#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 3.97 0.29 0.00 1.02 -1.26 -4.95 119.74 118.81 2fva s LYS 2 Ca 0.00 0.67 -0.01 0.00 0.02 0.00 0.00 55.97 56.65 2fva s LYS 2 Cb 0.00 -2.39 0.44 0.00 -0.52 0.00 0.00 37.83 35.36 2fva s LYS 2 CO 0.00 0.09 1.91 0.87 -0.92 0.00 0.00 175.35 177.30 2fva h LYS 3 N 1.99 0.95 -0.31 1.68 1.57 -2.02 -0.73 116.57 119.70 2fva h LYS 3 Ca -0.48 -0.11 0.02 0.00 -1.87 0.00 0.00 60.65 58.20 2fva h LYS 3 Cb 1.18 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 33.28 2fva h LYS 3 CO 0.65 0.72 0.17 1.05 -0.57 0.00 0.00 179.45 181.46 2fva h GLU 4 N 0.95 0.34 -0.39 3.15 4.11 -1.99 0.14 114.58 120.89 2fva h GLU 4 Ca 0.24 -0.02 -0.13 0.00 0.07 0.00 0.00 59.36 59.51 2fva h GLU 4 Cb 0.07 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2fva h GLU 4 CO -0.03 0.22 -0.27 1.15 0.07 0.00 0.00 179.01 180.14 2fva h THR 5 N 0.35 1.28 -0.50 -1.06 2.02 -1.88 -2.35 112.91 110.76 2fva h THR 5 Ca 0.12 -1.43 -0.01 0.00 0.77 0.00 0.00 66.41 65.86 2fva h THR 5 Cb 0.02 1.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 2fva h THR 5 CO -0.07 0.48 0.29 0.40 0.37 0.00 0.00 175.52 176.99 2fva h ILE 6 N 0.69 1.16 -0.83 3.11 2.04 -0.85 0.41 117.51 123.24 2fva h ILE 6 Ca 0.08 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.51 2fva h ILE 6 Cb 0.85 0.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 2fva h ILE 6 CO 0.07 0.17 0.40 -0.78 0.00 0.00 0.00 178.15 178.01 2fva h ASP 7 N 0.67 1.09 -0.17 1.72 1.82 -0.67 -0.61 116.42 120.28 2fva h ASP 7 Ca 0.18 -0.13 -0.02 0.00 -0.39 0.00 0.00 57.03 56.67 2fva h ASP 7 Cb 0.02 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 39.74 2fva h ASP 7 CO -0.03 0.91 0.01 0.11 -1.61 0.00 0.00 179.24 178.63 2fva h LYS 8 N 1.19 0.28 -0.27 0.28 1.79 -0.93 -0.41 116.57 118.50 2fva h LYS 8 Ca 0.29 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.67 2fva h LYS 8 Cb 0.12 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.72 2fva h LYS 8 CO -0.04 0.49 0.18 0.28 -1.08 0.00 0.00 179.45 179.28 2fva h VAL 9 N 0.05 1.07 -0.72 0.50 2.07 -0.67 0.84 116.25 119.39 2fva h VAL 9 Ca 0.05 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 2fva h VAL 9 Cb 0.35 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 2fva h VAL 9 CO 0.01 0.07 0.44 -1.28 0.02 0.00 0.00 177.57 176.83 2fva h SER 10 N 0.37 0.85 -0.64 0.57 0.87 -1.07 -2.41 113.55 112.09 2fva h SER 10 Ca 0.10 -0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 2fva h SER 10 Cb -0.04 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 61.67 2fva h SER 10 CO -0.02 0.65 0.30 0.44 -0.53 0.00 0.00 176.83 177.68 2fva h ASP 11 N 0.98 0.84 -0.68 6.23 3.32 -0.55 -1.91 116.42 124.65 2fva h ASP 11 Ca 0.26 -0.14 0.10 0.00 0.02 0.00 0.00 