#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 3.91 0.23 0.00 1.02 -1.26 -4.91 119.74 118.73 2fva s LYS 2 Ca 0.00 1.31 -0.07 0.00 0.02 0.00 0.00 55.97 57.23 2fva s LYS 2 Cb 0.00 -2.12 0.21 0.00 -0.52 0.00 0.00 37.83 35.40 2fva s LYS 2 CO 0.00 -0.33 1.88 0.87 -0.92 0.00 0.00 175.35 176.84 2fva h LYS 3 N 1.66 1.23 -0.62 1.68 1.57 -2.01 -0.40 116.57 119.68 2fva h LYS 3 Ca -0.49 -0.11 0.03 0.00 -1.87 0.00 0.00 60.65 58.20 2fva h LYS 3 Cb 1.21 -0.26 -0.04 0.00 0.08 0.00 0.00 32.23 33.23 2fva h LYS 3 CO 0.60 0.86 0.38 1.05 -0.57 0.00 0.00 179.45 181.77 2fva h GLU 4 N 1.24 0.74 -0.41 3.15 4.11 -1.99 0.27 114.58 121.69 2fva h GLU 4 Ca 0.32 -0.04 -0.10 0.00 0.07 0.00 0.00 59.36 59.60 2fva h GLU 4 Cb -0.05 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 2fva h GLU 4 CO -0.06 0.49 -0.15 1.15 0.07 0.00 0.00 179.01 180.50 2fva h THR 5 N 0.76 1.28 -0.51 -1.06 2.02 -1.82 -2.32 112.91 111.26 2fva h THR 5 Ca 0.25 -1.28 -0.00 0.00 0.77 0.00 0.00 66.41 66.15 2fva h THR 5 Cb 0.01 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 2fva h THR 5 CO -0.10 0.43 0.32 0.40 0.37 0.00 0.00 175.52 176.94 2fva h ILE 6 N 0.64 1.15 -0.58 3.11 2.04 -0.63 -0.92 117.51 122.32 2fva h ILE 6 Ca 0.10 -0.31 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 2fva h ILE 6 Cb 0.70 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 2fva h ILE 6 CO 0.05 0.15 0.19 0.44 0.00 0.00 0.00 178.15 178.98 2fva h ASP 7 N 0.68 0.79 -0.26 1.72 3.32 -0.89 -2.19 116.42 119.60 2fva h ASP 7 Ca 0.18 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 2fva h ASP 7 Cb -0.03 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 2fva h ASP 7 CO -0.04 0.74 0.04 0.11 -1.72 0.00 0.00 179.24 178.38 2fva h LYS 8 N 0.84 0.43 -0.29 3.56 1.79 -0.83 -1.16 116.57 120.91 2fva h LYS 8 Ca 0.19 -0.12 0.01 0.00 -2.18 0.00 0.00 60.65 58.56 2fva h LYS 8 Cb 0.23 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 2fva h LYS 8 CO -0.01 0.55 0.17 0.28 -1.08 0.00 0.00 179.45 179.36 2fva h VAL 9 N 0.24 1.03 -0.63 0.50 2.07 -0.92 -2.12 116.25 116.41 2fva h VAL 9 Ca 0.08 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 2fva h VAL 9 Cb 0.33 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 2fva h VAL 9 CO 0.01 0.06 0.39 0.77 0.02 0.00 0.00 177.57 178.82 2fva h SER 10 N 0.34 0.75 -0.80 0.57 4.64 -1.33 -2.43 113.55 115.29 2fva h SER 10 Ca 0.12 -0.05 0.12 0.00 -0.47 0.00 0.00 61.79 61.50 2fva h SER 10 Cb 0.01 -0.19 -0.08 0.00 -0.31 0.00 0.00 62.40 61.82 2fva h SER 10 CO -0.06 0.58 0.41 0.44 -0.87 0.00 0.00 176.83 177.33 2fva h ASP 11 N 0.86 0.52 -0.51 4.97 3.32 -0.68 -0.11 116.42 124.78 2fva h ASP 11 Ca 0.23 0.08 0.02 0.00 0.02 0.00 0.00 57.03 57.37 2fva h ASP 11 