#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 4.43 0.25 0.00 1.02 -1.26 -4.93 119.74 119.25 2fva s LYS 2 Ca 0.00 1.17 -0.05 0.00 0.02 0.00 0.00 55.97 57.11 2fva s LYS 2 Cb 0.00 -2.69 0.32 0.00 -0.52 0.00 0.00 37.83 34.93 2fva s LYS 2 CO 0.00 0.24 1.90 0.87 -0.92 0.00 0.00 175.35 177.45 2fva h LYS 3 N 2.96 1.22 -0.57 1.68 1.57 -2.01 0.99 116.57 122.40 2fva h LYS 3 Ca -0.47 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.22 2fva h LYS 3 Cb 1.19 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 33.20 2fva h LYS 3 CO 0.64 0.80 0.29 1.05 -0.57 0.00 0.00 179.45 181.67 2fva h GLU 4 N 1.25 0.81 -0.40 3.15 4.11 -1.99 -0.38 114.58 121.13 2fva h GLU 4 Ca 0.39 -0.11 -0.09 0.00 0.07 0.00 0.00 59.36 59.63 2fva h GLU 4 Cb -0.01 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 2fva h GLU 4 CO -0.12 0.64 -0.08 1.15 0.07 0.00 0.00 179.01 180.67 2fva h THR 5 N 0.77 1.27 -0.44 -1.06 2.02 -1.77 -1.30 112.91 112.40 2fva h THR 5 Ca 0.20 -1.16 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 2fva h THR 5 Cb 0.08 1.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 2fva h THR 5 CO -0.03 0.39 0.27 0.40 0.37 0.00 0.00 175.52 176.93 2fva h ILE 6 N 0.59 1.13 -0.35 3.11 2.04 -0.56 -0.56 117.51 122.92 2fva h ILE 6 Ca 0.10 -0.29 -0.08 0.00 1.00 0.00 0.00 64.86 65.60 2fva h ILE 6 Cb 0.60 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 2fva h ILE 6 CO 0.04 0.13 -0.13 0.44 0.00 0.00 0.00 178.15 178.63 2fva h ASP 7 N 0.59 0.60 -0.39 1.72 3.32 -1.00 -2.61 116.42 118.64 2fva h ASP 7 Ca 0.16 -0.17 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 2fva h ASP 7 Cb -0.02 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 2fva h ASP 7 CO -0.03 0.76 0.11 0.11 -1.72 0.00 0.00 179.24 178.47 2fva h LYS 8 N 0.56 0.62 -0.51 3.56 1.79 -0.64 -1.79 116.57 120.16 2fva h LYS 8 Ca 0.10 -0.14 0.02 0.00 -2.18 0.00 0.00 60.65 58.44 2fva h LYS 8 Cb 0.55 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 31.09 2fva h LYS 8 CO 0.04 0.63 0.31 0.28 -1.08 0.00 0.00 179.45 179.63 2fva h VAL 9 N 0.49 1.08 -0.85 0.50 2.07 -0.92 -2.09 116.25 116.53 2fva h VAL 9 Ca 0.13 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 2fva h VAL 9 Cb 0.28 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 2fva h VAL 9 CO -0.00 0.12 0.53 0.77 0.02 0.00 0.00 177.57 179.00 2fva h SER 10 N 0.63 1.01 -0.66 0.57 4.64 -1.31 -2.70 113.55 115.72 2fva h SER 10 Ca 0.20 -0.05 0.10 0.00 -0.47 0.00 0.00 61.79 61.56 2fva h SER 10 Cb -0.02 -0.25 -0.07 0.00 -0.31 0.00 0.00 62.40 61.75 2fva h SER 10 CO -0.07 0.76 0.29 -0.78 -0.87 0.00 0.00 176.83 176.16 2fva h ASP 11 N 1.16 0.34 -0.68 4.97 3.58 -0.64 -1.18 116.42 123.97 2fva h ASP 11 Ca 0.31 0.07 0.14 0.00 0.42 0.00 0.00 57.03 