#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fpv s ALA 17 N 0.00 3.07 0.24 2.33 0.00 -1.26 -5.11 121.76 121.03 3fpv s ALA 17 Ca 0.00 -0.82 -0.13 0.00 0.00 0.00 0.00 51.96 51.01 3fpv s ALA 17 Cb 0.00 -1.54 -0.08 0.00 0.00 0.00 0.00 23.12 21.50 3fpv s ALA 17 CO 0.00 0.30 0.62 0.00 0.00 0.00 0.00 175.76 176.68 3fpv s ALA 18 N 0.06 3.49 0.24 0.00 0.00 -1.26 -5.11 121.76 119.18 3fpv s ALA 18 Ca 0.01 -0.11 -0.08 0.00 0.00 0.00 0.00 51.96 51.77 3fpv s ALA 18 Cb -0.13 -2.58 0.03 0.00 0.00 0.00 0.00 23.12 20.44 3fpv s ALA 18 CO 0.02 0.43 0.47 2.89 0.00 0.00 0.00 175.76 179.58 3fpv n ARG 19 N 0.07 0.68 0.14 0.00 1.85 -1.26 -4.97 116.66 113.16 3fpv n ARG 19 Ca -0.00 -1.39 0.04 0.00 -1.00 0.00 0.00 57.85 55.50 3fpv n ARG 19 Cb 0.52 1.70 0.04 0.00 -1.05 0.00 0.00 32.46 33.67 3fpv n ARG 19 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 3fpv h GLY 20 N 1.21 0.00 2.00 2.89 0.00 -1.99 -3.08 103.07 104.10 3fpv h GLY 20 Ca -0.20 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 3fpv h GLY 20 CO 0.26 0.00 -0.10 -1.33 0.00 0.00 0.00 176.54 175.37 3fpv h GLY 21 N 3.64 0.00 -1.18 4.60 0.00 -2.05 -2.25 103.07 105.83 3fpv h GLY 21 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 3fpv h GLY 21 CO 0.05 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.77 3fpv n GLU 22 N -3.25 1.99 -3.53 4.80 1.02 -1.16 -4.87 120.64 115.64 3fpv n GLU 22 Ca 0.00 -1.44 -0.34 0.00 -0.02 0.00 0.00 57.16 55.36 3fpv n GLU 22 Cb 0.36 -1.47 -0.05 0.00 -0.02 0.00 0.00 31.44 30.25 3fpv n GLU 22 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3fpv s LEU 23 N -1.99 4.33 0.14 -4.62 1.43 -0.85 -4.95 118.68 112.17 3fpv s LEU 23 Ca 0.33 0.85 0.01 0.00 -1.03 0.00 0.00 54.13 54.28 3fpv s LEU 23 Cb 0.20 -3.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.27 3fpv s LEU 23 CO 0.32 0.13 0.01 0.28 0.23 0.00 0.00 176.35 177.32 3fpv s THR 24 N -1.46 0.44 0.15 5.49 -1.32 -1.26 -5.00 115.64 112.69 3fpv s THR 24 Ca 0.35 -1.94 0.10 0.00 -1.21 0.00 0.00 61.69 59.00 3fpv s THR 24 Cb -0.14 -1.99 -0.04 0.00 -1.51 0.00 0.00 72.50 68.82 3fpv s THR 24 CO 0.19 -0.56 -0.21 -1.10 -2.21 0.00 0.00 174.62 170.72 3fpv s GLN 25 N -3.95 1.63 0.12 7.08 -1.52 -1.26 -5.15 119.66 116.61 3fpv s GLN 25 Ca 0.21 -1.33 0.03 0.00 -1.95 0.00 0.00 55.36 52.32 3fpv s GLN 25 Cb 0.07 -1.98 -0.04 0.00 -0.22 0.00 0.00 33.01 30.83 3fpv s GLN 25 CO 0.01 0.45 -0.09 -1.54 -0.25 0.00 0.00 175.29 173.87 