Cb -0.04 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 2fva h ASP 11 CO -0.04 0.26 0.31 0.40 -1.72 0.00 0.00 179.24 178.44 2fva h ILE 12 N 0.64 1.07 -0.52 0.35 5.03 -0.91 -0.78 117.51 122.39 2fva h ILE 12 Ca 0.41 -0.21 -0.01 0.00 -0.12 0.00 0.00 64.86 64.93 2fva h ILE 12 Cb 0.51 0.39 -0.02 0.00 -3.03 0.00 0.00 36.82 34.67 2fva h ILE 12 CO -0.32 0.11 0.28 0.58 -0.68 0.00 0.00 178.15 178.13 2fva h VAL 13 N 0.63 1.18 -0.67 1.67 2.07 -0.86 -2.62 116.25 117.65 2fva h VAL 13 Ca 0.20 -0.45 -0.05 0.00 0.82 0.00 0.00 66.70 67.22 2fva h VAL 13 Cb -0.01 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 2fva h VAL 13 CO -0.08 0.19 0.22 0.11 0.02 0.00 0.00 177.57 178.03 2fva h LYS 14 N 0.69 1.01 -0.59 1.57 1.57 -0.83 -2.90 116.57 117.09 2fva h LYS 14 Ca 0.18 -0.20 0.08 0.00 -1.87 0.00 0.00 60.65 58.85 2fva h LYS 14 Cb 0.05 -0.16 -0.06 0.00 0.08 0.00 0.00 32.23 32.14 2fva h LYS 14 CO -0.03 0.86 0.24 0.93 -0.57 0.00 0.00 179.45 180.88 2fva h GLU 15 N 0.98 0.43 -0.58 3.15 4.39 -0.77 1.74 114.58 123.92 2fva h GLU 15 Ca 0.22 -0.03 0.11 0.00 0.34 0.00 0.00 59.36 60.00 2fva h GLU 15 Cb 0.27 -0.10 -0.11 0.00 -0.10 0.00 0.00 28.75 28.70 2fva h GLU 15 CO -0.01 0.29 -0.26 0.87 -1.16 0.00 0.00 179.01 178.74 2fva h LYS 16 N 0.45 -0.11 -0.01 2.33 1.79 -1.35 0.94 116.57 120.61 2fva h LYS 16 Ca 0.29 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.77 2fva h LYS 16 Cb 0.31 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 2fva h LYS 16 CO -0.27 -0.07 -0.01 1.28 -1.08 0.00 0.00 179.45 179.30 2fva n LEU 17 N -5.44 0.87 -1.64 2.94 7.99 -0.88 -4.89 117.00 115.96 2fva n LEU 17 Ca 0.05 -0.28 -0.12 0.00 -0.01 0.00 0.00 56.01 55.65 2fva n LEU 17 Cb 0.34 -0.02 0.01 0.00 -0.11 0.00 0.00 43.42 43.65 2fva n LEU 17 CO 0.03 0.15 -0.05 0.00 -1.51 0.00 0.00 177.39 176.01 2fva n ALA 18 N -0.35 -0.47 -1.78 -1.18 0.00 0.32 -5.02 120.51 112.03 2fva n ALA 18 Ca 0.20 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.78 2fva n ALA 18 Cb 0.26 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.63 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 -2.13 0.00 0.00 0.00 4.32 0.55 -4.73 117.00 115.01 2fva n LEU 19 Ca -0.09 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.90 2fva n LEU 19 Cb 0.58 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.38 2fva n LEU 19 CO 0.23 -0.30 0.00 0.61 -1.22 0.00 0.00 177.39 176.71 2fva n GLY 20 N 5.00 0.80 0.00 -0.72 0.00 -1.26 -4.46 105.19 104.55 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 -1.42 -0.01 0.05 4.61 0.00 -1.26 -4.69 120.51 117.78 2fva n ALA 21 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 2fva n ALA 21 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 