57.03 57.27 2fva h ASP 11 Cb -0.05 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.24 2fva h ASP 11 CO -0.05 0.74 0.45 0.40 -1.72 0.00 0.00 179.24 179.06 2fva h ILE 12 N 0.89 0.91 -0.12 0.35 5.03 -0.36 -0.09 117.51 124.13 2fva h ILE 12 Ca 0.22 -0.18 -0.22 0.00 -0.12 0.00 0.00 64.86 64.56 2fva h ILE 12 Cb 0.13 0.33 0.01 0.00 -3.03 0.00 0.00 36.82 34.26 2fva h ILE 12 CO -0.03 0.10 -0.78 0.58 -0.68 0.00 0.00 178.15 177.34 2fva h VAL 13 N 0.53 1.29 -0.21 1.67 2.07 -1.06 -3.30 116.25 117.24 2fva h VAL 13 Ca 0.31 -1.99 -0.02 0.00 0.82 0.00 0.00 66.70 65.82 2fva h VAL 13 Cb 0.51 2.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 2fva h VAL 13 CO -0.10 0.63 0.05 0.11 0.02 0.00 0.00 177.57 178.27 2fva h LYS 14 N 0.44 0.33 -0.16 1.57 1.57 -0.49 -2.68 116.57 117.15 2fva h LYS 14 Ca -0.06 -0.08 0.05 0.00 -1.87 0.00 0.00 60.65 58.68 2fva h LYS 14 Cb 1.42 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.68 2fva h LYS 14 CO 0.16 0.45 0.38 1.05 -0.57 0.00 0.00 179.45 180.93 2fva h GLU 15 N 0.15 0.00 -0.74 3.15 4.11 -1.16 1.76 114.58 121.85 2fva h GLU 15 Ca 0.06 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.45 2fva h GLU 15 Cb 0.27 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 2fva h GLU 15 CO 0.00 0.00 0.28 0.87 0.07 0.00 0.00 179.01 180.23 2fva h LYS 16 N 0.00 1.12 -0.00 1.06 1.79 -1.55 -3.17 116.57 115.81 2fva h LYS 16 Ca 0.08 -0.22 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 2fva h LYS 16 Cb 0.84 -0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.32 2fva h LYS 16 CO -0.00 0.93 -0.08 1.47 -1.08 0.00 0.00 179.45 180.69 2fva n LEU 17 N -4.31 1.08 -1.56 2.94 -0.00 0.35 -5.05 117.00 110.45 2fva n LEU 17 Ca 0.06 -0.84 -0.00 0.00 -0.00 0.00 0.00 56.01 55.23 2fva n LEU 17 Cb 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.62 2fva n LEU 17 CO 0.41 0.23 0.01 0.00 -0.00 0.00 0.00 177.39 178.03 2fva n ALA 18 N -0.14 -2.55 -3.56 1.47 0.00 0.57 -5.11 120.51 111.19 2fva n ALA 18 Ca 0.03 0.04 -0.01 0.00 0.00 0.00 0.00 53.44 53.49 2fva n ALA 18 Cb 0.12 -0.13 -0.00 0.00 0.00 0.00 0.00 19.45 19.44 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 -0.66 0.00 0.00 0.00 4.32 -0.84 -4.88 117.00 114.94 2fva n LEU 19 Ca 0.00 -0.10 0.00 0.00 -0.02 0.00 0.00 56.01 55.89 2fva n LEU 19 Cb 0.17 0.03 0.00 0.00 -1.62 0.00 0.00 43.42 42.00 2fva n LEU 19 CO 0.02 -0.02 0.00 0.61 -1.22 0.00 0.00 177.39 176.79 2fva n GLY 20 N 2.52 0.49 0.00 -0.72 0.00 -1.26 -4.68 105.19 101.54 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 -1.94 0.00 0.34 4.61 0.00 -1.26 -4.59 120.51 117.67 2fva n ALA 21 Ca 0.00 -0.09 0.11 0.00 0.00 0.00 0.00 53.44 53.47 2fva n ALA 21 Cb 0.00 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.70 2fva