0.40 -0.63 0.36 0.00 -1.14 0.00 0.00 41.12 40.11 2fva n ASP 28 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 2fva n SER 29 N 0.47 0.31 -2.82 -1.12 2.88 -0.97 -4.93 113.62 107.45 2fva n SER 29 Ca 0.26 0.60 -0.04 0.00 -1.33 0.00 0.00 58.87 58.36 2fva n SER 29 Cb 1.07 -0.66 0.00 0.00 -0.75 0.00 0.00 64.21 63.88 2fva n SER 29 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2fva n GLU 30 N -1.87 -2.92 0.12 -1.46 1.02 -1.26 -4.68 120.64 109.59 2fva n GLU 30 Ca 0.02 2.43 0.03 0.00 -0.02 0.00 0.00 57.16 59.62 2fva n GLU 30 Cb 0.14 -5.08 0.18 0.00 -0.02 0.00 0.00 31.44 26.66 2fva n GLU 30 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 2fva n PHE 31 N 0.42 0.23 -3.71 -0.32 1.16 -1.26 -4.40 117.46 109.57 2fva n PHE 31 Ca 0.03 0.12 -0.13 0.00 -1.87 0.00 0.00 57.45 55.60 2fva n PHE 31 Cb 0.19 -0.39 -0.08 0.00 -1.61 0.00 0.00 39.48 37.60 2fva n PHE 31 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 2fva s SER 32 N -2.94 -0.25 0.00 5.98 1.04 -1.26 -5.10 113.70 111.18 2fva s SER 32 Ca -0.01 0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.51 2fva s SER 32 Cb 0.02 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.50 2fva s SER 32 CO 0.06 -0.54 0.00 0.29 0.98 0.00 0.00 173.24 174.04 2fva n LYS 33 N 0.97 0.00 -0.20 4.02 4.76 -1.26 -4.65 118.16 121.80 2fva n LYS 33 Ca -0.20 0.08 -0.07 0.00 -2.87 0.00 0.00 58.31 55.24 2fva n LYS 33 Cb 0.57 -0.40 0.03 0.00 -1.84 0.00 0.00 35.03 33.39 2fva n LYS 33 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 2fva h LEU 34 N 0.00 0.75 0.00 -0.35 5.85 -1.99 -3.47 115.31 116.10 2fva h LEU 34 Ca 0.00 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.60 2fva h LEU 34 Cb 0.00 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.84 2fva h LEU 34 CO 0.00 0.66 0.00 0.61 -0.34 0.00 0.00 178.44 179.37 2fva n GLY 35 N -0.96 0.39 0.09 3.75 0.00 -1.26 -4.79 105.19 102.41 2fva n GLY 35 Ca 0.03 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.02 2fva n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fva n ALA 36 N 0.96 1.02 -0.26 4.61 0.00 -1.26 -4.96 120.51 120.62 2fva n ALA 36 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 2fva n ALA 36 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.50 2fva n ALA 36 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2fva h ASP 37 N 0.00 1.00 -5.04 0.00 1.82 -1.99 -3.46 116.42 108.75 2fva h ASP 37 Ca 0.00 -0.18 0.04 0.00 -0.39 0.00 0.00 57.03 56.49 2fva h ASP 37 Cb 0.84 -0.26 -0.07 0.00 0.68 0.00 0.00 39.33 40.52 2fva h ASP 37 CO 0.00 0.91 0.16 -0.94 -1.61 0.00 0.00 179.24 177.77 2fva s SER 38 N -6.28 -0.27 0.00 2.28 1.04 -1.26 -5.14 113.70 104.08 2fva s SER 38 Ca -0.12 -0.58 0.00 0.00 0.48 0.00 0.00 55.95 55.72 2fva s SER 38 Cb 0.14 0.69 0.00 0.00 0.10 0.00 0.00 66.02 66.95 2fva s SER 38 CO 0.82 -1.26 0.00 0.18 0.98 0.00 0.00 173.24 173.96 2fva n LEU 39 N -0.43 0.00 0.00 2.42 4.32 -1.26 -4.70 117.00 117.35 