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 -0.90 1.94 -4.74 0.00 8.00 -1.26 -5.01 116.55 114.58 2fva n ASP 22 Ca 0.00 -1.64 -0.39 0.00 0.71 0.00 0.00 54.79 53.47 2fva n ASP 22 Cb 0.00 -0.05 -0.05 0.00 -0.02 0.00 0.00 41.12 41.00 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 -0.72 4.90 0.72 2.53 1.01 -1.26 -5.05 120.40 122.52 2fva s VAL 23 Ca 0.08 1.45 -0.13 0.00 0.00 0.00 0.00 61.98 63.37 2fva s VAL 23 Cb 0.05 -4.03 0.03 0.00 0.00 0.00 0.00 36.38 32.42 2fva s VAL 23 CO 0.06 0.34 1.12 0.68 0.00 0.00 0.00 175.10 177.30 2fva s VAL 24 N 0.21 3.07 -0.09 2.92 -7.23 -1.26 -4.63 120.40 113.38 2fva s VAL 24 Ca 0.36 0.45 0.04 0.00 -1.81 0.00 0.00 61.98 61.01 2fva s VAL 24 Cb -0.19 -2.93 0.00 0.00 0.56 0.00 0.00 36.38 33.83 2fva s VAL 24 CO 0.19 -0.36 -0.21 0.54 -0.31 0.00 0.00 175.10 174.96 2fva s VAL 25 N -2.47 1.84 0.08 1.32 0.11 -1.26 -5.02 120.40 115.00 2fva s VAL 25 Ca 0.66 -0.89 0.02 0.00 -2.93 0.00 0.00 61.98 58.83 2fva s VAL 25 Cb -0.21 -1.61 -0.04 0.00 -1.53 0.00 0.00 36.38 33.00 2fva s VAL 25 CO 0.47 0.51 -0.06 0.42 -3.33 0.00 0.00 175.10 173.11 2fva s THR 26 N 0.41 0.60 0.00 5.04 -4.23 -1.26 -5.05 115.64 111.14 2fva s THR 26 Ca -0.18 -1.71 0.11 0.00 -1.18 0.00 0.00 61.69 58.74 2fva s THR 26 Cb -0.17 -1.39 -0.22 0.00 1.34 0.00 0.00 72.50 72.05 2fva s THR 26 CO 0.08 -0.77 0.84 0.00 -0.54 0.00 0.00 174.62 174.23 2fva h ALA 27 N 3.37 0.65 -0.00 3.99 0.00 -1.98 -3.28 119.26 122.00 2fva h ALA 27 Ca -0.35 -1.31 0.00 0.00 0.00 0.00 0.00 54.91 53.25 2fva h ALA 27 Cb 1.17 0.30 0.00 0.00 0.00 0.00 0.00 17.79 19.27 2fva h ALA 27 CO 0.59 1.49 0.00 -0.25 0.00 0.00 0.00 179.25 181.08 2fva n ASP 28 N -3.13 0.25 -4.47 0.00 8.00 -1.26 -2.43 116.55 113.51 2fva n ASP 28 Ca -0.12 -1.11 -0.43 0.00 0.71 0.00 0.00 54.79 53.85 2fva n ASP 28 Cb 1.02 -0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 42.08 2fva n ASP 28 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2fva s SER 29 N -1.97 6.26 -0.17 -2.24 0.15 -1.24 -4.91 113.70 109.57 2fva s SER 29 Ca 0.45 -1.09 -0.41 0.00 0.70 0.00 0.00 55.95 55.60 2fva s SER 29 Cb 0.21 -2.45 -0.18 0.00 -1.71 0.00 0.00 66.02 61.89 2fva s SER 29 CO 0.35 -1.45 1.41 -0.62 1.20 0.00 0.00 173.24 174.14 2fva n GLU 30 N 7.88 0.51 -0.11 5.44 1.02 -1.26 -4.44 120.64 129.68 2fva n GLU 30 Ca 0.04 0.19 0.07 0.00 -0.02 0.00 0.00 57.16 57.43 2fva n GLU 30 Cb 0.47 -1.76 0.41 0.00 -0.02 0.00 0.00 31.44 30.54 2fva n GLU 30 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2fva h PHE 31 N 4.78 0.61 -4.01 -0.32 -5.15 -1.90 -3.42 116.94 107.53 2fva h PHE 31 Ca -0.47 0.02 -0.53 0.00 -0.20 0.00 0.00 57.97 56.78 2fva h PHE 31 Cb 1.37 -0.20 0.11 0.00 0.22 0.00 0.00 35.95 37.44 2fva h PHE 31 