3fpv s SER 26 N -2.33 1.49 -0.00 5.90 1.04 -1.26 -5.16 113.70 113.38 3fpv s SER 26 Ca 0.18 -0.97 0.04 0.00 0.48 0.00 0.00 55.95 55.68 3fpv s SER 26 Cb -0.10 0.03 -0.03 0.00 0.10 0.00 0.00 66.02 66.02 3fpv s SER 26 CO 0.09 -0.37 -0.11 -0.89 0.98 0.00 0.00 173.24 172.95 3fpv s THR 27 N -3.26 3.32 0.03 2.02 2.01 -1.26 -5.13 115.64 113.37 3fpv s THR 27 Ca 0.13 -0.86 -0.05 0.00 0.31 0.00 0.00 61.69 61.22 3fpv s THR 27 Cb 0.02 -2.40 -0.01 0.00 0.01 0.00 0.00 72.50 70.12 3fpv s THR 27 CO -0.01 0.43 0.08 -1.00 -0.69 0.00 0.00 174.62 173.42 3fpv s HIS 28 N -0.92 0.19 0.23 4.92 3.76 -1.26 -4.76 115.29 117.45 3fpv s HIS 28 Ca 0.15 -0.46 -0.32 0.00 -0.15 0.00 0.00 55.06 54.28 3fpv s HIS 28 Cb -0.11 -0.14 -0.13 0.00 1.11 0.00 0.00 32.58 33.31 3fpv s HIS 28 CO 0.05 -0.33 1.45 1.28 -0.85 0.00 0.00 174.74 176.34 3fpv n LEU 29 N 0.97 3.17 -4.63 0.89 4.77 -1.26 -5.03 117.00 115.88 3fpv n LEU 29 Ca -0.20 1.13 -0.36 0.00 -0.03 0.00 0.00 56.01 56.55 3fpv n LEU 29 Cb 0.58 -1.44 0.08 0.00 -2.33 0.00 0.00 43.42 40.31 3fpv n LEU 29 CO 0.22 -0.42 0.58 0.35 -1.33 0.00 0.00 177.39 176.79 3fpv n THR 30 N 2.18 3.24 -0.28 -5.08 -2.24 -1.26 -4.86 114.28 105.98 3fpv n THR 30 Ca 0.12 -0.41 0.08 0.00 -2.27 0.00 0.00 64.05 61.58 3fpv n THR 30 Cb 0.31 -1.15 0.23 0.00 -2.10 0.00 0.00 70.33 67.62 3fpv n THR 30 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3fpv h LEU 31 N -0.04 0.27 -0.78 3.22 5.85 -1.98 -1.25 115.31 120.61 3fpv h LEU 31 Ca -0.48 0.13 0.05 0.00 0.84 0.00 0.00 57.88 58.42 3fpv h LEU 31 Cb 1.34 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 42.43 3fpv h LEU 31 CO 0.48 0.06 0.48 -0.08 -0.34 0.00 0.00 178.44 179.04 3fpv h GLU 32 N 0.42 0.86 -0.15 1.25 4.57 -1.99 0.91 114.58 120.45 3fpv h GLU 32 Ca 0.47 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.52 3fpv h GLU 32 Cb 0.79 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 29.19 3fpv h GLU 32 CO -0.46 0.57 -0.22 0.00 -1.18 0.00 0.00 179.01 177.72 3fpv h ALA 33 N 1.37 0.23 -0.50 2.92 0.00 -1.78 -1.59 119.26 119.90 3fpv h ALA 33 Ca 0.34 -0.37 0.04 0.00 0.00 0.00 0.00 54.91 54.91 3fpv h ALA 33 Cb 0.13 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3fpv h ALA 33 CO -0.16 0.18 0.28 0.00 0.00 0.00 0.00 179.25 179.55 3fpv h ALA 34 N 0.58 0.65 -0.37 0.00 0.00 -0.93 0.50 119.26 119.69 3fpv h ALA 34 Ca 0.02 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3fpv h ALA 34 Cb 0.79 