2fva n LEU 39 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.94 2fva n LEU 39 Cb 0.60 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.40 2fva n LEU 39 CO 0.16 0.00 0.00 -0.67 -1.22 0.00 0.00 177.39 175.66 2fva n ASP 40 N 0.00 0.00 -0.31 -1.43 2.03 -1.26 -4.74 116.55 110.85 2fva n ASP 40 Ca 0.00 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.28 2fva n ASP 40 Cb 0.00 -1.96 0.12 0.00 -0.72 0.00 0.00 41.12 38.56 2fva n ASP 40 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 2fva h THR 41 N 0.00 1.25 -0.47 5.18 2.02 -1.95 -1.83 112.91 117.11 2fva h THR 41 Ca 0.00 -0.61 0.03 0.00 0.77 0.00 0.00 66.41 66.60 2fva h THR 41 Cb 0.00 0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 66.46 2fva h THR 41 CO 0.00 0.28 0.31 0.58 0.37 0.00 0.00 175.52 177.06 2fva h VAL 42 N 1.21 1.05 -0.09 3.16 2.07 -1.94 0.19 116.25 121.90 2fva h VAL 42 Ca 0.31 -0.18 -0.06 0.00 0.82 0.00 0.00 66.70 67.58 2fva h VAL 42 Cb 0.02 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2fva h VAL 42 CO -0.05 0.10 -0.20 -0.33 0.02 0.00 0.00 177.57 177.11 2fva h GLU 43 N 0.53 0.29 -0.14 1.57 5.08 -1.73 -2.64 114.58 117.53 2fva h GLU 43 Ca 0.19 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2fva h GLU 43 Cb 0.09 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 2fva h GLU 43 CO -0.05 0.79 -0.00 0.82 -1.00 0.00 0.00 179.01 179.58 2fva h ILE 44 N -0.18 1.25 -0.55 3.13 1.08 -1.03 -1.48 117.51 119.73 2fva h ILE 44 Ca -0.00 -0.83 0.00 0.00 -0.39 0.00 0.00 64.86 63.64 2fva h ILE 44 Cb 0.79 1.54 -0.03 0.00 -3.07 0.00 0.00 36.82 36.06 2fva h ILE 44 CO 0.04 0.24 0.35 1.62 -0.69 0.00 0.00 178.15 179.72 2fva h VAL 45 N -0.03 1.15 -0.70 1.67 3.04 -1.08 -0.70 116.25 119.60 2fva h VAL 45 Ca 0.04 -0.29 -0.07 0.00 -1.01 0.00 0.00 66.70 65.37 2fva h VAL 45 Cb 0.37 0.36 -0.03 0.00 -2.01 0.00 0.00 31.29 29.98 2fva h VAL 45 CO 0.01 0.14 0.16 0.24 -1.01 0.00 0.00 177.57 177.11 2fva h MET 46 N 0.74 1.12 -0.35 4.17 2.86 -1.45 0.40 114.93 122.42 2fva h MET 46 Ca 0.20 -0.27 -0.02 0.00 -2.06 0.00 0.00 59.70 57.55 2fva h MET 46 Cb -0.07 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.43 2fva h MET 46 CO -0.04 0.99 0.16 -0.97 1.06 0.00 0.00 176.91 178.11 2fva h ASN 47 N 1.06 0.47 -0.33 1.22 -0.00 -0.78 1.15 115.58 118.36 2fva h ASN 47 Ca 0.22 -0.14 -0.08 0.00 -0.00 0.00 0.00 56.30 56.29 2fva h ASN 47 Cb 0.38 -0.12 -0.01 0.00 -0.00 0.00 0.00 38.32 38.57 2fva h ASN 47 CO 0.00 0.48 -0.12 -0.07 -0.00 0.00 0.00 177.43 177.73 2fva h LEU 48 N 0.42 0.68 -0.45 0.34 3.38 -0.89 0.39 115.31 119.18 2fva h LEU 48 Ca 0.12 -0.38 -0.09 0.00 0.09 0.00 0.00 57.88 57.62 2fva h LEU 48 Cb 0.15 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2fva h LEU 48 CO -0.01 0.91 -0.05 -0.08 0.09 0.00 0.00 178.44 179.29 2fva h GLU 49 N 0.44 0.83 -0.32 1.13 4.81 -0.01 -0.87 114.58 120.60 2fva h GLU 49 Ca 0.08 -0.29 -0.12 0.00 -0.13 0.00 0.00 59.36 58.90 2fva h GLU 49 Cb 