CO 0.64 0.33 0.60 -1.12 -2.00 0.00 0.00 178.31 176.76 2fva s SER 32 N -6.34 5.76 0.00 -0.68 0.01 -1.26 -5.02 113.70 106.17 2fva s SER 32 Ca -0.09 2.67 0.03 0.00 1.31 0.00 0.00 55.95 59.87 2fva s SER 32 Cb 0.19 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.75 2fva s SER 32 CO 0.76 -1.23 -0.07 -0.54 0.41 0.00 0.00 173.24 172.56 2fva s LYS 33 N -2.66 2.55 -0.01 12.44 -0.14 -1.26 -5.11 119.74 125.55 2fva s LYS 33 Ca 0.65 -0.72 -0.21 0.00 -1.36 0.00 0.00 55.97 54.33 2fva s LYS 33 Cb -0.38 -2.50 -0.05 0.00 -1.68 0.00 0.00 37.83 33.22 2fva s LYS 33 CO 0.46 0.60 0.62 -0.51 -0.76 0.00 0.00 175.35 175.77 2fva s LEU 34 N -1.39 4.40 0.00 3.17 2.01 -1.26 -3.64 118.68 121.97 2fva s LEU 34 Ca 0.17 1.18 0.00 0.00 0.01 0.00 0.00 54.13 55.49 2fva s LEU 34 Cb -0.11 -2.96 0.00 0.00 0.01 0.00 0.00 46.19 43.13 2fva s LEU 34 CO 0.07 0.06 0.00 0.61 1.01 0.00 0.00 176.35 178.10 2fva n GLY 35 N 2.56 0.81 3.76 -3.19 0.00 -1.26 -5.04 105.19 102.82 2fva n GLY 35 Ca -0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.56 3.39 0.10 4.61 0.00 -1.24 -4.95 121.76 121.12 2fva s ALA 36 Ca 0.00 0.99 -0.20 0.00 0.00 0.00 0.00 51.96 52.74 2fva s ALA 36 Cb 0.00 -3.37 -0.08 0.00 0.00 0.00 0.00 23.12 19.67 2fva s ALA 36 CO 0.00 -0.31 1.69 0.22 0.00 0.00 0.00 175.76 177.36 2fva h ASP 37 N 3.55 0.24 -4.92 0.00 1.82 -1.96 -3.47 116.42 111.69 2fva h ASP 37 Ca -0.47 -0.10 0.03 0.00 -0.39 0.00 0.00 57.03 56.10 2fva h ASP 37 Cb 1.22 -0.06 -0.12 0.00 0.68 0.00 0.00 39.33 41.05 2fva h ASP 37 CO 0.66 0.27 0.30 -0.55 -1.61 0.00 0.00 179.24 178.31 2fva s SER 38 N -5.49 -0.47 -0.09 2.28 0.15 -1.26 -5.16 113.70 103.65 2fva s SER 38 Ca -0.13 -0.07 0.03 0.00 0.70 0.00 0.00 55.95 56.48 2fva s SER 38 Cb 0.08 0.55 -0.01 0.00 -1.71 0.00 0.00 66.02 64.92 2fva s SER 38 CO 0.70 -0.90 -0.20 -0.22 1.20 0.00 0.00 173.24 173.82 2fva s LEU 39 N -2.70 2.35 -1.00 3.45 2.96 -1.26 -5.07 118.68 117.41 2fva s LEU 39 Ca 0.03 -0.44 -0.20 0.00 -0.22 0.00 0.00 54.13 53.31 2fva s LEU 39 Cb -0.01 -1.48 0.10 0.00 0.50 0.00 0.00 46.19 45.30 2fva s LEU 39 CO -0.09 0.20 1.30 -1.81 -1.32 0.00 0.00 176.35 174.62 2fva s ASP 40 N 0.12 6.63 0.30 3.68 1.01 -1.26 -4.82 116.67 122.33 2fva s ASP 40 Ca -0.10 -1.93 -0.00 0.00 0.71 0.00 0.00 52.55 51.23 2fva s ASP 40 Cb -0.16 -2.47 0.46 0.00 1.01 0.00 0.00 42.92 41.76 2fva s ASP 40 CO 0.06 -1.21 1.86 0.74 0.21 0.00 0.00 175.17 176.83 2fva h THR 41 N 6.08 1.21 -0.75 -1.27 2.02 -1.97 -1.68 112.91 116.55 2fva h THR 41 Ca 0.20 -0.74 -0.04 0.00 0.77 0.00 0.00 66.41 66.60 2fva h THR 41 Cb 1.00 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 68.02 2fva h THR 41 CO 1.25 0.28 0.32 0.58 0.37 0.00 0.00 175.52 178.33 2fva h VAL 42 N 0.77 1.25 -0.12 