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 3fpv h ALA 34 CO 0.05 -0.05 0.21 1.15 0.00 0.00 0.00 179.25 180.61 3fpv h THR 35 N 0.54 1.14 -0.31 0.00 2.02 -0.83 0.45 112.91 115.92 3fpv h THR 35 Ca 0.21 -0.34 0.04 0.00 0.77 0.00 0.00 66.41 67.09 3fpv h THR 35 Cb 0.08 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 3fpv h THR 35 CO -0.13 0.14 0.10 0.50 0.37 0.00 0.00 175.52 176.50 3fpv h LYS 36 N 0.48 0.22 -0.60 6.66 3.64 -0.84 -0.09 116.57 126.04 3fpv h LYS 36 Ca 0.13 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 3fpv h LYS 36 Cb 0.04 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.78 3fpv h LYS 36 CO -0.02 0.15 0.20 0.00 -2.27 0.00 0.00 179.45 177.51 3fpv h ALA 37 N 1.20 0.78 -0.36 5.00 0.00 -0.72 -2.26 119.26 122.89 3fpv h ALA 37 Ca 0.14 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3fpv h ALA 37 Cb 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3fpv h ALA 37 CO -0.15 0.44 0.08 0.00 0.00 0.00 0.00 179.25 179.61 3fpv h ALA 38 N 1.07 0.48 -0.03 0.00 0.00 -0.53 -2.23 119.26 118.01 3fpv h ALA 38 Ca 0.20 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 3fpv h ALA 38 Cb 0.26 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3fpv h ALA 38 CO -0.01 0.17 -0.33 0.00 0.00 0.00 0.00 179.25 179.08 3fpv h ARG 39 N 0.44 0.06 -0.24 0.00 3.08 -0.99 -2.31 114.38 114.43 3fpv h ARG 39 Ca 0.11 -0.02 -0.12 0.00 0.07 0.00 0.00 59.98 60.02 3fpv h ARG 39 Cb 0.33 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 3fpv h ARG 39 CO 0.00 0.39 -0.34 0.00 -1.07 0.00 0.00 179.97 178.96 3fpv h ALA 40 N 1.61 0.97 -0.29 0.04 0.00 -1.16 -1.07 119.26 119.35 3fpv h ALA 40 Ca 0.01 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 3fpv h ALA 40 Cb 0.61 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3fpv h ALA 40 CO 0.04 0.61 -0.06 0.00 0.00 0.00 0.00 179.25 179.84 3fpv h ALA 41 N 1.20 0.40 -0.34 0.00 0.00 -0.92 -1.46 119.26 118.14 3fpv h ALA 41 Ca 0.05 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 54.74 3fpv h ALA 41 Cb 0.80 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 3fpv h ALA 41 CO 0.06 0.22 0.00 0.28 0.00 0.00 0.00 179.25 179.81 3fpv h VAL 42 N 0.33 0.75 -0.57 0.00 2.07 -1.38 -2.43 116.25 115.01 3fpv h VAL 42 Ca 0.08 -0.03 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 3fpv h VAL 42 Cb 0.54 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 3fpv h VAL 42 CO 0.03 0.02 0.10 -0.08 