0.63 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 2fva h GLU 49 CO 0.04 0.92 -0.26 1.49 -0.73 0.00 0.00 179.01 180.47 2fva h GLU 50 N 0.68 0.73 -0.15 1.92 4.81 0.14 1.89 114.58 124.60 2fva h GLU 50 Ca 0.12 -0.36 -0.00 0.00 -0.13 0.00 0.00 59.36 58.98 2fva h GLU 50 Cb 0.57 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 2fva h GLU 50 CO 0.03 0.98 0.08 1.49 -0.73 0.00 0.00 179.01 180.86 2fva h GLU 51 N 0.49 0.21 -0.00 1.92 4.57 -0.12 -2.78 114.58 118.87 2fva h GLU 51 Ca 0.06 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 2fva h GLU 51 Cb 0.82 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.37 2fva h GLU 51 CO 0.07 0.24 -0.40 1.19 -1.18 0.00 0.00 179.01 178.92 2fva n PHE 52 N -4.92 0.00 -3.16 0.92 3.72 -0.34 -4.94 117.46 108.74 2fva n PHE 52 Ca -0.05 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.13 2fva n PHE 52 Cb 0.08 -0.20 0.03 0.00 -0.94 0.00 0.00 39.48 38.45 2fva n PHE 52 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2fva n GLY 53 N 1.43 -0.51 0.00 1.37 0.00 0.63 -4.88 105.19 103.23 2fva n GLY 53 Ca 0.08 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 -4.39 0.00 -3.71 -0.61 -5.35 -0.31 -4.73 119.36 100.26 2fva n ILE 54 Ca -0.08 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.12 2fva n ILE 54 Cb 0.59 -0.62 -0.16 0.00 -1.74 0.00 0.00 39.64 37.72 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 -1.00 3.00 -0.23 7.28 6.03 -1.26 -4.83 114.94 123.93 2fva s ASN 55 Ca 0.00 -0.91 -0.07 0.00 -1.03 0.00 0.00 52.86 50.85 2fva s ASN 55 Cb 0.00 -0.57 -0.03 0.00 -3.03 0.00 0.00 41.25 37.62 2fva s ASN 55 CO 0.00 -0.33 0.05 -0.69 -2.03 0.00 0.00 177.10 174.10 2fva s VAL 56 N 1.88 4.22 0.27 3.54 1.01 -1.26 -4.98 120.40 125.08 2fva s VAL 56 Ca 0.01 -0.21 -0.21 0.00 0.00 0.00 0.00 61.98 61.58 2fva s VAL 56 Cb -0.17 -2.95 -0.09 0.00 0.00 0.00 0.00 36.38 33.17 2fva s VAL 56 CO -0.12 0.37 0.79 -1.81 0.00 0.00 0.00 175.10 174.34 2fva s ASP 57 N 1.37 7.08 0.54 3.32 1.01 -1.26 -4.92 116.67 123.80 2fva s ASP 57 Ca 0.05 1.51 0.27 0.00 0.71 0.00 0.00 52.55 55.09 2fva s ASP 57 Cb -0.15 -2.46 1.49 0.00 1.01 0.00 0.00 42.92 42.82 2fva s ASP 57 CO 0.03 -0.04 1.82 -0.33 0.21 0.00 0.00 175.17 176.85 2fva h GLU 58 N 3.12 0.00 0.00 8.23 5.08 -1.99 0.74 114.58 129.77 2fva h GLU 58 Ca -0.48 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.80 2fva h GLU 58 Cb 1.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 2fva h GLU 58 CO 0.65 0.00 -0.56 -0.44 -1.00 0.00 0.00 179.01 177.66 2fva h ASP 59 N 0.00 0.00 0.39 1.42 3.32 -2.01 -3.20 116.42 116.34 2fva h ASP 59 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2fva h ASP 59 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 2fva h ASP 59 CO 0.00 0.35 -0.87 0.29 -1.72 0.00 0.00 179.24 177.29 2fva n LYS 60 N -3.10 0.16 -2.32 3.56 4.76 0.25 -4.21 118.16 117.27 2fva n LYS 60 Ca 0.01 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.21 