57.97 2fva h ASP 11 Cb -0.07 0.02 -0.10 0.00 1.72 0.00 0.00 39.33 40.90 2fva h ASP 11 CO -0.06 0.19 0.14 0.40 -2.88 0.00 0.00 179.24 177.03 2fva h ILE 12 N 0.50 0.55 -0.33 2.25 5.03 -1.18 1.71 117.51 126.04 2fva h ILE 12 Ca 0.33 -0.09 -0.03 0.00 -0.12 0.00 0.00 64.86 64.96 2fva h ILE 12 Cb 0.39 0.28 -0.01 0.00 -3.03 0.00 0.00 36.82 34.44 2fva h ILE 12 CO -0.29 0.05 0.09 0.58 -0.68 0.00 0.00 178.15 177.89 2fva h VAL 13 N 0.25 1.21 -0.41 1.67 2.07 -1.28 -2.88 116.25 116.89 2fva h VAL 13 Ca 0.37 -0.71 -0.13 0.00 0.82 0.00 0.00 66.70 67.05 2fva h VAL 13 Cb 0.61 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 2fva h VAL 13 CO -0.48 0.24 -0.24 0.11 0.02 0.00 0.00 177.57 177.22 2fva h LYS 14 N 0.37 0.88 -0.94 1.57 1.57 -0.48 -2.94 116.57 116.61 2fva h LYS 14 Ca 0.10 -0.41 0.22 0.00 -1.87 0.00 0.00 60.65 58.70 2fva h LYS 14 Cb 0.28 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.50 2fva h LYS 14 CO -0.00 1.05 0.62 0.93 -0.57 0.00 0.00 179.45 181.49 2fva h GLU 15 N 0.70 0.36 -0.56 3.15 5.08 0.26 2.02 114.58 125.59 2fva h GLU 15 Ca 0.08 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2fva h GLU 15 Cb 0.82 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 2fva h GLU 15 CO 0.07 0.24 0.29 0.87 -1.00 0.00 0.00 179.01 179.48 2fva h LYS 16 N 0.38 0.79 -0.02 2.33 1.57 -1.32 -2.33 116.57 117.97 2fva h LYS 16 Ca 0.50 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 2fva h LYS 16 Cb 1.29 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2fva h LYS 16 CO -0.19 0.62 -0.07 1.28 -0.57 0.00 0.00 179.45 180.53 2fva n LEU 17 N -4.59 2.12 -1.22 2.94 7.99 0.85 -4.93 117.00 120.17 2fva n LEU 17 Ca 0.03 -0.71 -0.11 0.00 -0.01 0.00 0.00 56.01 55.21 2fva n LEU 17 Cb 0.10 -0.01 -0.01 0.00 -0.11 0.00 0.00 43.42 43.39 2fva n LEU 17 CO 0.37 0.36 -0.14 0.00 -1.51 0.00 0.00 177.39 176.47 2fva n ALA 18 N 0.56 -0.31 -1.93 -1.18 0.00 0.64 -5.02 120.51 113.28 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 0.47 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.53 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 -1.55 0.00 0.00 0.00 4.32 0.11 -4.61 117.00 115.27 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 0.58 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.38 2fva n LEU 19 CO 0.15 -0.48 0.00 0.61 -1.22 0.00 0.00 177.39 176.45 2fva n GLY 20 N 5.00 0.91 0.00 -0.72 0.00 -1.26 -4.45 105.19 104.68 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 -1.06 0.00 -0.89 4.61 0.00 -1.26 -4.57 120.51 117.34 2fva n ALA 21 Ca 0.00 -0.05 0.08 0.00 0.00 0.00 0.00 53.44 53.47 2fva n ALA 21 Cb 0.00 0.00 0.35 0.00 0.00 0.00 0.00 19.45 19.80 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 -1.63 5.01 -4.22 0.00 -0.08 -1.26 -4.93 116.55 109.45 2fva n ASP 22 Ca 0.00 -2.89 -0.30 0.00 -1.51 0.00 0.00 54.79 50.09 2fva n ASP 22 Cb 0.00 -0.62 -0.16 0.00 2.34 0.00 0.00 41.12 42.68 2fva n ASP 22 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2fva s VAL 23 N -2.65 1.85 0.37 5.18 1.01 -1.26 -5.11 120.40 119.78 2fva s VAL 23 Ca 0.50 -0.95 -0.28 0.00 0.00 0.00 0.00 61.98 61.25 2fva s VAL 23 Cb 0.38 -1.57 -0.10 0.00 0.00 0.00 0.00 36.38 35.09 2fva s VAL 23 CO 0.15 0.52 1.34 0.54 0.00 0.00 0.00 175.10 177.65 2fva s VAL 24 N -0.09 2.54 -0.11 2.92 0.11 -1.26 -4.28 120.40 120.23 2fva s VAL 24 Ca -0.04 0.53 0.03 0.00 -2.93 0.00 0.00 61.98 59.57 2fva s VAL 24 Cb -0.13 -3.33 -0.01 0.00 -1.53 0.00 0.00 36.38 31.39 2fva s VAL 24 CO 0.03 0.11 -0.21 -0.69 -3.33 0.00 0.00 175.10 171.01 2fva s VAL 25 N -1.18 2.37 0.03 2.04 1.01 -1.26 -4.95 120.40 118.46 2fva s VAL 25 Ca 0.53 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.60 2fva s VAL 25 Cb -0.40 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 2fva s VAL 25 CO 0.53 0.55 -0.05 0.42 0.00 0.00 0.00 175.10 176.55 2fva s THR 26 N 0.31 0.31 -0.01 3.92 -4.23 -1.26 -5.05 115.64 109.62 2fva s THR 26 Ca -0.16 -1.07 -0.01 0.00 -1.18 0.00 0.00 61.69 59.27 2fva s THR 26 Cb -0.17 -0.53 -0.27 0.00 1.34 0.00 0.00 72.50 72.87 2fva s THR 26 CO 0.08 -0.50 0.79 0.00 -0.54 0.00 0.00 174.62 174.45 2fva h ALA 27 N 4.43 0.36 -0.05 3.99 0.00 -1.96 -3.28 119.26 122.75 2fva h ALA 27 Ca -0.34 -1.19 0.00 0.00 0.00 0.00 0.00 54.91 53.39 2fva h ALA 27 Cb 1.20 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.33 2fva h ALA 27 CO 0.43 1.23 0.00 -0.25 0.00 0.00 0.00 179.25 180.66 2fva n ASP 28 N -3.40 0.70 -0.95 0.00 9.92 -1.26 -2.85 116.55 118.72 2fva n ASP 28 Ca -0.18 -2.03 0.07 0.00 -0.53 0.00 0.00 54.79 52.13 2fva n ASP 28 Cb 1.04 -0.22 0.22 0.00 -0.64 0.00 0.00 41.12 41.51 2fva n ASP 28 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2fva n SER 29 N -0.19 2.75 -1.44 -2.24 7.64 -1.24 -5.01 113.62 113.88 2fva n SER 29 Ca 0.02 -2.08 0.08 0.00 1.01 0.00 0.00 58.87 57.89 2fva n SER 29 Cb 0.15 -0.36 -0.04 0.00 -1.01 0.00 0.00 64.21 62.95 2fva n SER 29 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2fva n GLU 30 N 0.82 -3.33 -0.18 1.43 1.02 -1.22 -4.56 120.64 114.62 2fva n GLU 30 Ca 0.16 2.65 -0.08 0.00 -0.02 0.00 0.00 57.16 59.88 2fva n GLU 30 Cb 0.46 -3.60 0.02 0.00 -0.02 0.00 0.00 31.44 28.31 2fva n GLU 30 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 2fva h PHE 31 N -0.63 0.73 -3.14 -0.32 -1.00 -1.89 -3.45 116.94 107.24 2fva h PHE 31 Ca -0.09 -0.03 -0.02 0.00 2.81 0.00 0.00 57.97 60.64 2fva h PHE 31 Cb 1.05 -0.23 -0.11 0.00 3.61 0.00 0.00 35.95 40.27 2fva h PHE 31 CO 0.06 0.56 0.12 -1.54 -1.61 0.00 0.00 178.31 175.90 