0.02 0.00 0.00 177.57 177.65 3fpv h GLU 43 N 0.10 0.90 -0.21 1.57 4.81 -0.98 0.37 114.58 121.14 3fpv h GLU 43 Ca 0.17 -0.21 -0.11 0.00 -0.13 0.00 0.00 59.36 59.08 3fpv h GLU 43 Cb 0.23 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 3fpv h GLU 43 CO -0.28 0.83 -0.34 0.00 -0.73 0.00 0.00 179.01 178.50 3fpv h ALA 44 N 1.25 1.04 -0.11 2.92 0.00 -1.21 -1.86 119.26 121.28 3fpv h ALA 44 Ca 0.18 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 3fpv h ALA 44 Cb 0.37 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3fpv h ALA 44 CO 0.01 0.59 -0.22 0.00 0.00 0.00 0.00 179.25 179.62 3fpv h ALA 45 N 1.27 0.18 -1.06 0.00 0.00 -0.82 -2.99 119.26 115.84 3fpv h ALA 45 Ca 0.04 -0.38 0.30 0.00 0.00 0.00 0.00 54.91 54.88 3fpv h ALA 45 Cb 0.77 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.41 3fpv h ALA 45 CO 0.06 0.14 0.64 0.93 0.00 0.00 0.00 179.25 181.02 3fpv h GLU 46 N -0.08 0.37 0.00 0.00 4.39 -0.21 0.19 114.58 119.25 3fpv h GLU 46 Ca 0.00 -0.02 -0.06 0.00 0.34 0.00 0.00 59.36 59.62 3fpv h GLU 46 Cb 0.81 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.36 3fpv h GLU 46 CO 0.05 0.25 -0.31 -0.22 -1.16 0.00 0.00 179.01 177.62 3fpv h LYS 47 N 0.39 0.00 -0.55 2.33 3.64 -1.18 -1.67 116.57 119.52 3fpv h LYS 47 Ca 0.68 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.06 3fpv h LYS 47 Cb 1.62 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.44 3fpv h LYS 47 CO -0.45 0.31 0.00 -0.25 -2.27 0.00 0.00 179.45 176.79 3fpv n ASP 48 N -3.64 5.14 -1.63 4.20 8.00 -0.73 -4.93 116.55 122.95 3fpv n ASP 48 Ca -0.01 -2.78 -0.14 0.00 0.71 0.00 0.00 54.79 52.57 3fpv n ASP 48 Cb 0.43 -0.62 -0.01 0.00 -0.02 0.00 0.00 41.12 40.90 3fpv n ASP 48 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3fpv n GLY 49 N 0.62 -0.22 3.85 0.44 0.00 -0.63 -5.00 105.19 104.24 3fpv n GLY 49 Ca 0.26 -0.28 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 3fpv n GLY 49 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fpv s ARG 50 N -4.72 3.14 -0.25 1.61 3.00 -0.02 -5.00 118.95 116.71 3fpv s ARG 50 Ca 0.00 -0.62 0.02 0.00 0.00 0.00 0.00 55.73 55.14 3fpv s ARG 50 Cb -0.00 -2.85 0.06 0.00 0.00 0.00 0.00 34.95 32.16 3fpv s ARG 50 CO 0.00 0.57 -0.09 -1.01 0.00 0.00 0.00 175.30 174.76 3fpv s HIS 51 N -1.52 3.03 0.24 -0.53 3.76 -1.26 -3.69 115.29 115.32 3fpv s HIS 51 Ca 0.32 -2.17 0.08 0.00 -0.15 0.00 0.00 55.06 53.14 3fpv s HIS 51 Cb -0.12 -1.83 -0.05 