n ALA 21 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2fva n ASP 22 N -1.92 3.25 -4.47 0.00 5.75 -1.26 -4.89 116.55 113.01 2fva n ASP 22 Ca 0.00 -1.96 -0.33 0.00 -0.01 0.00 0.00 54.79 52.49 2fva n ASP 22 Cb 0.00 -0.28 -0.13 0.00 -1.03 0.00 0.00 41.12 39.69 2fva n ASP 22 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2fva s VAL 23 N -1.45 3.53 0.08 2.12 1.01 -1.26 -5.10 120.40 119.33 2fva s VAL 23 Ca 0.39 -0.50 -0.30 0.00 0.00 0.00 0.00 61.98 61.57 2fva s VAL 23 Cb 0.22 -2.50 -0.05 0.00 0.00 0.00 0.00 36.38 34.05 2fva s VAL 23 CO 0.31 0.53 0.95 -0.69 0.00 0.00 0.00 175.10 176.20 2fva s VAL 24 N 0.10 4.61 -0.16 2.92 1.01 -1.26 -4.30 120.40 123.32 2fva s VAL 24 Ca -0.03 2.04 -0.17 0.00 0.00 0.00 0.00 61.98 63.83 2fva s VAL 24 Cb -0.14 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.89 2fva s VAL 24 CO 0.04 0.28 0.42 -0.69 0.00 0.00 0.00 175.10 175.14 2fva s VAL 25 N 0.26 5.21 0.35 2.92 1.01 -1.26 -5.02 120.40 123.86 2fva s VAL 25 Ca 0.48 0.79 0.05 0.00 0.00 0.00 0.00 61.98 63.30 2fva s VAL 25 Cb -0.23 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.37 2fva s VAL 25 CO 0.29 0.30 0.21 0.42 0.00 0.00 0.00 175.10 176.32 2fva s THR 26 N 0.89 0.22 -0.66 3.92 -4.23 -1.26 -5.05 115.64 109.47 2fva s THR 26 Ca 0.22 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.96 2fva s THR 26 Cb -0.15 -2.44 -0.05 0.00 1.34 0.00 0.00 72.50 71.20 2fva s THR 26 CO 0.08 0.00 1.15 0.00 -0.54 0.00 0.00 174.62 175.31 2fva n ALA 27 N -0.70 3.28 -0.68 3.99 0.00 -1.26 -3.92 120.51 121.22 2fva n ALA 27 Ca 0.02 -0.35 0.07 0.00 0.00 0.00 0.00 53.44 53.18 2fva n ALA 27 Cb 0.64 -1.05 0.18 0.00 0.00 0.00 0.00 19.45 19.22 2fva n ALA 27 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2fva n ASP 28 N -1.96 3.14 0.01 0.00 8.00 -1.26 -1.00 116.55 123.47 2fva n ASP 28 Ca 0.03 -2.64 0.09 0.00 0.71 0.00 0.00 54.79 52.97 2fva n ASP 28 Cb 0.43 -0.38 0.38 0.00 -0.02 0.00 0.00 41.12 41.53 2fva n ASP 28 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2fva n SER 29 N -0.41 0.04 -2.14 -2.24 2.88 -1.25 -4.92 113.62 105.58 2fva n SER 29 Ca 0.15 0.51 0.00 0.00 -1.33 0.00 0.00 58.87 58.20 2fva n SER 29 Cb 0.65 -0.52 0.00 0.00 -0.75 0.00 0.00 64.21 63.59 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 -1.54 -5.24 -0.20 -1.46 1.02 -1.26 -4.80 120.64 107.16 2fva n GLU 30 Ca 0.04 3.71 -0.05 0.00 -0.02 0.00 0.00 57.16 60.84 2fva n GLU 30 Cb 0.21 -4.18 0.05 0.00 -0.02 0.00 0.00 31.44 27.50 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 4.37 0.66 -3.98 -0.32 -5.15 -1.89 -3.42 116.94 107.21 2fva h PHE 31 Ca 0.00 0.02 -0.54 0.00 -0.20 0.00 0.00 57.97 57.25 2fva h PHE 31 Cb 0.00 -0.22 0.11 0.00 0.22 0.00 0.00 35.95 36.06 2fva h PHE 31 CO 0.00 0.38 0.66 -1.54 -2.00 0.00 0.00 178.31 175.81 2fva s SER 32 N -5.65 5.95 0.02 -0.68 1.04 -1.26 -5.03 113.70 108.10 2fva s SER 32 Ca -0.13 2.81 -0.02 0.00 0.48 0.00 0.00 55.95 59.10 2fva s SER 32 Cb 0.14 -2.65 -0.02 0.00 0.10 0.00 0.00 66.02 63.59 2fva s SER 32 CO 0.75 -1.12 0.01 -0.54 0.98 0.00 0.00 173.24 173.32 2fva s LYS 33 N -2.44 0.40 0.05 4.02 1.02 -1.26 -5.13 119.74 116.39 2fva s LYS 33 Ca 0.61 -0.68 -0.30 0.00 0.02 0.00 0.00 55.97 55.62 2fva s LYS 33 Cb -0.41 0.15 -0.04 0.00 -0.52 0.00 0.00 37.83 37.00 2fva s LYS 33 CO 0.53 -0.08 0.99 -0.51 -0.92 0.00 0.00 175.35 175.36 2fva s LEU 34 N -1.71 4.42 0.00 3.17 1.43 -1.26 -4.84 118.68 119.89 2fva s LEU 34 Ca -0.12 1.74 0.00 0.00 -1.03 0.00 0.00 54.13 54.73 2fva s LEU 34 Cb -0.06 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.58 2fva s LEU 34 CO -0.02 -0.21 0.00 0.61 0.23 0.00 0.00 176.35 176.96 2fva n GLY 35 N 2.67 -0.46 0.32 -3.19 0.00 -1.26 -4.93 105.19 98.34 2fva n GLY 35 Ca 0.05 -1.36 0.01 0.00 0.00 0.00 0.00 46.02 44.72 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 1.46 -2.76 4.61 0.00 -2.09 -3.42 119.26 117.06 2fva h ALA 36 Ca 0.00 -0.10 -0.53 0.00 0.00 0.00 0.00 54.91 54.29 2fva h ALA 36 Cb 0.00 -0.23 0.06 0.00 0.00 0.00 0.00 17.79 17.61 2fva h ALA 36 CO 0.00 0.44 0.75 0.34 0.00 0.00 0.00 179.25 180.78 2fva s ASP 37 N -6.53 6.66 -0.01 0.00 -1.08 -1.26 -5.01 116.67 109.44 2fva s ASP 37 Ca -0.10 2.67 -0.22 0.00 -0.52 0.00 0.00 52.55 54.39 2fva s ASP 37 Cb 0.17 -2.63 0.04 0.00 -1.46 0.00 0.00 42.92 39.05 2fva s ASP 37 CO 0.77 -0.69 0.47 -0.55 0.52 0.00 0.00 175.17 175.70 2fva s SER 38 N 0.27 -0.39 1.16 -0.34 0.15 -1.26 -4.86 113.70 108.43 2fva s SER 38 Ca 0.58 0.29 0.00 0.00 0.70 0.00 0.00 55.95 57.52 2fva s SER 38 Cb -0.42 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.32 2fva s SER 38 CO 0.44 -0.57 0.00 0.18 1.20 0.00 0.00 173.24 174.50 2fva n LEU 39 N 0.94 0.00 -2.41 3.45 4.77 -1.26 -4.78 117.00 117.71 2fva n LEU 39 Ca -0.20 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.62 2fva n LEU 39 Cb 0.57 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.66 2fva n LEU 39 CO 0.22 0.00 -0.20 0.47 -1.33 0.00 0.00 177.39 176.55 2fva n ASP 40 N 8.51 -4.76 -0.20 -1.43 8.00 -1.26 -4.85 116.55 120.56 2fva n ASP 40 Ca 0.00 0.11 -0.07 0.00 0.71 0.00 0.00 54.79 55.54 2fva n ASP 40 Cb 0.00 -4.01 0.03 0.00 -0.02 0.00 0.00 41.12 37.12 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 0.00 1.20 -0.63 -3.53 2.02 -1.94 0.34 112.91 110.37 2fva h THR 41 Ca -0.38 -0.52 -0.04 0.00 0.77 0.00 0.00 66.41 66.24 2fva h THR 41 Cb 1.28 0.48 -0.03 0.00 -1.74 0.00 0.00 68.15 68.14 2fva h THR 41 CO 0.45 0.22 0.24 0.58 0.37 0.00 0.00 175.52 177.38 2fva h VAL 42 N 0.79 1.22 -0.01 3.16 2.07 -1.94 0.23 116.25 121.77 2fva h VAL 42 Ca 0.20 -0.71 -0.03 0.00 0.82 0.00 0.00 66.70 66.98 2fva h VAL 42 Cb 0.08 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2fva h VAL 42 CO -0.03 0.28 -0.11 -0.33 0.02 0.00 0.00 177.57 177.41 2fva h GLU 43 N 0.91 0.10 -0.32 1.57 5.08 -1.82 -2.90 114.58 117.19 2fva h GLU 43 Ca 0.21 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 2fva h GLU 43 Cb 0.19 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2fva h GLU 43 CO -0.02 0.78 0.07 0.82 -1.00 0.00 0.00 179.01 179.66 2fva h ILE 44 N -0.56 1.22 -0.85 3.13 1.08 -0.24 -2.69 117.51 118.61 2fva h ILE 44 Ca -0.01 -0.76 0.00 0.00 -0.39 0.00 0.00 64.86 63.70 2fva h ILE 44 Cb 0.81 1.11 -0.04 0.00 -3.07 0.00 0.00 36.82 35.63 2fva h ILE 44 CO 0.02 0.25 0.53 1.62 -0.69 0.00 0.00 178.15 179.89 2fva h VAL 45 N 0.36 1.23 -0.85 1.67 3.04 -0.67 -1.94 116.25 119.10 2fva h VAL 45 Ca 0.10 -0.47 -0.01 0.00 -1.01 0.00 0.00 66.70 65.31 2fva h VAL 45 Cb 0.31 0.00 -0.04 0.00 -2.01 0.00 0.00 31.29 29.56 2fva h VAL 45 CO 0.00 0.23 0.50 -0.03 -1.01 0.00 0.00 177.57 177.26 2fva h MET 46 N 1.17 1.16 -0.54 4.17 -1.53 -1.33 0.24 114.93 118.28 2fva h MET 46 Ca 0.31 -0.12 -0.01 0.00 -3.44 0.00 0.00 59.70 56.44 2fva h MET 46 Cb -0.08 -0.24 -0.03 0.00 -0.55 0.00 0.00 31.60 30.70 2fva h MET 46 CO -0.06 0.83 0.28 -0.91 0.14 0.00 0.00 176.91 177.19 2fva h ASN 47 N 1.17 0.68 -0.38 1.39 4.21 -1.04 0.66 115.58 122.29 2fva h ASN 47 Ca 0.30 -0.11 -0.11 0.00 1.21 0.00 0.00 56.30 57.60 2fva h ASN 47 Cb -0.02 -0.17 -0.01 0.00 -1.12 0.00 0.00 38.32 36.99 2fva h ASN 47 CO -0.05 0.60 -0.18 -0.07 -1.29 0.00 0.00 177.43 176.43 2fva h LEU 48 N 0.72 0.81 -0.65 1.61 3.38 -0.96 -1.20 115.31 119.02 2fva h LEU 48 Ca 0.19 -0.41 -0.12 0.00 0.09 0.00 0.00 57.88 57.64 2fva h LEU 48 Cb 0.08 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2fva h LEU 48 CO -0.03 1.04 -0.20 -0.08 0.09 0.00 0.00 178.44 179.27 2fva h GLU 49 N 0.59 0.85 0.11 1.13 4.81 -0.24 -1.74 114.58 120.08 2fva h GLU 49 Ca 0.08 -0.34 -0.01 0.00 -0.13 0.00 0.00 59.36 58.97 2fva h GLU 49 Cb 0.73 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.07 2fva h GLU 49 CO 0.06 0.97 -0.05 1.49 -0.73 0.00 0.00 179.01 180.74 2fva h GLU 50 N 0.74 -0.14 0.53 1.92 4.81 0.45 0.94 114.58 123.83 2fva h GLU 50 Ca 0.11 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.32 2fva h GLU 50 Cb 0.72 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.13 2fva h GLU 50 CO 0.06 0.20 -0.30 1.49 -0.73 0.00 0.00 179.01 179.73 2fva h GLU 51 N -0.50 -0.75 0.00 1.92 4.22 -1.23 -2.32 114.58 115.92 2fva h GLU 51 Ca -0.01 0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.48 2fva h GLU 51 Cb 0.41 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2fva