2fva s SER 32 N -5.87 -0.42 0.27 2.17 1.04 -1.26 -5.03 113.70 104.59 2fva s SER 32 Ca -0.13 -0.19 -0.15 0.00 0.48 0.00 0.00 55.95 55.96 2fva s SER 32 Cb 0.12 0.58 -0.08 0.00 0.10 0.00 0.00 66.02 66.73 2fva s SER 32 CO 0.76 -0.98 0.69 -0.54 0.98 0.00 0.00 173.24 174.15 2fva s LYS 33 N -3.79 4.04 0.27 4.02 1.02 -1.26 -5.04 119.74 118.99 2fva s LYS 33 Ca 0.03 0.65 -0.29 0.00 0.02 0.00 0.00 55.97 56.38 2fva s LYS 33 Cb -0.01 -2.63 -0.09 0.00 -0.52 0.00 0.00 37.83 34.58 2fva s LYS 33 CO -0.10 0.27 1.17 -0.51 -0.92 0.00 0.00 175.35 175.26 2fva s LEU 34 N -2.59 4.50 0.00 3.17 1.43 -1.26 -4.78 118.68 119.14 2fva s LEU 34 Ca 0.49 2.36 0.00 0.00 -1.03 0.00 0.00 54.13 55.95 2fva s LEU 34 Cb -0.12 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.47 2fva s LEU 34 CO 0.19 -0.29 0.00 0.61 0.23 0.00 0.00 176.35 177.09 2fva n GLY 35 N 1.34 -1.50 0.33 -3.19 0.00 -1.26 -4.96 105.19 95.95 2fva n GLY 35 Ca 0.00 -1.23 -0.01 0.00 0.00 0.00 0.00 46.02 44.79 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 1.38 -2.38 4.61 0.00 -2.07 -3.38 119.26 117.42 2fva h ALA 36 Ca 0.00 -0.11 -0.65 0.00 0.00 0.00 0.00 54.91 54.15 2fva h ALA 36 Cb 0.00 -0.26 -0.15 0.00 0.00 0.00 0.00 17.79 17.39 2fva h ALA 36 CO 0.00 0.50 0.01 0.34 0.00 0.00 0.00 179.25 180.10 2fva s ASP 37 N -6.48 6.34 0.03 0.00 2.15 -1.26 -5.04 116.67 112.40 2fva s ASP 37 Ca -0.10 -0.05 0.02 0.00 0.43 0.00 0.00 52.55 52.85 2fva s ASP 37 Cb 0.17 -2.29 -0.02 0.00 -0.30 0.00 0.00 42.92 40.48 2fva s ASP 37 CO 0.78 -0.55 -0.08 -0.55 -0.17 0.00 0.00 175.17 174.61 2fva s SER 38 N 1.80 0.87 0.43 -0.34 0.15 -1.26 -4.82 113.70 110.52 2fva s SER 38 Ca 0.20 -0.42 -0.21 0.00 0.70 0.00 0.00 55.95 56.22 2fva s SER 38 Cb -0.15 -0.00 -0.11 0.00 -1.71 0.00 0.00 66.02 64.05 2fva s SER 38 CO 0.14 -0.11 0.96 -0.76 1.20 0.00 0.00 173.24 174.67 2fva s LEU 39 N -1.17 3.95 -0.15 3.45 1.02 -1.26 -5.01 118.68 119.52 2fva s LEU 39 Ca -0.06 1.71 -0.29 0.00 0.02 0.00 0.00 54.13 55.51 2fva s LEU 39 Cb -0.08 -4.52 -0.01 0.00 0.02 0.00 0.00 46.19 41.61 2fva s LEU 39 CO 0.00 -0.37 1.12 -1.81 0.02 0.00 0.00 176.35 175.31 2fva s ASP 40 N -2.14 7.09 0.32 2.29 1.01 -1.26 -4.92 116.67 119.06 2fva s ASP 40 Ca 0.62 1.59 0.01 0.00 0.71 0.00 0.00 52.55 55.48 2fva s ASP 40 Cb -0.10 -2.55 0.53 0.00 1.01 0.00 0.00 42.92 41.82 2fva s ASP 40 CO 0.14 -0.62 1.92 0.74 0.21 0.00 0.00 175.17 177.56 2fva h THR 41 N 5.28 1.19 -0.58 -1.27 2.02 -1.95 -1.93 112.91 115.68 2fva h THR 41 Ca -0.27 -0.58 0.03 0.00 0.77 0.00 0.00 66.41 66.36 2fva h THR 41 Cb 1.11 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 2fva h THR 41 CO 0.93 0.23 0.38 0.58 0.37 0.00 0.00 175.52 178.01 2fva h VAL 42 N 0.78 1.09 -0.05 3.16 2.07 -1.93 0.17 116.25 121.55 2fva