#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 4.09 0.24 0.00 1.02 -1.26 -4.94 119.74 118.88 2fva s LYS 2 Ca 0.00 0.82 -0.07 0.00 0.02 0.00 0.00 55.97 56.74 2fva s LYS 2 Cb 0.00 -2.37 0.23 0.00 -0.52 0.00 0.00 37.83 35.17 2fva s LYS 2 CO 0.00 0.11 1.90 0.87 -0.92 0.00 0.00 175.35 177.31 2fva h LYS 3 N 2.19 1.25 -0.42 1.68 1.57 -2.02 -0.02 116.57 120.80 2fva h LYS 3 Ca -0.48 -0.09 0.03 0.00 -1.87 0.00 0.00 60.65 58.23 2fva h LYS 3 Cb 1.18 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 33.18 2fva h LYS 3 CO 0.64 0.85 0.23 1.05 -0.57 0.00 0.00 179.45 181.64 2fva h GLU 4 N 1.28 0.44 -0.48 3.15 4.11 -1.99 0.16 114.58 121.25 2fva h GLU 4 Ca 0.34 -0.03 -0.12 0.00 0.07 0.00 0.00 59.36 59.62 2fva h GLU 4 Cb -0.11 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 2fva h GLU 4 CO -0.07 0.29 -0.17 1.15 0.07 0.00 0.00 179.01 180.28 2fva h THR 5 N 0.46 1.27 -0.43 -1.06 2.02 -1.86 -2.13 112.91 111.17 2fva h THR 5 Ca 0.17 -1.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.02 2fva h THR 5 Cb 0.05 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.55 2fva h THR 5 CO -0.10 0.46 0.23 0.40 0.37 0.00 0.00 175.52 176.88 2fva h ILE 6 N 0.82 1.16 -0.40 3.11 2.04 -0.53 -0.23 117.51 123.48 2fva h ILE 6 Ca 0.11 -0.44 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 2fva h ILE 6 Cb 0.74 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 2fva h ILE 6 CO 0.06 0.17 0.07 0.44 0.00 0.00 0.00 178.15 178.89 2fva h ASP 7 N 0.57 0.56 -0.10 1.72 3.32 -0.63 -1.29 116.42 120.56 2fva h ASP 7 Ca 0.15 -0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 2fva h ASP 7 Cb 0.07 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 2fva h ASP 7 CO -0.02 0.58 -0.04 0.11 -1.72 0.00 0.00 179.24 178.15 2fva h LYS 8 N 0.59 0.21 -0.16 3.56 1.79 -0.81 -0.52 116.57 121.23 2fva h LYS 8 Ca 0.13 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 2fva h LYS 8 Cb 0.27 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.90 2fva h LYS 8 CO 0.00 0.55 0.10 0.28 -1.08 0.00 0.00 179.45 179.30 2fva h VAL 9 N -0.14 1.04 -0.60 0.50 2.07 -0.82 -2.64 116.25 115.65 2fva h VAL 9 Ca 0.02 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 2fva h VAL 9 Cb 0.48 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 2fva h VAL 9 CO 0.01 0.04 0.32 -1.28 0.02 0.00 0.00 177.57 176.68 2fva h SER 10 N 0.21 0.76 -0.82 0.57 0.87 -1.26 -2.71 113.55 111.17 2fva h SER 10 Ca 0.06 -0.11 0.19 0.00 -1.23 0.00 0.00 61.79 60.71 2fva h SER 10 Cb -0.02 -0.20 -0.12 0.00 -0.44 0.00 0.00 62.40 61.62 2fva h SER 10 CO -0.01 0.65 0.25 -0.78 -0.53 0.00 0.00 176.83 176.41 2fva h ASP 11 N 0.82 0.10 -0.36 6.23 1.82 -0.73 0.18 116.42 124.48 2fva h ASP 11 Ca 0.21 0.16 0.06 0.00 -0.39 0.00 0.00 57.03 57.07 2fva h ASP 11 Cb 0.07 0.19 -0.05 0.00 0.68 0.00 0.00 39.33 40.22 2fva h ASP 11 CO -0.03 -0.05 0.05 0.40 -1.61 0.00 0.00 179.24 178.00 2fva h ILE 12 N 0.30 0.79 -0.62 2.25 5.03 -1.23 0.14 117.51 124.18 2fva h ILE 12 Ca 0.49 -0.06 -0.04 0.00 -0.12 0.00 0.00 64.86 65.13 2fva h ILE 12 Cb 0.90 0.61 -0.03 0.00 -3.03 0.00 0.00 36.82 35.27 2fva h ILE 12 CO -0.55 0.03 0.24 0.58 -0.68 0.00 0.00 178.15 177.77 2fva h VAL 13 N 0.17 1.23 -0.19 1.67 2.07 -0.74 -2.32 116.25 118.14 2fva h VAL 13 Ca 0.17 -0.75 -0.05 0.00 0.82 0.00 0.00 66.70 66.89 2fva h VAL 13 Cb 0.21 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 2fva h VAL 13 CO -0.24 0.29 -0.12 0.11 0.02 0.00 0.00 177.57 177.62 2fva h LYS 14 N 0.87 0.30 0.00 1.57 1.57 -0.33 -2.01 116.57 118.54 2fva h LYS 14 Ca 0.20 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 2fva h LYS 14 Cb 0.22 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 2fva h LYS 14 CO -0.01 0.43 -0.06 0.93 -0.57 0.00 0.00 179.45 180.17 2fva h GLU 15 N 0.29 0.00 -0.56 3.15 4.39 -0.29 2.82 114.58 124.37 2fva h GLU 15 Ca 0.06 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 2fva h GLU 15 Cb 0.40 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.02 2fva h GLU 15 CO 0.02 0.06 0.31 0.87 -1.16 0.00 0.00 179.01 179.11 2fva h LYS 16 N 0.00 0.77 -0.01 2.33 6.56 -0.83 -2.68 116.57 122.71 2fva h LYS 16 Ca -0.00 -0.08 0.00 0.00 -1.06 0.00 0.00 60.65 59.51 2fva h LYS 16 Cb 0.75 -0.16 0.00 0.00 -0.57 0.00 0.00 32.23 32.26 2fva h LYS 16 CO 0.01 0.57 -0.05 1.47 -2.06 0.00 0.00 179.45 179.39 2fva n LEU 17 N -4.40 1.63 -1.09 2.94 -0.00 -1.16 -5.00 117.00 109.93 2fva n LEU 17 Ca 0.05 -0.94 0.00 0.00 -0.00 0.00 0.00 56.01 55.12 2fva n LEU 17 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.52 2fva n LEU 17 CO 0.37 0.32 0.00 0.00 -0.00 0.00 0.00 177.39 178.08 2fva n ALA 18 N 0.33 -0.14 -3.40 1.47 0.00 -0.21 -5.09 120.51 113.47 2fva n ALA 18 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2fva n ALA 18 Cb 0.23 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.20 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 -1.09 0.00 0.00 0.00 4.32 0.93 -4.82 117.00 116.34 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 0.47 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.27 2fva n LEU 19 CO 0.00 -0.13 0.00 0.61 -1.22 0.00 0.00 177.39 176.65 2fva n GLY 20 N 5.00 0.67 0.00 -0.72 0.00 -1.26 -4.45 105.19 104.43 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 -1.55 0.00 0.77 4.61 0.00 -1.26 -4.68 120.51 118.41 2fva n ALA 21 Ca 0.00 -0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.54 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 -0.81 2.86 -4.76 0.00 