0.00 1.11 0.00 0.00 32.58 31.69 3fpv s HIS 51 CO 0.25 -0.85 -0.11 0.14 -0.85 0.00 0.00 174.74 173.32 3fpv s VAL 52 N 1.18 1.74 0.09 -0.90 -7.23 -1.26 -4.31 120.40 109.71 3fpv s VAL 52 Ca -0.08 -2.19 0.02 0.00 -1.81 0.00 0.00 61.98 57.92 3fpv s VAL 52 Cb -0.20 -2.22 -0.04 0.00 0.56 0.00 0.00 36.38 34.49 3fpv s VAL 52 CO -0.05 -0.47 0.16 -0.44 -0.31 0.00 0.00 175.10 173.99 3fpv s SER 53 N -3.38 5.96 -0.04 4.85 0.01 -0.30 -1.45 113.70 119.35 3fpv s SER 53 Ca 0.26 0.11 0.03 0.00 1.31 0.00 0.00 55.95 57.66 3fpv s SER 53 Cb 0.01 -1.72 0.01 0.00 0.21 0.00 0.00 66.02 64.52 3fpv s SER 53 CO 0.09 0.15 -0.11 -0.69 0.41 0.00 0.00 173.24 173.09 3fpv s VAL 54 N -1.51 0.97 -0.01 3.43 1.01 -0.27 -1.90 120.40 122.12 3fpv s VAL 54 Ca 0.32 -0.43 0.06 0.00 0.00 0.00 0.00 61.98 61.93 3fpv s VAL 54 Cb -0.12 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.37 3fpv s VAL 54 CO 0.25 0.30 -0.19 0.00 0.00 0.00 0.00 175.10 175.47 3fpv s ALA 55 N 0.36 1.54 -0.22 5.51 0.00 -0.04 -0.74 121.76 128.18 3fpv s ALA 55 Ca -0.07 -0.82 -0.04 0.00 0.00 0.00 0.00 51.96 51.03 3fpv s ALA 55 Cb -0.12 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.61 3fpv s ALA 55 CO 0.02 0.37 -0.04 0.08 0.00 0.00 0.00 175.76 176.19 3fpv s VAL 56 N -0.47 3.43 -0.18 0.00 1.01 0.18 -0.07 120.40 124.30 3fpv s VAL 56 Ca 0.07 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 61.56 3fpv s VAL 56 Cb -0.07 -2.56 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 3fpv s VAL 56 CO -0.00 0.42 -0.09 -0.69 0.00 0.00 0.00 175.10 174.74 3fpv s VAL 57 N 1.44 3.16 0.85 2.92 1.01 -0.23 -0.64 120.40 128.92 3fpv s VAL 57 Ca 0.05 -0.59 -0.13 0.00 0.00 0.00 0.00 61.98 61.31 3fpv s VAL 57 Cb -0.14 -2.39 0.07 0.00 0.00 0.00 0.00 36.38 33.92 3fpv s VAL 57 CO -0.03 0.48 0.94 -0.67 0.00 0.00 0.00 175.10 175.83 3fpv n ASP 58 N 4.19 -0.02 0.12 3.32 2.03 0.31 -0.69 116.55 125.81 3fpv n ASP 58 Ca -0.18 0.50 0.09 0.00 0.52 0.00 0.00 54.79 55.72 3fpv n ASP 58 Cb 0.52 -1.40 0.46 0.00 -0.72 0.00 0.00 41.12 39.97 3fpv n ASP 58 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 3fpv n ARG 59 N -2.81 0.12 -0.49 -0.67 3.00 -0.35 -3.01 116.66 112.44 3fpv n ARG 59 Ca 0.11 0.55 0.04 0.00 -0.00 0.00 0.00 57.85 58.56 3fpv n ARG 59 Cb 0.51 -1.85 0.23 0.00 0.00 0.00 0.00 32.46 31.36 3fpv n ARG 59 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 3fpv n ASN 60 N -2.10 3.60 -4.56 6.15 0.23 -1.26 -4.94 115.26 