h GLU 51 CO 0.02 -0.50 0.00 1.19 -2.18 0.00 0.00 179.01 177.54 2fva n PHE 52 N -5.44 0.00 -3.95 0.92 3.72 -0.66 -4.91 117.46 107.14 2fva n PHE 52 Ca -0.12 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.00 2fva n PHE 52 Cb 0.34 -0.42 0.00 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 1.12 -0.35 0.00 1.37 0.00 0.32 -4.97 105.19 102.68 2fva n GLY 53 Ca 0.09 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.26 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 -4.44 0.00 -3.88 -0.61 -5.35 -0.63 -5.01 119.36 99.44 2fva n ILE 54 Ca -0.14 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.03 2fva n ILE 54 Cb 0.61 -0.68 -0.14 0.00 -1.74 0.00 0.00 39.64 37.68 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 -0.80 4.31 -0.20 7.28 6.03 -1.26 -4.85 114.94 125.44 2fva s ASN 55 Ca 0.00 -2.27 -0.08 0.00 -1.03 0.00 0.00 52.86 49.48 2fva s ASN 55 Cb 0.00 -1.34 -0.04 0.00 -3.03 0.00 0.00 41.25 36.84 2fva s ASN 55 CO 0.00 -0.34 0.09 -0.69 -2.03 0.00 0.00 177.10 174.13 2fva s VAL 56 N 0.77 4.97 0.21 3.54 1.01 -1.26 -5.01 120.40 124.63 2fva s VAL 56 Ca 0.13 0.04 -0.24 0.00 0.00 0.00 0.00 61.98 61.90 2fva s VAL 56 Cb -0.21 -3.27 -0.08 0.00 0.00 0.00 0.00 36.38 32.82 2fva s VAL 56 CO -0.09 0.42 0.80 -1.81 0.00 0.00 0.00 175.10 174.42 2fva s ASP 57 N 0.61 7.31 0.66 3.32 1.01 -1.26 -4.92 116.67 123.39 2fva s ASP 57 Ca 0.05 1.64 0.36 0.00 0.71 0.00 0.00 52.55 55.30 2fva s ASP 57 Cb -0.13 -2.50 1.95 0.00 1.01 0.00 0.00 42.92 43.25 2fva s ASP 57 CO 0.01 0.11 2.09 -0.33 0.21 0.00 0.00 175.17 177.27 2fva h GLU 58 N 3.87 0.00 0.00 8.23 5.08 -1.98 0.42 114.58 130.21 2fva h GLU 58 Ca -0.47 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.81 2fva h GLU 58 Cb 1.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 2fva h GLU 58 CO 0.66 0.00 -1.01 -0.44 -1.00 0.00 0.00 179.01 177.21 2fva h ASP 59 N 0.00 0.00 0.11 1.42 3.32 -2.00 -3.29 116.42 115.97 2fva h ASP 59 Ca 0.00 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.80 2fva h ASP 59 Cb 0.38 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.96 2fva h ASP 59 CO 0.00 0.28 -1.05 0.50 -1.72 0.00 0.00 179.24 177.24 2fva h LYS 60 N 0.00 0.52 -0.97 3.56 1.63 -0.55 -3.23 116.57 117.54 2fva h LYS 60 Ca -0.06 -0.71 -0.25 0.00 -0.85 0.00 0.00 60.65 58.78 2fva h LYS 60 Cb 1.27 0.24 -0.15 0.00 -0.60 0.00 0.00 32.23 32.99 2fva h LYS 60 CO 0.02 1.31 0.31 0.00 -3.45 0.00 0.00 179.45 177.65 2fva n ALA 61 N -2.66 4.09 -0.12 5.00 0.00 -0.84 -4.51 120.51 121.46 2fva n ALA 61 Ca -0.13 -1.53 0.00 0.00 0.00 0.00 0.00 53.44 51.78 2fva n ALA 61 Cb 0.90 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 19.13 2fva n ALA 61 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2fva n GLN 62 N -0.30 