3.16 2.07 -1.94 0.18 116.25 121.62 2fva h VAL 42 Ca 0.18 -0.75 -0.09 0.00 0.82 0.00 0.00 66.70 66.86 2fva h VAL 42 Cb 0.25 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 2fva h VAL 42 CO -0.01 0.31 -0.29 -0.33 0.02 0.00 0.00 177.57 177.28 2fva h GLU 43 N 1.08 0.41 -0.21 1.57 5.08 -1.86 -2.55 114.58 118.11 2fva h GLU 43 Ca 0.26 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 2fva h GLU 43 Cb 0.17 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2fva h GLU 43 CO -0.03 0.89 0.04 0.82 -1.00 0.00 0.00 179.01 179.73 2fva h ILE 44 N -0.01 1.22 -0.45 3.13 1.08 -1.16 -1.75 117.51 119.56 2fva h ILE 44 Ca -0.00 -0.70 -0.02 0.00 -0.39 0.00 0.00 64.86 63.75 2fva h ILE 44 Cb 0.89 1.28 -0.02 0.00 -3.07 0.00 0.00 36.82 35.90 2fva h ILE 44 CO 0.06 0.22 0.22 1.62 -0.69 0.00 0.00 178.15 179.59 2fva h VAL 45 N 0.15 1.18 -0.79 1.67 3.04 -1.05 -2.06 116.25 118.38 2fva h VAL 45 Ca 0.06 -0.50 -0.04 0.00 -1.01 0.00 0.00 66.70 65.22 2fva h VAL 45 Cb 0.29 0.68 -0.04 0.00 -2.01 0.00 0.00 31.29 30.22 2fva h VAL 45 CO 0.00 0.19 0.36 0.24 -1.01 0.00 0.00 177.57 177.35 2fva h MET 46 N 0.59 1.15 -0.52 4.17 2.86 -1.41 0.25 114.93 122.02 2fva h MET 46 Ca 0.16 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 2fva h MET 46 Cb 0.11 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.54 2fva h MET 46 CO -0.02 0.91 0.28 -0.91 1.06 0.00 0.00 176.91 178.23 2fva h ASN 47 N 1.14 0.66 -0.27 1.22 4.21 -0.99 1.17 115.58 122.72 2fva h ASN 47 Ca 0.27 -0.10 -0.11 0.00 1.21 0.00 0.00 56.30 57.58 2fva h ASN 47 Cb 0.15 -0.17 -0.00 0.00 -1.12 0.00 0.00 38.32 37.18 2fva h ASN 47 CO -0.03 0.57 -0.24 -0.07 -1.29 0.00 0.00 177.43 176.37 2fva h LEU 48 N 0.70 0.69 -0.38 1.61 3.38 -0.95 0.12 115.31 120.48 2fva h LEU 48 Ca 0.18 -0.46 -0.10 0.00 0.09 0.00 0.00 57.88 57.59 2fva h LEU 48 Cb 0.06 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2fva h LEU 48 CO -0.03 1.00 -0.15 -0.08 0.09 0.00 0.00 178.44 179.28 2fva h GLU 49 N 0.38 0.77 -0.45 1.13 4.81 -0.29 -1.44 114.58 119.50 2fva h GLU 49 Ca 0.05 -0.32 -0.10 0.00 -0.13 0.00 0.00 59.36 58.86 2fva h GLU 49 Cb 0.80 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 2fva h GLU 49 CO 0.06 0.94 -0.10 1.49 -0.73 0.00 0.00 179.01 180.67 2fva h GLU 50 N 0.58 0.86 0.22 1.92 4.57 0.14 1.99 114.58 124.85 2fva h GLU 50 Ca 0.09 -0.33 -0.01 0.00 -1.18 0.00 0.00 59.36 57.93 2fva h GLU 50 Cb 0.68 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.23 2fva h GLU 50 CO 0.05 0.96 -0.11 1.49 -1.18 0.00 0.00 179.01 180.22 2fva h GLU 51 N 0.69 -0.28 -0.00 1.92 4.57 -0.67 -2.78 114.58 118.03 2fva h GLU 51 Ca 0.11 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2fva h GLU 51 Cb 0.64 