8.00 -1.26 -4.94 116.55 115.65 2fva n ASP 22 Ca 0.00 -1.90 -0.38 0.00 0.71 0.00 0.00 54.79 53.22 2fva n ASP 22 Cb 0.00 -0.04 -0.06 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 -1.70 5.07 0.61 2.53 1.01 -1.26 -5.06 120.40 121.60 2fva s VAL 23 Ca 0.27 1.01 -0.15 0.00 0.00 0.00 0.00 61.98 63.11 2fva s VAL 23 Cb 0.18 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 2fva s VAL 23 CO 0.27 0.41 1.05 0.68 0.00 0.00 0.00 175.10 177.51 2fva s VAL 24 N -0.00 3.92 -0.15 2.92 -7.23 -1.26 -4.50 120.40 114.10 2fva s VAL 24 Ca 0.27 0.84 -0.02 0.00 -1.81 0.00 0.00 61.98 61.25 2fva s VAL 24 Cb -0.16 -3.41 -0.02 0.00 0.56 0.00 0.00 36.38 33.34 2fva s VAL 24 CO 0.13 -0.61 -0.08 0.54 -0.31 0.00 0.00 175.10 174.77 2fva s VAL 25 N -2.62 3.46 0.10 1.32 0.11 -1.26 -5.00 120.40 116.51 2fva s VAL 25 Ca 0.62 -0.51 0.05 0.00 -2.93 0.00 0.00 61.98 59.21 2fva s VAL 25 Cb -0.15 -2.49 -0.03 0.00 -1.53 0.00 0.00 36.38 32.17 2fva s VAL 25 CO 0.41 0.50 -0.13 0.42 -3.33 0.00 0.00 175.10 172.97 2fva s THR 26 N 0.42 1.20 -0.05 5.04 -4.23 -1.26 -5.05 115.64 111.70 2fva s THR 26 Ca -0.07 -1.59 0.03 0.00 -1.18 0.00 0.00 61.69 58.88 2fva s THR 26 Cb -0.15 -1.37 -0.25 0.00 1.34 0.00 0.00 72.50 72.07 2fva s THR 26 CO 0.04 -0.39 0.63 0.00 -0.54 0.00 0.00 174.62 174.36 2fva h ALA 27 N 3.74 0.54 0.00 3.99 0.00 -1.95 -3.31 119.26 122.28 2fva h ALA 27 Ca -0.40 -1.35 0.00 0.00 0.00 0.00 0.00 54.91 53.16 2fva h ALA 27 Cb 1.19 0.50 0.00 0.00 0.00 0.00 0.00 17.79 19.48 2fva h ALA 27 CO 0.48 1.39 0.00 -0.40 0.00 0.00 0.00 179.25 180.72 2fva n ASP 28 N -3.28 0.00 -4.55 0.00 5.68 -1.26 -2.44 116.55 110.69 2fva n ASP 28 Ca -0.21 -0.17 -0.41 0.00 -0.50 0.00 0.00 54.79 53.50 2fva n ASP 28 Cb 1.05 -0.24 -0.03 0.00 -1.14 0.00 0.00 41.12 40.76 2fva n ASP 28 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 2fva s SER 29 N -2.48 6.20 0.77 -1.12 0.01 -1.25 -4.87 113.70 110.96 2fva s SER 29 Ca 0.25 -0.58 -0.17 0.00 1.31 0.00 0.00 55.95 56.75 2fva s SER 29 Cb 0.16 -2.56 -0.14 0.00 0.21 0.00 0.00 66.02 63.69 2fva s SER 29 CO 0.35 -1.80 -0.40 -0.62 0.41 0.00 0.00 173.24 171.18 2fva n GLU 30 N 9.31 0.01 -0.31 12.44 1.02 -1.26 -4.27 120.64 137.58 2fva n GLU 30 Ca 0.07 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 2fva n GLU 30 Cb 0.49 -1.08 0.14 0.00 -0.02 0.00 0.00 31.44 30.97 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 -0.55 1.00 -2.35 -0.32 -1.00 -1.90 -3.33 116.94 108.49 2fva h PHE 31 Ca -0.43 0.03 -0.59 0.00 2.81 0.00 0.00 57.97 59.79 2fva h PHE 31 Cb 1.37 -0.32 -0.39 0.00 3.61 0.00 0.00 35.95 40.22 2fva h PHE 31 CO 0.23 0.52 -0.96 0.43 -1.61 0.00 0.00 178.31 176.92 2fva n SER 32 N -4.61 0.06 -0.20 2.17 7.64 -1.26 -4.96 113.62 112.46 2fva n