2fva n LYS 60 Cb 0.69 -1.55 0.01 0.00 -1.84 0.00 0.00 35.03 32.33 2fva n LYS 60 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2fva n ALA 61 N -1.68 4.88 -0.01 7.82 0.00 -0.65 -4.62 120.51 126.25 2fva n ALA 61 Ca 0.03 -4.00 -0.02 0.00 0.00 0.00 0.00 53.44 49.46 2fva n ALA 61 Cb 0.39 -0.48 -0.01 0.00 0.00 0.00 0.00 19.45 19.34 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 -0.56 0.38 -2.89 0.00 10.64 -1.21 -4.86 117.38 118.88 2fva n GLN 62 Ca 0.38 0.02 -0.15 0.00 -1.83 0.00 0.00 57.00 55.42 2fva n GLN 62 Cb 0.80 -1.06 -0.00 0.00 -0.86 0.00 0.00 30.24 29.12 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 -2.54 1.47 -4.73 2.61 8.00 -1.26 -5.09 116.55 115.00 2fva n ASP 63 Ca -0.05 -2.93 -0.39 0.00 0.71 0.00 0.00 54.79 52.13 2fva n ASP 63 Cb 0.56 -0.57 -0.05 0.00 -0.02 0.00 0.00 41.12 41.04 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 -3.00 5.02 0.36 0.53 -1.09 -1.26 -5.07 121.20 116.69 2fva s ILE 64 Ca 0.35 1.30 -0.06 0.00 -2.23 0.00 0.00 60.65 60.01 2fva s ILE 64 Cb 0.40 -3.97 0.09 0.00 -1.58 0.00 0.00 42.46 37.40 2fva s ILE 64 CO -0.03 0.32 0.30 -0.24 -1.23 0.00 0.00 174.94 174.05 2fva n SER 65 N 3.41 -1.54 -3.15 3.58 2.88 -1.26 -4.96 113.62 112.58 2fva n SER 65 Ca -0.04 -0.61 -0.02 0.00 -1.33 0.00 0.00 58.87 56.87 2fva n SER 65 Cb 0.51 -0.28 0.02 0.00 -0.75 0.00 0.00 64.21 63.71 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 -3.28 0.00 -0.33 2.46 5.66 -1.26 -4.20 114.28 113.34 2fva n THR 66 Ca 0.04 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 61.05 2fva n THR 66 Cb 0.17 -0.08 0.14 0.00 -1.55 0.00 0.00 70.33 69.01 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 -1.60 1.08 -0.94 1.09 2.04 -1.85 -2.24 117.51 115.08 2fva h ILE 67 Ca -0.03 -0.36 0.12 0.00 1.00 0.00 0.00 64.86 65.59 2fva h ILE 67 Cb 0.10 -0.06 -0.14 0.00 -0.74 0.00 0.00 36.82 35.99 2fva h ILE 67 CO 0.02 0.19 -0.49 1.56 0.00 0.00 0.00 178.15 179.43 2fva h GLN 68 N 1.05 -0.03 -0.37 2.37 1.08 -1.59 0.74 115.11 118.35 2fva h GLN 68 Ca 0.38 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.43 2fva h GLN 68 Cb 0.12 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.56 2fva h GLN 68 CO -0.16 -0.02 -0.34 1.96 -0.95 0.00 0.00 178.83 179.32 2fva h GLN 69 N -0.03 0.89 -0.54 1.46 1.08 -1.76 -2.89 115.11 113.32 2fva h GLN 69 Ca 0.24 -0.46 0.07 0.00 -1.45 0.00 0.00 58.65 57.05 2fva h GLN 69 Cb 0.51 0.01 -0.06 0.00 -0.05 0.00 0.00 27.48 27.89 2fva h GLN 69 CO -0.93 1.11 0.22 0.00 -0.95 0.00 0.00 178.83 178.28 2fva h ALA 70 N 0.77 0.68 -0.84 3.87 0.00 -0.13 0.11 119.26 123.71 2fva h ALA 70 Ca 0.06 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2fva h ALA 70 Cb 0.93 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 2fva h ALA 70 CO 0.09 -0.16 0.45 0.00 0.00 0.00 0.00 179.25 179.62 2fva h ALA 71 N 1.34 1.20 -0.70 0.00 0.00 0.36 -2.23 119.26 119.22 2fva h ALA 71 Ca 0.25 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2fva