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.29 2fva h GLU 51 CO 0.04 -0.10 -0.19 1.19 -1.18 0.00 0.00 179.01 178.78 2fva n PHE 52 N -5.16 0.00 -2.33 0.92 3.72 -0.55 -4.91 117.46 109.14 2fva n PHE 52 Ca -0.09 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.15 2fva n PHE 52 Cb 0.18 -0.20 -0.01 0.00 -0.94 0.00 0.00 39.48 38.51 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 1.34 -0.31 0.00 1.37 0.00 0.66 -4.95 105.19 103.30 2fva n GLY 53 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -3.47 0.00 -3.94 -0.61 -5.35 -0.50 -4.98 119.36 100.51 2fva n ILE 54 Ca -0.18 0.00 -0.31 0.00 -0.27 0.00 0.00 62.75 61.99 2fva n ILE 54 Cb 0.63 -1.53 -0.15 0.00 -1.74 0.00 0.00 39.64 36.85 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 4.19 -0.17 7.28 4.22 -1.26 -4.81 114.94 123.38 2fva s ASN 55 Ca 0.00 -1.55 -0.04 0.00 -2.14 0.00 0.00 52.86 49.12 2fva s ASN 55 Cb 0.00 -1.28 -0.03 0.00 1.28 0.00 0.00 41.25 41.23 2fva s ASN 55 CO 0.00 -0.30 -0.02 -0.69 -2.04 0.00 0.00 177.10 174.04 2fva s VAL 56 N 1.27 3.90 0.22 3.54 1.01 -1.26 -5.01 120.40 124.07 2fva s VAL 56 Ca 0.01 -0.35 -0.10 0.00 0.00 0.00 0.00 61.98 61.55 2fva s VAL 56 Cb -0.19 -2.73 -0.07 0.00 0.00 0.00 0.00 36.38 33.39 2fva s VAL 56 CO -0.10 0.47 0.54 -1.81 0.00 0.00 0.00 175.10 174.20 2fva s ASP 57 N 0.64 6.64 0.53 3.32 1.01 -1.26 -4.94 116.67 122.60 2fva s ASP 57 Ca -0.02 0.92 0.29 0.00 0.71 0.00 0.00 52.55 54.45 2fva s ASP 57 Cb -0.14 -2.23 1.58 0.00 1.01 0.00 0.00 42.92 43.14 2fva s ASP 57 CO 0.02 -0.05 1.87 -0.33 0.21 0.00 0.00 175.17 176.89 2fva h GLU 58 N 2.65 0.00 0.00 8.23 3.07 -1.99 0.74 114.58 127.29 2fva h GLU 58 Ca -0.47 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.37 2fva h GLU 58 Cb 1.17 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.08 2fva h GLU 58 CO 0.69 0.00 -0.28 0.22 -1.40 0.00 0.00 179.01 178.24 2fva h ASP 59 N 0.00 0.00 0.19 1.42 1.82 -2.01 -3.11 116.42 114.74 2fva h ASP 59 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2fva h ASP 59 Cb 0.33 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.34 2fva h ASP 59 CO 0.00 0.07 -0.83 0.29 -1.61 0.00 0.00 179.24 177.16 2fva n LYS 60 N -3.03 0.02 -1.93 0.28 4.76 0.25 -4.22 118.16 114.29 2fva n LYS 60 Ca 0.03 -0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.31 2fva n LYS 60 Cb 0.57 -1.50 0.05 0.00 -1.84 0.00 0.00 35.03 32.30 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 -1.52 4.42 -0.02 7.82 0.00 -0.78 -4.59 120.51 125.85 2fva n ALA 61 Ca 0.04 -3.54 -0.02 0.00 0.00 0.00 0.00 53.44 49.93 2fva n ALA 61 Cb 0.34 -0.41 -0.02 0.00 0.00 0.00 0.00 19.45 19.35 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 -0.72 3.19 -2.86 0.00 10.64 -1.18 -4.83 117.38 