SER 32 Ca 0.12 -2.54 -0.07 0.00 1.01 0.00 0.00 58.87 57.39 2fva n SER 32 Cb 0.16 -0.59 0.03 0.00 -1.01 0.00 0.00 64.21 62.80 2fva n SER 32 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2fva h LYS 33 N 5.25 0.81 -0.61 1.43 3.64 -1.93 -2.76 116.57 122.41 2fva h LYS 33 Ca 0.22 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 2fva h LYS 33 Cb 0.88 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.53 2fva h LYS 33 CO 0.43 0.65 0.27 -0.07 -2.27 0.00 0.00 179.45 178.47 2fva h LEU 34 N 0.77 0.82 0.00 5.20 3.38 -1.93 -3.47 115.31 120.07 2fva h LEU 34 Ca 0.20 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2fva h LEU 34 Cb 0.10 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.64 2fva h LEU 34 CO -0.03 0.74 0.00 0.61 0.09 0.00 0.00 178.44 179.85 2fva n GLY 35 N -0.89 2.77 3.77 0.83 0.00 -1.04 -5.14 105.19 105.49 2fva n GLY 35 Ca 0.04 0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 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 0.00 3.37 0.73 4.61 0.00 -1.25 -4.94 121.76 124.28 2fva s ALA 36 Ca 0.00 1.05 -0.07 0.00 0.00 0.00 0.00 51.96 52.94 2fva s ALA 36 Cb 0.00 -3.40 0.08 0.00 0.00 0.00 0.00 23.12 19.81 2fva s ALA 36 CO 0.00 -0.44 1.05 0.16 0.00 0.00 0.00 175.76 176.53 2fva s ASP 37 N -0.81 4.58 0.13 0.00 -4.77 -1.26 -5.00 116.67 109.55 2fva s ASP 37 Ca 0.50 0.35 -0.17 0.00 -3.30 0.00 0.00 52.55 49.93 2fva s ASP 37 Cb -0.34 -0.90 -0.02 0.00 -1.09 0.00 0.00 42.92 40.57 2fva s ASP 37 CO 0.45 -1.75 1.71 0.77 0.70 0.00 0.00 175.17 177.05 2fva h SER 38 N -0.70 0.47 -3.31 2.11 4.64 -2.08 -3.41 113.55 111.27 2fva h SER 38 Ca -0.44 -0.12 -0.66 0.00 -0.47 0.00 0.00 61.79 60.11 2fva h SER 38 Cb 1.30 -0.12 -0.29 0.00 -0.31 0.00 0.00 62.40 62.98 2fva h SER 38 CO 0.56 0.46 -0.76 -0.76 -0.87 0.00 0.00 176.83 175.45 2fva s LEU 39 N -9.91 2.68 0.00 5.97 1.43 -1.26 -4.79 118.68 112.80 2fva s LEU 39 Ca -0.13 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.55 2fva s LEU 39 Cb 0.10 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.68 2fva s LEU 39 CO 0.73 0.05 0.00 -0.90 0.23 0.00 0.00 176.35 176.46 2fva n ASP 40 N 4.32 0.00 -0.23 2.29 5.75 -1.26 -4.98 116.55 122.44 2fva n ASP 40 Ca -0.19 0.00 -0.06 0.00 -0.01 0.00 0.00 54.79 54.53 2fva n ASP 40 Cb 0.51 0.00 0.04 0.00 -1.03 0.00 0.00 41.12 40.65 2fva n ASP 40 CO 0.00 0.00 0.00 0.74 -0.11 0.00 0.00 177.20 177.83 2fva h THR 41 N 0.00 1.19 -0.59 2.12 2.02 -1.90 1.06 112.91 116.80 2fva h THR 41 Ca 0.00 -0.43 -0.02 0.00 0.77 0.00 0.00 66.41 66.73 2fva h THR 41 Cb 0.00 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 66.69 2fva h THR 41 CO 0.00 0.20 0.28 0.58 0.37 0.00 0.00 175.52 176.95 2fva h VAL 42 N 0.88 1.21 -0.04 3.16 2.07 -1.94 0.43 116.25 