0.00 -3.55 0.00 6.02 -1.22 -4.60 117.38 113.73 2fva n GLN 62 Ca 0.31 0.44 -0.27 0.00 -0.01 0.00 0.00 57.00 57.47 2fva n GLN 62 Cb 1.10 -1.20 -0.09 0.00 1.02 0.00 0.00 30.24 31.06 2fva n GLN 62 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2fva n ASP 63 N -1.83 2.54 -4.75 1.08 -0.08 -1.26 -5.08 116.55 107.17 2fva n ASP 63 Ca 0.00 -3.14 -0.39 0.00 -1.51 0.00 0.00 54.79 49.75 2fva n ASP 63 Cb 0.00 -0.68 -0.06 0.00 2.34 0.00 0.00 41.12 42.72 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 -1.67 5.00 0.03 5.18 -1.09 -1.26 -5.07 121.20 122.32 2fva s ILE 64 Ca 0.33 1.18 -0.00 0.00 -2.23 0.00 0.00 60.65 59.92 2fva s ILE 64 Cb 0.07 -3.90 0.01 0.00 -1.58 0.00 0.00 42.46 37.06 2fva s ILE 64 CO -0.10 0.38 0.02 -1.54 -1.23 0.00 0.00 174.94 172.47 2fva n SER 65 N 3.03 -1.66 -3.23 3.58 3.41 -1.26 -4.92 113.62 112.57 2fva n SER 65 Ca -0.07 -0.20 -0.02 0.00 -0.26 0.00 0.00 58.87 58.32 2fva n SER 65 Cb 0.51 -0.02 0.02 0.00 -0.26 0.00 0.00 64.21 64.46 2fva n SER 65 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2fva n THR 66 N -2.86 0.00 -0.25 6.66 5.66 -1.26 -4.19 114.28 118.04 2fva n THR 66 Ca 0.00 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.95 2fva n THR 66 Cb 0.01 -0.07 0.05 0.00 -1.55 0.00 0.00 70.33 68.78 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 -1.59 1.18 -0.89 1.09 2.04 -1.90 -2.07 117.51 115.36 2fva h ILE 67 Ca -0.03 -0.32 0.13 0.00 1.00 0.00 0.00 64.86 65.64 2fva h ILE 67 Cb 0.09 0.16 -0.14 0.00 -0.74 0.00 0.00 36.82 36.19 2fva h ILE 67 CO 0.02 0.17 -0.43 1.56 0.00 0.00 0.00 178.15 179.47 2fva h GLN 68 N 0.93 -0.05 -0.44 2.37 1.08 -1.37 1.02 115.11 118.65 2fva h GLN 68 Ca 0.25 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.35 2fva h GLN 68 Cb -0.11 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.32 2fva h GLN 68 CO -0.06 -0.03 -0.14 0.37 -0.95 0.00 0.00 178.83 178.02 2fva h GLN 69 N -0.05 0.87 -0.53 1.46 4.15 -1.77 -2.37 115.11 116.87 2fva h GLN 69 Ca 0.27 -0.35 0.05 0.00 0.77 0.00 0.00 58.65 59.39 2fva h GLN 69 Cb 0.55 -0.04 -0.05 0.00 0.21 0.00 0.00 27.48 28.15 2fva h GLN 69 CO -0.90 0.99 0.26 0.00 -1.93 0.00 0.00 178.83 177.25 2fva h ALA 70 N 0.85 0.68 -0.81 3.38 0.00 0.17 0.21 119.26 123.74 2fva h ALA 70 Ca 0.11 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2fva h ALA 70 Cb 0.69 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2fva h ALA 70 CO 0.05 -0.09 0.33 0.00 0.00 0.00 0.00 179.25 179.54 2fva h ALA 71 N 1.29 1.05 -0.62 0.00 0.00 0.98 -2.35 119.26 119.61 2fva h ALA 71 Ca 0.24 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2fva h ALA 71 Cb 0.16 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2fva h ALA 71 CO -0.17 0.67 0.11 -0.44 0.00 0.00 0.00 179.25 179.42 