121.63 2fva n GLN 62 Ca 0.34 0.00 -0.12 0.00 -1.83 0.00 0.00 57.00 55.39 2fva n GLN 62 Cb 0.91 -1.08 0.01 0.00 -0.86 0.00 0.00 30.24 29.22 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 -2.16 0.94 -4.72 2.61 8.00 -1.26 -5.10 116.55 114.86 2fva n ASP 63 Ca -0.05 -2.84 -0.39 0.00 0.71 0.00 0.00 54.79 52.22 2fva n ASP 63 Cb 0.60 -0.41 -0.05 0.00 -0.02 0.00 0.00 41.12 41.24 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 -2.60 5.10 0.22 0.53 -1.09 -1.26 -5.07 121.20 117.03 2fva s ILE 64 Ca 0.31 1.24 -0.04 0.00 -2.23 0.00 0.00 60.65 59.94 2fva s ILE 64 Cb 0.41 -3.95 0.06 0.00 -1.58 0.00 0.00 42.46 37.40 2fva s ILE 64 CO -0.01 0.28 0.19 -1.20 -1.23 0.00 0.00 174.94 172.97 2fva n SER 65 N 3.78 -1.26 -3.23 3.58 7.64 -1.26 -4.96 113.62 117.91 2fva n SER 65 Ca -0.04 -0.59 -0.02 0.00 1.01 0.00 0.00 58.87 59.23 2fva n SER 65 Cb 0.51 -0.18 0.02 0.00 -1.01 0.00 0.00 64.21 63.56 2fva n SER 65 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2fva n THR 66 N -2.95 0.00 -0.25 0.44 5.66 -1.26 -4.22 114.28 111.69 2fva n THR 66 Ca 0.03 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.98 2fva n THR 66 Cb 0.11 -0.07 0.05 0.00 -1.55 0.00 0.00 70.33 68.87 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 -1.61 1.19 -0.87 1.09 2.04 -1.75 -2.35 117.51 115.25 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 0.18 -0.13 0.00 -0.74 0.00 0.00 36.82 36.22 2fva h ILE 67 CO 0.02 0.18 -0.45 1.56 0.00 0.00 0.00 178.15 179.46 2fva h GLN 68 N 0.95 -0.07 -0.45 2.37 1.08 -1.79 0.55 115.11 117.76 2fva h GLN 68 Ca 0.25 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.36 2fva h GLN 68 Cb -0.09 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.34 2fva h GLN 68 CO -0.05 -0.04 -0.09 0.37 -0.95 0.00 0.00 178.83 178.06 2fva h GLN 69 N -0.07 0.85 -0.65 1.46 4.15 -1.78 -2.75 115.11 116.32 2fva h GLN 69 Ca 0.25 -0.32 0.07 0.00 0.77 0.00 0.00 58.65 59.42 2fva h GLN 69 Cb 0.54 -0.05 -0.06 0.00 0.21 0.00 0.00 27.48 28.12 2fva h GLN 69 CO -0.88 0.95 0.34 0.00 -1.93 0.00 0.00 178.83 177.30 2fva h ALA 70 N 0.87 0.88 -0.65 3.38 0.00 -0.23 -0.79 119.26 122.71 2fva h ALA 70 Ca 0.11 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2fva h ALA 70 Cb 0.63 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2fva h ALA 70 CO 0.04 -0.02 0.27 0.00 0.00 0.00 0.00 179.25 179.54 2fva h ALA 71 N 1.37 1.25 -0.58 0.00 0.00 0.05 -2.30 119.26 119.04 2fva h ALA 71 Ca 0.30 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 2fva h ALA 71 Cb 0.25 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2fva h ALA 71 CO -0.22 0.56 0.08 -0.44 0.00 0.00 0.00 179.25 179.23 2fva h ASP 72 N 0.94 0.90 -0.46 0.00 3.32 -0.90 -2.25 116.42 117.97 2fva