122.02 2fva h VAL 42 Ca 0.23 -0.60 -0.14 0.00 0.82 0.00 0.00 66.70 67.01 2fva h VAL 42 Cb -0.02 0.51 0.01 0.00 -1.52 0.00 0.00 31.29 30.28 2fva h VAL 42 CO -0.04 0.24 -0.54 -0.33 0.02 0.00 0.00 177.57 176.92 2fva h GLU 43 N 0.81 0.44 -0.20 1.57 5.08 -1.85 -2.43 114.58 118.00 2fva h GLU 43 Ca 0.20 -0.42 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 2fva h GLU 43 Cb 0.12 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2fva h GLU 43 CO -0.03 1.07 0.03 0.82 -1.00 0.00 0.00 179.01 179.90 2fva h ILE 44 N -0.04 1.22 -0.53 3.13 1.08 0.13 -1.39 117.51 121.11 2fva h ILE 44 Ca -0.06 -0.73 -0.02 0.00 -0.39 0.00 0.00 64.86 63.66 2fva h ILE 44 Cb 1.22 1.32 -0.02 0.00 -3.07 0.00 0.00 36.82 36.27 2fva h ILE 44 CO 0.11 0.23 0.25 1.62 -0.69 0.00 0.00 178.15 179.66 2fva h VAL 45 N 0.13 1.20 -0.79 1.67 3.04 -0.24 -2.17 116.25 119.10 2fva h VAL 45 Ca 0.06 -0.58 -0.02 0.00 -1.01 0.00 0.00 66.70 65.15 2fva h VAL 45 Cb 0.31 0.61 -0.04 0.00 -2.01 0.00 0.00 31.29 30.16 2fva h VAL 45 CO 0.00 0.23 0.39 -0.03 -1.01 0.00 0.00 177.57 177.15 2fva h MET 46 N 0.71 1.11 -0.20 4.17 1.85 -1.35 0.66 114.93 121.87 2fva h MET 46 Ca 0.18 -0.15 -0.01 0.00 -0.61 0.00 0.00 59.70 59.12 2fva h MET 46 Cb 0.13 -0.21 -0.01 0.00 0.43 0.00 0.00 31.60 31.94 2fva h MET 46 CO -0.02 0.84 0.10 -0.91 -0.40 0.00 0.00 176.91 176.52 2fva h ASN 47 N 1.11 0.26 -0.25 1.39 4.21 -0.88 0.53 115.58 121.95 2fva h ASN 47 Ca 0.27 -0.11 -0.03 0.00 1.21 0.00 0.00 56.30 57.64 2fva h ASN 47 Cb 0.09 -0.07 -0.01 0.00 -1.12 0.00 0.00 38.32 37.21 2fva h ASN 47 CO -0.04 0.30 0.03 -0.07 -1.29 0.00 0.00 177.43 176.36 2fva h LEU 48 N 0.20 0.41 -1.07 1.61 3.38 -1.10 0.17 115.31 118.91 2fva h LEU 48 Ca 0.07 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 2fva h LEU 48 Cb 0.11 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2fva h LEU 48 CO -0.01 0.59 0.09 -0.08 0.09 0.00 0.00 178.44 179.12 2fva h GLU 49 N 0.22 0.76 -0.20 1.13 4.81 -0.75 0.60 114.58 121.15 2fva h GLU 49 Ca 0.07 -0.16 -0.14 0.00 -0.13 0.00 0.00 59.36 59.01 2fva h GLU 49 Cb 0.36 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.63 2fva h GLU 49 CO 0.01 0.71 -0.43 1.49 -0.73 0.00 0.00 179.01 180.06 2fva h GLU 50 N 0.73 0.64 0.43 1.92 4.81 0.26 0.31 114.58 123.67 2fva h GLU 50 Ca 0.16 -0.42 -0.02 0.00 -0.13 0.00 0.00 59.36 58.95 2fva h GLU 50 Cb 0.31 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.75 2fva h GLU 50 CO 0.00 1.04 -0.21 1.49 -0.73 0.00 0.00 179.01 180.60 2fva h GLU 51 N 0.32 -0.56 0.00 1.92 4.81 -0.41 -3.11 114.58 117.55 2fva h GLU 51 Ca 0.00 0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.21 2fva h GLU 51 Cb 1.03 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.53 2fva h GLU 51 