h ALA 71 Cb 0.25 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2fva h ALA 71 CO -0.23 0.64 0.16 0.22 0.00 0.00 0.00 179.25 180.03 2fva h ASP 72 N 1.19 1.07 -0.48 0.00 3.58 -1.01 -1.96 116.42 118.80 2fva h ASP 72 Ca 0.30 -0.23 -0.01 0.00 0.42 0.00 0.00 57.03 57.50 2fva h ASP 72 Cb 0.05 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.79 2fva h ASP 72 CO -0.05 1.03 0.26 0.58 -2.88 0.00 0.00 179.24 178.19 2fva h VAL 73 N 1.07 1.17 -0.60 2.25 2.07 -0.54 -2.67 116.25 119.00 2fva h VAL 73 Ca 0.22 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 2fva h VAL 73 Cb 0.39 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 2fva h VAL 73 CO 0.00 0.18 0.28 0.40 0.02 0.00 0.00 177.57 178.46 2fva h ILE 74 N 0.64 1.22 -0.60 4.57 2.04 -1.22 -2.02 117.51 122.13 2fva h ILE 74 Ca 0.17 -0.62 0.12 0.00 1.00 0.00 0.00 64.86 65.52 2fva h ILE 74 Cb 0.05 0.51 -0.09 0.00 -0.74 0.00 0.00 36.82 36.55 2fva h ILE 74 CO -0.03 0.25 0.10 -0.33 0.00 0.00 0.00 178.15 178.14 2fva h GLU 75 N 0.83 0.22 -0.43 2.37 5.08 -1.03 0.92 114.58 122.54 2fva h GLU 75 Ca 0.21 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 2fva h GLU 75 Cb 0.13 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2fva h GLU 75 CO -0.02 0.14 -0.09 0.78 -1.00 0.00 0.00 179.01 178.82 2fva h GLY 76 N 0.22 0.83 1.87 -3.84 0.00 -1.21 -2.07 103.07 98.86 2fva h GLY 76 Ca 0.31 -0.61 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2fva h GLY 76 CO -0.43 0.56 0.00 1.04 0.00 0.00 0.00 176.54 177.71 2fva n LEU 77 N -4.17 0.00 0.00 3.11 4.77 -0.01 -1.97 117.00 118.73 2fva n LEU 77 Ca 0.01 0.43 0.11 0.00 -0.03 0.00 0.00 56.01 56.54 2fva n LEU 77 Cb 0.35 -0.43 0.11 0.00 -2.33 0.00 0.00 43.42 41.12 2fva n LEU 77 CO 0.43 -0.15 0.24 0.18 -1.33 0.00 0.00 177.39 176.76 2fva n LEU 78 N -1.43 0.67 0.07 2.23 4.77 0.11 -3.39 117.00 120.03 2fva n LEU 78 Ca 0.06 -0.16 -0.04 0.00 -0.03 0.00 0.00 56.01 55.85 2fva n LEU 78 Cb 0.20 -0.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 2fva n LEU 78 CO 0.17 0.15 0.14 -0.33 -1.33 0.00 0.00 177.39 176.20 2fva h GLU 79 N 0.00 -0.22 -0.21 3.23 4.39 -1.33 -3.36 114.58 117.08 2fva h GLU 79 Ca 0.00 0.02 -0.20 0.00 0.34 0.00 0.00 59.36 59.51 2fva h GLU 79 Cb 0.53 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 2fva h GLU 79 CO 0.00 -0.15 -0.67 1.57 -1.16 0.00 0.00 179.01 178.60 2fva h LYS 80 N -0.68 0.80 -4.92 2.33 -0.00 -1.78 -3.42 116.57 108.91 2fva h LYS 80 Ca -0.02 -0.59 -0.67 0.00 -0.00 0.00 0.00 60.65 59.37 2fva h LYS 80 Cb 0.18 0.10 -0.36 0.00 -0.00 0.00 0.00 32.23 32.15 2fva h LYS 80 CO 0.04 1.21 -0.80 0.21 -0.00 0.00 0.00 179.45 180.10 2fva s LYS 81 N -3.91 2.51 0.00 0.07 2.20 -1.22 -5.17 119.74 114.22 2fva s LYS 81 Ca -0.10 -1.17 0.00 0.00 -0.36 0.00 0.00 55.97 54.34 2fva s LYS 81 Cb 0.09 -2.83 0.00 0.00 -1.51 0.00 0.00 37.83 33.58 2fva s LYS 81 CO 0.89 -0.46 0.44 0.00 -0.36 0.00 0.00 175.35 175.86