2fva h ASP 72 N 1.18 0.95 -0.55 0.00 3.32 -0.80 -2.01 116.42 118.50 2fva h ASP 72 Ca 0.27 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 2fva h ASP 72 Cb 0.21 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 2fva h ASP 72 CO -0.02 0.94 0.30 0.58 -1.72 0.00 0.00 179.24 179.32 2fva h VAL 73 N 0.94 1.18 -0.59 -1.35 2.07 -0.59 -2.65 116.25 115.27 2fva h VAL 73 Ca 0.19 -0.47 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 2fva h VAL 73 Cb 0.39 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 2fva h VAL 73 CO 0.01 0.20 0.25 0.40 0.02 0.00 0.00 177.57 178.45 2fva h ILE 74 N 0.75 1.22 -0.92 4.57 2.04 -1.19 -2.49 117.51 121.49 2fva h ILE 74 Ca 0.20 -0.67 0.18 0.00 1.00 0.00 0.00 64.86 65.56 2fva h ILE 74 Cb 0.05 0.56 -0.10 0.00 -0.74 0.00 0.00 36.82 36.58 2fva h ILE 74 CO -0.03 0.26 0.50 -0.33 0.00 0.00 0.00 178.15 178.55 2fva h GLU 75 N 0.81 0.62 0.00 2.37 5.08 -1.02 0.53 114.58 122.98 2fva h GLU 75 Ca 0.20 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.45 2fva h GLU 75 Cb 0.18 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2fva h GLU 75 CO -0.02 0.41 -0.33 0.78 -1.00 0.00 0.00 179.01 178.85 2fva h GLY 76 N 0.64 0.00 -0.15 -3.84 0.00 -1.24 -2.67 103.07 95.81 2fva h GLY 76 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.86 2fva h GLY 76 CO -0.40 0.00 -0.04 1.04 0.00 0.00 0.00 176.54 177.14 2fva n LEU 77 N -3.47 1.22 -0.22 3.11 4.77 0.16 -3.45 117.00 119.13 2fva n LEU 77 Ca 0.00 -0.39 0.11 0.00 -0.03 0.00 0.00 56.01 55.70 2fva n LEU 77 Cb 0.49 -0.02 0.04 0.00 -2.33 0.00 0.00 43.42 41.60 2fva n LEU 77 CO 0.36 0.21 0.24 0.18 -1.33 0.00 0.00 177.39 177.05 2fva n LEU 78 N -0.11 1.32 -0.11 2.23 4.77 0.12 -4.13 117.00 121.08 2fva n LEU 78 Ca 0.19 -0.50 0.06 0.00 -0.03 0.00 0.00 56.01 55.73 2fva n LEU 78 Cb 0.32 -0.05 -0.05 0.00 -2.33 0.00 0.00 43.42 41.31 2fva n LEU 78 CO 0.18 0.27 0.06 -0.62 -1.33 0.00 0.00 177.39 175.95 2fva n GLU 79 N -0.84 2.37 -0.37 3.23 1.02 -1.22 -4.59 120.64 120.23 2fva n GLU 79 Ca 0.07 -0.24 0.29 0.00 -0.02 0.00 0.00 57.16 57.26 2fva n GLU 79 Cb 0.38 -1.15 0.46 0.00 -0.02 0.00 0.00 31.44 31.11 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 -0.93 -0.01 -0.24 3.49 0.00 -1.25 0.31 118.16 119.53 2fva n LYS 80 Ca 0.04 0.68 -0.06 0.00 -0.00 0.00 0.00 58.31 58.97 2fva n LYS 80 Cb 0.23 -1.47 0.05 0.00 -0.00 0.00 0.00 35.03 33.84 2fva n LYS 80 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 2fva h LYS 81 N 0.00 0.91 0.00 -1.58 3.64 -1.90 -3.53 116.57 114.11 2fva h LYS 81 Ca 0.54 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.85 2fva h LYS 81 Cb 2.04 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 33.67 2fva h LYS 81 CO -0.10 0.64 0.00 0.00 -2.27 0.00 0.00 179.45 177.72