CO 0.09 -0.25 -0.30 0.74 -0.73 0.00 0.00 179.01 178.56 2fva h PHE 52 N -0.89 0.00 -2.85 0.92 0.04 -0.99 -3.47 116.94 109.70 2fva h PHE 52 Ca -0.06 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.59 2fva h PHE 52 Cb 0.57 0.00 0.05 0.00 2.20 0.00 0.00 35.95 38.76 2fva h PHE 52 CO 0.01 0.30 -0.23 0.41 -0.60 0.00 0.00 178.31 178.20 2fva n GLY 53 N -0.28 0.33 0.00 -1.45 0.00 0.98 -5.05 105.19 99.73 2fva n GLY 53 Ca -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.64 0.00 -4.53 -0.61 -5.35 -0.59 -5.03 119.36 100.63 2fva n ILE 54 Ca -0.05 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.16 2fva n ILE 54 Cb 0.54 -0.10 -0.17 0.00 -1.74 0.00 0.00 39.64 38.17 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 0.22 2.35 -0.04 7.28 4.22 -1.26 -4.81 114.94 122.90 2fva s ASN 55 Ca 0.00 -0.41 0.03 0.00 -2.14 0.00 0.00 52.86 50.34 2fva s ASN 55 Cb 0.00 -1.05 0.00 0.00 1.28 0.00 0.00 41.25 41.48 2fva s ASN 55 CO 0.00 0.03 -0.12 -0.69 -2.04 0.00 0.00 177.10 174.27 2fva s VAL 56 N 0.89 1.08 0.15 3.54 1.01 -1.26 -4.99 120.40 120.83 2fva s VAL 56 Ca -0.09 -0.51 0.06 0.00 0.00 0.00 0.00 61.98 61.44 2fva s VAL 56 Cb -0.15 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 2fva s VAL 56 CO 0.00 0.32 0.04 -0.62 0.00 0.00 0.00 175.10 174.84 2fva s ASP 57 N 0.21 5.03 0.47 3.32 2.15 -1.26 -4.99 116.67 121.60 2fva s ASP 57 Ca -0.05 -0.28 0.17 0.00 0.43 0.00 0.00 52.55 52.82 2fva s ASP 57 Cb -0.11 -1.17 1.15 0.00 -0.30 0.00 0.00 42.92 42.49 2fva s ASP 57 CO 0.02 0.10 2.01 1.05 -0.17 0.00 0.00 175.17 178.18 2fva h GLU 58 N 2.77 0.25 -0.26 4.34 4.11 -2.01 0.27 114.58 124.05 2fva h GLU 58 Ca -0.47 -0.02 -0.03 0.00 0.07 0.00 0.00 59.36 58.91 2fva h GLU 58 Cb 1.19 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 2fva h GLU 58 CO 0.60 0.17 0.03 0.22 0.07 0.00 0.00 179.01 180.10 2fva h ASP 59 N 0.26 0.34 0.56 3.06 1.82 -2.00 -1.83 116.42 118.62 2fva h ASP 59 Ca 0.23 -0.04 -0.11 0.00 -0.39 0.00 0.00 57.03 56.71 2fva h ASP 59 Cb 0.56 -0.09 -0.02 0.00 0.68 0.00 0.00 39.33 40.47 2fva h ASP 59 CO -0.05 0.38 -1.53 1.17 -1.61 0.00 0.00 179.24 177.60 2fva n LYS 60 N -4.36 0.63 -2.06 0.28 0.00 0.12 -4.28 118.16 108.50 2fva n LYS 60 Ca 0.01 0.08 -0.32 0.00 0.00 0.00 0.00 58.31 58.08 2fva n LYS 60 Cb 0.18 -1.72 0.03 0.00 0.00 0.00 0.00 35.03 33.52 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 -2.35 5.76 -0.01 3.14 0.00 0.74 -4.48 120.51 123.31 2fva n ALA 61 Ca -0.08 -4.06 -0.00 0.00 0.00 0.00 0.00 53.44 49.29 2fva n ALA 61 Cb 0.74 -1.20 -0.01 0.00 0.00 0.00 0.00 19.45 18.98 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 -0.59 2.87 -3.00 0.00 10.64 -0.73 -4.81 117.38 121.76 2fva n GLN 62 Ca 0.48 -0.00 -0.14 0.00 -1.83 