h VAL 42 Ca 0.19 -0.24 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 2fva h VAL 42 Cb 0.12 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 2fva h VAL 42 CO -0.02 0.13 -0.13 -0.33 0.02 0.00 0.00 177.57 177.23 2fva h GLU 43 N 0.70 0.17 -0.04 1.57 5.08 -1.77 -2.29 114.58 118.00 2fva h GLU 43 Ca 0.23 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2fva h GLU 43 Cb 0.04 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2fva h GLU 43 CO -0.06 0.74 0.01 0.82 -1.00 0.00 0.00 179.01 179.53 2fva h ILE 44 N -0.37 1.15 -0.50 3.13 1.08 -1.03 -0.84 117.51 120.14 2fva h ILE 44 Ca -0.00 -0.44 0.00 0.00 -0.39 0.00 0.00 64.86 64.03 2fva h ILE 44 Cb 0.75 1.37 -0.02 0.00 -3.07 0.00 0.00 36.82 35.85 2fva h ILE 44 CO 0.03 0.12 0.32 1.62 -0.69 0.00 0.00 178.15 179.55 2fva h VAL 45 N -0.11 1.13 -0.85 1.67 3.04 -0.78 -1.36 116.25 118.99 2fva h VAL 45 Ca 0.01 -0.26 -0.03 0.00 -1.01 0.00 0.00 66.70 65.41 2fva h VAL 45 Cb 0.18 0.42 -0.04 0.00 -2.01 0.00 0.00 31.29 29.84 2fva h VAL 45 CO -0.00 0.13 0.39 -0.03 -1.01 0.00 0.00 177.57 177.05 2fva h MET 46 N 0.67 1.23 -0.35 4.17 1.85 -1.33 0.14 114.93 121.31 2fva h MET 46 Ca 0.18 -0.19 -0.02 0.00 -0.61 0.00 0.00 59.70 59.06 2fva h MET 46 Cb -0.06 -0.22 -0.02 0.00 0.43 0.00 0.00 31.60 31.74 2fva h MET 46 CO -0.04 0.95 0.14 -0.91 -0.40 0.00 0.00 176.91 176.66 2fva h ASN 47 N 1.21 0.48 -0.34 1.39 4.21 -0.68 0.07 115.58 121.91 2fva h ASN 47 Ca 0.29 -0.16 -0.05 0.00 1.21 0.00 0.00 56.30 57.59 2fva h ASN 47 Cb 0.14 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 37.20 2fva h ASN 47 CO -0.03 0.51 0.02 -0.07 -1.29 0.00 0.00 177.43 176.57 2fva h LEU 48 N 0.42 0.58 -1.53 1.61 3.38 -0.98 0.39 115.31 119.18 2fva h LEU 48 Ca 0.12 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 2fva h LEU 48 Cb 0.18 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2fva h LEU 48 CO -0.01 0.73 0.01 -0.08 0.09 0.00 0.00 178.44 179.18 2fva h GLU 49 N 0.41 0.31 0.09 1.13 4.81 -0.85 0.17 114.58 120.66 2fva h GLU 49 Ca 0.10 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 59.14 2fva h GLU 49 Cb 0.42 -0.06 0.02 0.00 0.63 0.00 0.00 28.75 29.76 2fva h GLU 49 CO 0.01 0.33 -0.63 1.49 -0.73 0.00 0.00 179.01 179.49 2fva h GLU 50 N 0.31 0.26 0.05 1.92 4.81 -0.61 0.75 114.58 122.08 2fva h GLU 50 Ca 0.07 -0.41 -0.00 0.00 -0.13 0.00 0.00 59.36 58.90 2fva h GLU 50 Cb 0.19 0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.71 2fva h GLU 50 CO 0.00 1.17 -0.02 1.49 -0.73 0.00 0.00 179.01 180.92 2fva h GLU 51 N -0.43 -0.06 0.00 1.92 4.57 0.02 -2.79 114.58 117.80 2fva h GLU 51 Ca -0.10 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.04 2fva h GLU 51 Cb 1.46 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 30.06 