h ASP 72 Ca 0.22 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 2fva h ASP 72 Cb 0.17 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2fva h ASP 72 CO -0.02 0.92 0.20 0.58 -1.72 0.00 0.00 179.24 179.20 2fva h VAL 73 N 0.89 1.20 -0.49 -1.35 2.07 -0.67 -1.96 116.25 115.93 2fva h VAL 73 Ca 0.18 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 2fva h VAL 73 Cb 0.41 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 2fva h VAL 73 CO 0.01 0.22 0.28 0.40 0.02 0.00 0.00 177.57 178.50 2fva h ILE 74 N 0.60 1.17 -0.80 4.57 2.04 -1.25 -0.97 117.51 122.86 2fva h ILE 74 Ca 0.16 -0.41 0.06 0.00 1.00 0.00 0.00 64.86 65.66 2fva h ILE 74 Cb 0.16 0.54 -0.06 0.00 -0.74 0.00 0.00 36.82 36.72 2fva h ILE 74 CO -0.02 0.17 0.49 -0.33 0.00 0.00 0.00 178.15 178.46 2fva h GLU 75 N 0.65 0.87 0.00 2.37 4.39 -1.18 0.11 114.58 121.80 2fva h GLU 75 Ca 0.17 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.79 2fva h GLU 75 Cb 0.03 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.48 2fva h GLU 75 CO -0.03 0.58 -0.16 0.78 -1.16 0.00 0.00 179.01 179.01 2fva h GLY 76 N 0.90 0.00 1.36 -3.84 0.00 -0.86 -2.17 103.07 98.45 2fva h GLY 76 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 2fva h GLY 76 CO -0.17 0.00 -0.37 1.04 0.00 0.00 0.00 176.54 177.04 2fva n LEU 77 N -3.46 0.45 -0.22 3.11 4.77 0.22 -3.50 117.00 118.36 2fva n LEU 77 Ca -0.01 0.22 0.11 0.00 -0.03 0.00 0.00 56.01 56.30 2fva n LEU 77 Cb 0.33 -0.30 0.03 0.00 -2.33 0.00 0.00 43.42 41.15 2fva n LEU 77 CO 0.31 0.03 0.23 0.18 -1.33 0.00 0.00 177.39 176.81 2fva n LEU 78 N -1.70 1.35 0.46 2.23 4.77 -0.29 -4.28 117.00 119.53 2fva n LEU 78 Ca 0.05 -0.51 -0.20 0.00 -0.03 0.00 0.00 56.01 55.32 2fva n LEU 78 Cb 0.37 -0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.32 2fva n LEU 78 CO 0.33 0.28 0.53 -0.33 -1.33 0.00 0.00 177.39 176.87 2fva h GLU 79 N 1.10 -1.19 -0.18 3.23 5.08 -1.55 -0.02 114.58 121.04 2fva h GLU 79 Ca 0.00 0.08 -0.14 0.00 -1.00 0.00 0.00 59.36 58.30 2fva h GLU 79 Cb 0.60 0.27 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 2fva h GLU 79 CO 0.00 -0.80 -0.47 1.57 -1.00 0.00 0.00 179.01 178.32 2fva h LYS 80 N -1.24 0.46 -0.61 2.33 5.09 -1.80 -3.00 116.57 117.80 2fva h LYS 80 Ca -0.12 -0.26 -0.03 0.00 0.09 0.00 0.00 60.65 60.33 2fva h LYS 80 Cb 0.97 0.02 -0.03 0.00 0.10 0.00 0.00 32.23 33.29 2fva h LYS 80 CO 0.15 0.84 0.25 -0.22 -2.09 0.00 0.00 179.45 178.38 2fva h LYS 81 N 0.37 0.88 0.00 0.07 3.64 -1.73 -3.54 116.57 116.26 2fva h LYS 81 Ca 0.02 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2fva h LYS 81 Cb 0.97 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 2fva h LYS 81 CO 0.08 0.71 0.00 0.00 -2.27 0.00 0.00 179.45 177.98