0.00 0.00 57.00 55.50 2fva n GLN 62 Cb 0.55 -1.04 0.02 0.00 -0.86 0.00 0.00 30.24 28.91 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 -1.94 -0.58 -4.71 2.61 2.03 -1.26 -5.11 116.55 107.58 2fva n ASP 63 Ca -0.02 -3.27 -0.39 0.00 0.52 0.00 0.00 54.79 51.63 2fva n ASP 63 Cb 0.43 0.46 -0.05 0.00 -0.72 0.00 0.00 41.12 41.24 2fva n ASP 63 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2fva s ILE 64 N -1.19 5.12 0.00 5.18 -1.09 -1.26 -5.07 121.20 122.89 2fva s ILE 64 Ca 0.33 1.16 0.00 0.00 -2.23 0.00 0.00 60.65 59.90 2fva s ILE 64 Cb 0.31 -3.91 0.00 0.00 -1.58 0.00 0.00 42.46 37.28 2fva s ILE 64 CO -0.08 0.27 0.00 -1.54 -1.23 0.00 0.00 174.94 172.36 2fva n SER 65 N 3.88 -1.92 -3.14 3.58 3.41 -1.26 -4.94 113.62 113.23 2fva n SER 65 Ca -0.04 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.52 2fva n SER 65 Cb 0.51 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.51 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 -2.96 0.00 0.30 6.66 5.66 -1.26 -4.38 114.28 118.30 2fva n THR 66 Ca 0.00 0.00 0.17 0.00 -3.05 0.00 0.00 64.05 61.17 2fva n THR 66 Cb 0.00 -0.15 0.97 0.00 -1.55 0.00 0.00 70.33 69.60 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 -1.92 0.36 0.29 1.09 2.04 -1.71 -2.68 117.51 114.98 2fva h ILE 67 Ca -0.06 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 2fva h ILE 67 Cb 0.21 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 2fva h ILE 67 CO 0.04 0.02 -0.15 1.56 0.00 0.00 0.00 178.15 179.61 2fva h GLN 68 N 0.00 -0.39 -0.47 2.37 1.08 -1.77 -0.72 115.11 115.20 2fva h GLN 68 Ca -0.00 0.03 -0.14 0.00 -1.45 0.00 0.00 58.65 57.09 2fva h GLN 68 Cb 0.07 0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.58 2fva h GLN 68 CO 0.00 -0.26 -0.23 0.37 -0.95 0.00 0.00 178.83 177.75 2fva h GLN 69 N -0.41 0.99 -0.29 1.46 4.15 -1.75 -2.72 115.11 116.54 2fva h GLN 69 Ca -0.04 -0.43 0.05 0.00 0.77 0.00 0.00 58.65 59.00 2fva h GLN 69 Cb 0.32 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.94 2fva h GLN 69 CO 0.06 1.10 0.01 0.00 -1.93 0.00 0.00 178.83 178.07 2fva h ALA 70 N 0.87 0.27 -0.76 3.38 0.00 -1.32 0.26 119.26 121.97 2fva h ALA 70 Ca 0.11 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2fva h ALA 70 Cb 0.81 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 2fva h ALA 70 CO 0.07 -0.40 0.45 0.00 0.00 0.00 0.00 179.25 179.37 2fva h ALA 71 N 1.24 0.96 -0.67 0.00 0.00 -1.09 -0.80 119.26 118.90 2fva h ALA 71 Ca 0.14 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 2fva h ALA 71 Cb 0.18 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2fva h ALA 71 CO -0.22 0.44 0.14 0.22 0.00 0.00 0.00 179.25 179.84 2fva h ASP 72 N 1.04 1.03 -0.47 0.00 1.82 -1.04 -1.78 116.42 117.02 2fva