2fva h GLU 51 CO 0.12 0.11 -0.19 0.74 -1.18 0.00 0.00 179.01 178.61 2fva h PHE 52 N -0.22 0.00 -3.03 0.92 0.04 -0.82 -3.47 116.94 110.35 2fva h PHE 52 Ca -0.01 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.54 2fva h PHE 52 Cb 0.20 0.00 0.05 0.00 2.20 0.00 0.00 35.95 38.40 2fva h PHE 52 CO -0.02 0.19 -0.35 0.41 -0.60 0.00 0.00 178.31 177.93 2fva n GLY 53 N 0.70 0.05 0.00 -1.45 0.00 0.14 -4.94 105.19 99.69 2fva n GLY 53 Ca 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.93 0.00 -3.70 -0.61 -5.35 -0.51 -4.51 119.36 100.75 2fva n ILE 54 Ca -0.04 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.16 2fva n ILE 54 Cb 0.56 -0.63 -0.16 0.00 -1.74 0.00 0.00 39.64 37.67 2fva n ILE 54 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 2fva s ASN 55 N -0.49 3.07 -0.07 7.28 0.02 -1.23 -4.79 114.94 118.73 2fva s ASN 55 Ca 0.00 -0.96 0.04 0.00 -1.02 0.00 0.00 52.86 50.92 2fva s ASN 55 Cb 0.00 -0.57 -0.00 0.00 0.02 0.00 0.00 41.25 40.70 2fva s ASN 55 CO 0.00 -0.34 -0.20 0.54 0.02 0.00 0.00 177.10 177.12 2fva s VAL 56 N 1.88 1.73 0.49 1.60 0.11 -1.26 -5.01 120.40 119.94 2fva s VAL 56 Ca 0.02 -0.85 -0.05 0.00 -2.93 0.00 0.00 61.98 58.17 2fva s VAL 56 Cb -0.17 -1.50 -0.03 0.00 -1.53 0.00 0.00 36.38 33.16 2fva s VAL 56 CO -0.13 0.49 0.79 -0.62 -3.33 0.00 0.00 175.10 172.29 2fva s ASP 57 N 0.23 6.15 0.42 3.54 2.15 -1.26 -4.98 116.67 122.91 2fva s ASP 57 Ca -0.11 0.85 0.12 0.00 0.43 0.00 0.00 52.55 53.84 2fva s ASP 57 Cb -0.15 -2.13 0.89 0.00 -0.30 0.00 0.00 42.92 41.23 2fva s ASP 57 CO 0.05 -0.64 1.95 1.05 -0.17 0.00 0.00 175.17 177.41 2fva h GLU 58 N 0.19 0.11 0.00 4.34 4.11 -2.01 -1.30 114.58 120.02 2fva h GLU 58 Ca -0.47 -0.02 -0.01 0.00 0.07 0.00 0.00 59.36 58.92 2fva h GLU 58 Cb 1.21 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.45 2fva h GLU 58 CO 0.61 0.28 -0.07 -0.44 0.07 0.00 0.00 179.01 179.46 2fva h ASP 59 N 0.10 0.00 0.69 3.06 3.32 -2.01 -1.85 116.42 119.74 2fva h ASP 59 Ca 0.02 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 2fva h ASP 59 Cb 0.36 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 2fva h ASP 59 CO 0.02 0.07 -1.34 1.17 -1.72 0.00 0.00 179.24 177.45 2fva n LYS 60 N -3.35 0.62 -2.05 3.56 3.00 -0.54 -4.21 118.16 115.19 2fva n LYS 60 Ca -0.01 0.06 -0.29 0.00 -0.00 0.00 0.00 58.31 58.07 2fva n LYS 60 Cb 0.24 -1.75 0.03 0.00 0.00 0.00 0.00 35.03 33.55 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 -2.25 5.44 -0.01 3.14 0.00 -0.74 -4.56 120.51 121.53 2fva n ALA 61 Ca -0.04 -3.96 -0.02 0.00 0.00 0.00 0.00 53.44 49.43 2fva n ALA 61 Cb 0.62 -0.84 -0.02 0.00 0.00 0.00 0.00 19.45 19.21 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 -0.65 1.43 -2.46 0.00 10.64 -0.93 -4.80 117.38 120.61 