h ASP 72 Ca 0.27 -0.24 -0.04 0.00 -0.39 0.00 0.00 57.03 56.63 2fva h ASP 72 Cb -0.02 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 39.70 2fva h ASP 72 CO -0.05 1.01 0.13 0.58 -1.61 0.00 0.00 179.24 179.30 2fva h VAL 73 N 1.01 1.23 -0.64 2.25 2.07 -0.05 -2.92 116.25 119.20 2fva h VAL 73 Ca 0.21 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.92 2fva h VAL 73 Cb 0.39 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 2fva h VAL 73 CO 0.01 0.28 0.34 0.40 0.02 0.00 0.00 177.57 178.62 2fva h ILE 74 N 0.62 1.21 -0.77 4.57 2.04 -0.98 -2.59 117.51 121.61 2fva h ILE 74 Ca 0.15 -0.54 0.18 0.00 1.00 0.00 0.00 64.86 65.65 2fva h ILE 74 Cb 0.30 0.40 -0.12 0.00 -0.74 0.00 0.00 36.82 36.66 2fva h ILE 74 CO -0.00 0.23 0.17 -0.33 0.00 0.00 0.00 178.15 178.22 2fva h GLU 75 N 0.87 0.23 -0.61 2.37 5.08 -1.13 0.28 114.58 121.66 2fva h GLU 75 Ca 0.22 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.51 2fva h GLU 75 Cb 0.06 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 2fva h GLU 75 CO -0.03 0.15 0.16 0.78 -1.00 0.00 0.00 179.01 179.07 2fva h GLY 76 N 0.24 1.04 1.05 -3.84 0.00 -1.41 -2.58 103.07 97.56 2fva h GLY 76 Ca 0.45 -0.64 -0.05 0.00 0.00 0.00 0.00 47.33 47.09 2fva h GLY 76 CO -0.56 0.60 0.32 1.41 0.00 0.00 0.00 176.54 178.30 2fva h LEU 77 N 0.88 1.10 -1.28 3.11 3.38 -0.47 0.15 115.31 122.19 2fva h LEU 77 Ca 0.19 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2fva h LEU 77 Cb 0.33 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 2fva h LEU 77 CO -0.00 0.97 0.41 -0.07 0.09 0.00 0.00 178.44 179.85 2fva h LEU 78 N 1.16 0.79 0.49 1.67 3.38 -0.34 -3.09 115.31 119.38 2fva h LEU 78 Ca 0.27 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 2fva h LEU 78 Cb 0.22 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2fva h LEU 78 CO -0.02 0.60 -0.24 -0.33 0.09 0.00 0.00 178.44 178.55 2fva h GLU 79 N 0.92 -0.64 0.00 1.13 4.39 -1.05 -3.47 114.58 115.86 2fva h GLU 79 Ca 0.24 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.99 2fva h GLU 79 Cb -0.05 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 2fva h GLU 79 CO -0.05 -0.39 0.00 0.36 -1.16 0.00 0.00 179.01 177.77 2fva n LYS 80 N -5.22 0.00 -3.60 2.33 -0.00 -0.75 -5.13 118.16 105.79 2fva n LYS 80 Ca -0.09 0.00 -0.07 0.00 -0.00 0.00 0.00 58.31 58.15 2fva n LYS 80 Cb 0.28 0.00 -0.04 0.00 -0.00 0.00 0.00 35.03 35.27 2fva n LYS 80 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 2fva s LYS 81 N -0.03 0.41 0.00 -1.58 2.20 0.44 -4.91 119.74 116.27 2fva s LYS 81 Ca 0.00 0.06 0.00 0.00 -0.36 0.00 0.00 55.97 55.67 2fva s LYS 81 Cb 0.00 0.19 0.00 0.00 -1.51 0.00 0.00 37.83 36.51 2fva s LYS 81 CO 0.00 -0.14 0.23 0.00 -0.36 0.00 0.00 175.35 175.09