2fva n GLN 62 Ca 0.47 0.01 -0.16 0.00 -1.83 0.00 0.00 57.00 55.49 2fva n GLN 62 Cb 0.72 -1.06 0.02 0.00 -0.86 0.00 0.00 30.24 29.06 2fva n GLN 62 CO 0.00 0.00 0.00 -0.40 -1.83 0.00 0.00 177.06 174.83 2fva n ASP 63 N -2.40 3.37 -4.70 2.61 5.75 -1.26 -5.06 116.55 114.85 2fva n ASP 63 Ca -0.05 -3.12 -0.39 0.00 -0.01 0.00 0.00 54.79 51.22 2fva n ASP 63 Cb 0.57 -0.44 -0.05 0.00 -1.03 0.00 0.00 41.12 40.16 2fva n ASP 63 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2fva s ILE 64 N -4.35 5.08 0.00 2.12 -1.09 -1.26 -5.06 121.20 116.63 2fva s ILE 64 Ca 0.40 1.20 0.00 0.00 -2.23 0.00 0.00 60.65 60.02 2fva s ILE 64 Cb 0.40 -3.94 0.00 0.00 -1.58 0.00 0.00 42.46 37.34 2fva s ILE 64 CO -0.04 0.23 0.00 -1.54 -1.23 0.00 0.00 174.94 172.36 2fva n SER 65 N 4.19 -1.75 -3.10 3.58 3.41 -1.26 -4.94 113.62 113.74 2fva n SER 65 Ca -0.03 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.56 2fva n SER 65 Cb 0.51 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.48 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 -2.80 0.00 -0.29 6.66 5.66 -1.26 -4.40 114.28 117.85 2fva n THR 66 Ca 0.00 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 60.96 2fva n THR 66 Cb 0.00 -0.07 0.07 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 -1.63 1.21 -0.81 1.09 2.04 -1.83 -2.75 117.51 114.83 2fva h ILE 67 Ca -0.03 -0.39 0.11 0.00 1.00 0.00 0.00 64.86 65.55 2fva h ILE 67 Cb 0.10 0.06 -0.13 0.00 -0.74 0.00 0.00 36.82 36.10 2fva h ILE 67 CO 0.02 0.20 -0.44 1.56 0.00 0.00 0.00 178.15 179.49 2fva h GLN 68 N 1.07 -0.09 -0.54 2.37 1.08 -1.87 0.35 115.11 117.48 2fva h GLN 68 Ca 0.29 0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.45 2fva h GLN 68 Cb -0.11 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.32 2fva h GLN 68 CO -0.06 -0.06 0.15 0.37 -0.95 0.00 0.00 178.83 178.28 2fva h GLN 69 N -0.10 0.86 -0.96 1.46 4.15 -1.79 -2.72 115.11 116.01 2fva h GLN 69 Ca 0.24 -0.20 0.09 0.00 0.77 0.00 0.00 58.65 59.56 2fva h GLN 69 Cb 0.55 -0.12 -0.07 0.00 0.21 0.00 0.00 27.48 28.05 2fva h GLN 69 CO -0.85 0.80 0.61 0.00 -1.93 0.00 0.00 178.83 177.46 2fva h ALA 70 N 1.02 1.38 -0.77 3.38 0.00 -0.53 0.35 119.26 124.10 2fva h ALA 70 Ca 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2fva h ALA 70 Cb 0.31 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 2fva h ALA 70 CO -0.00 0.30 0.38 0.00 0.00 0.00 0.00 179.25 179.93 2fva h ALA 71 N 1.48 0.99 -0.45 0.00 0.00 -0.14 -0.43 119.26 120.71 2fva h ALA 71 Ca 0.45 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 2fva h ALA 71 Cb 0.31 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2fva h ALA 71 CO -0.22 0.55 -0.08 -0.44 0.00 0.00 0.00 179.25 179.06 2fva h ASP 72 N 1.08 0.84 -0.51 0.00 3.32 -0.91 -1.81 116.42 118.44 2fva h ASP 72 Ca 0.27 -0.35 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 2fva h ASP 72 Cb 0.10 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 2fva h ASP 72 CO -0.04 0.99 0.21 0.58 -1.72 0.00 0.00 179.24 179.26 2fva h VAL 73 N 0.68 1.21 -0.50 -1.35 2.07 -0.67 -2.87 116.25 114.81 2fva h VAL 73 Ca 0.12 -0.65 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 2fva h VAL 73 Cb 0.61 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 2fva h VAL 73 CO 0.04 0.25 0.22 0.40 0.02 0.00 0.00 177.57 178.50 2fva h ILE 74 N 0.67 1.20 -0.92 4.57 2.04 -1.00 -2.60 117.51 121.47 2fva h ILE 74 Ca 0.17 -0.59 0.22 0.00 1.00 0.00 0.00 64.86 65.66 2fva h ILE 74 Cb 0.19 0.67 -0.12 0.00 -0.74 0.00 0.00 36.82 36.82 2fva h ILE 74 CO -0.01 0.23 0.46 -0.33 0.00 0.00 0.00 178.15 178.49 2fva h GLU 75 N 0.66 0.47 -0.11 2.37 4.39 -1.11 0.72 114.58 121.97 2fva h GLU 75 Ca 0.17 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.78 2fva h GLU 75 Cb 0.15 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 2fva h GLU 75 CO -0.02 0.31 -0.22 0.78 -1.16 0.00 0.00 179.01 178.70 2fva h GLY 76 N 0.49 0.21 1.99 -3.84 0.00 -1.35 -1.66 103.07 98.90 2fva h GLY 76 Ca 0.57 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.76 2fva h GLY 76 CO -0.49 0.13 -0.01 1.04 0.00 0.00 0.00 176.54 177.22 2fva n LEU 77 N -4.20 0.08 0.01 3.11 4.77 0.23 -2.90 117.00 118.11 2fva n LEU 77 Ca -0.01 0.50 0.11 0.00 -0.03 0.00 0.00 56.01 56.58 2fva n LEU 77 Cb 0.33 -0.48 0.07 0.00 -2.33 0.00 0.00 43.42 41.01 2fva n LEU 77 CO 0.39 -0.01 0.14 0.18 -1.33 0.00 0.00 177.39 176.75 2fva n LEU 78 N -1.57 0.66 0.23 2.23 4.77 -0.23 -2.28 117.00 120.81 2fva n LEU 78 Ca 0.07 -0.11 -0.14 0.00 -0.03 0.00 0.00 56.01 55.79 2fva n LEU 78 Cb 0.35 -0.13 -0.08 0.00 -2.33 0.00 0.00 43.42 41.23 2fva n LEU 78 CO 0.27 0.11 0.56 -0.33 -1.33 0.00 0.00 177.39 176.68 2fva h GLU 79 N 0.00 -0.57 0.00 3.23 5.08 -1.36 -3.39 114.58 117.56 2fva h GLU 79 Ca 0.00 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2fva h GLU 79 Cb 0.61 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2fva h GLU 79 CO 0.00 -0.28 -0.77 0.36 -1.00 0.00 0.00 179.01 177.32 2fva n LYS 80 N -5.25 2.11 -2.03 2.33 -0.00 -1.26 -4.78 118.16 109.28 2fva n LYS 80 Ca -0.11 0.00 -0.38 0.00 -0.00 0.00 0.00 58.31 57.82 2fva n LYS 80 Cb 0.29 -0.89 0.02 0.00 -0.00 0.00 0.00 35.03 34.45 2fva n LYS 80 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2fva n LYS 81 N -1.37 3.46 0.00 -1.58 5.02 -0.97 -5.12 118.16 117.60 2fva n LYS 81 Ca 0.00 -3.60 0.14 0.00 -2.02 0.00 0.00 58.31 52.83 2fva n LYS 81 Cb 0.17 -2.32 0.86 0.00 -0.02 0.00 0.00 35.03 33.72 2fva n LYS 81 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88