112.38 3fpv n ASN 60 Ca -0.00 -2.49 -0.35 0.00 -0.53 0.00 0.00 54.58 51.21 3fpv n ASN 60 Cb 0.08 -0.58 -0.04 0.00 -2.08 0.00 0.00 39.78 37.16 3fpv n ASN 60 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 3fpv s GLY 61 N -0.50 0.84 0.24 4.83 0.00 -1.16 -5.04 107.32 106.52 3fpv s GLY 61 Ca 0.31 -2.05 -0.30 0.00 0.00 0.00 0.00 44.72 42.68 3fpv s GLY 61 CO 0.10 3.04 1.18 0.70 0.00 0.00 0.00 173.10 178.12 3fpv n ASN 62 N 11.04 1.80 -4.73 1.64 3.02 -1.26 -4.77 115.26 121.99 3fpv n ASN 62 Ca 0.38 1.16 -0.42 0.00 -0.03 0.00 0.00 54.58 55.67 3fpv n ASN 62 Cb 0.49 -1.32 -0.03 0.00 -0.61 0.00 0.00 39.78 38.32 3fpv n ASN 62 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3fpv s THR 63 N -0.52 2.46 -0.24 3.41 2.01 -1.26 -0.53 115.64 120.95 3fpv s THR 63 Ca 0.65 0.35 -0.02 0.00 0.31 0.00 0.00 61.69 62.99 3fpv s THR 63 Cb -0.73 -3.22 -0.14 0.00 0.01 0.00 0.00 72.50 68.42 3fpv s THR 63 CO 0.55 0.04 -0.24 0.18 -0.69 0.00 0.00 174.62 174.46 3fpv n LEU 64 N 3.25 2.67 -3.82 4.42 4.77 0.19 -4.88 117.00 123.60 3fpv n LEU 64 Ca 0.11 -0.01 -0.15 0.00 -0.03 0.00 0.00 56.01 55.93 3fpv n LEU 64 Cb 0.38 -0.81 -0.16 0.00 -2.33 0.00 0.00 43.42 40.51 3fpv n LEU 64 CO 0.62 0.81 -0.36 -0.69 -1.33 0.00 0.00 177.39 176.43 3fpv s VAL 65 N -2.47 0.05 0.03 4.08 1.01 -1.09 -5.00 120.40 117.01 3fpv s VAL 65 Ca -0.33 0.11 0.08 0.00 0.00 0.00 0.00 61.98 61.84 3fpv s VAL 65 Cb 0.10 -0.14 -0.03 0.00 0.00 0.00 0.00 36.38 36.31 3fpv s VAL 65 CO 0.52 0.09 -0.24 0.42 0.00 0.00 0.00 175.10 175.89 3fpv s THR 66 N 0.77 1.94 -0.09 3.92 -4.23 -1.26 -0.65 115.64 116.04 3fpv s THR 66 Ca -0.07 -1.26 -0.01 0.00 -1.18 0.00 0.00 61.69 59.17 3fpv s THR 66 Cb -0.10 -1.65 0.03 0.00 1.34 0.00 0.00 72.50 72.11 3fpv s THR 66 CO -0.02 0.34 -0.03 -0.76 -0.54 0.00 0.00 174.62 173.61 3fpv s LEU 67 N -1.10 0.83 -0.41 4.79 1.43 0.08 -5.01 118.68 119.30 3fpv s LEU 67 Ca 0.10 -0.17 -0.20 0.00 -1.03 0.00 0.00 54.13 52.82 3fpv s LEU 67 Cb -0.09 -0.60 0.02 0.00 0.03 0.00 0.00 46.19 45.54 3fpv s LEU 67 CO 0.01 -0.16 0.63 -0.60 0.23 0.00 0.00 176.35 176.46 3fpv s ARG 68 N 1.85 3.42 0.74 1.70 3.52 -1.26 -1.11 118.95 127.82 3fpv s ARG 68 Ca 0.05 -0.23 -0.12 0.00 -0.13 0.00 0.00 55.73 55.29 3fpv s ARG 68 Cb -0.12 -3.90 0.04 0.00 -1.56 0.00 0.00 34.95 29.41 3fpv s ARG 68 CO -0.06 -0.90 1.11 0.20 -0.81 0.00 0.00 175.30 174.84 3fpv s GLY 69 N 1.92 1.87 -0.04 8.12 0.00 -0.53 -4.95 107.32 113.72 3fpv s GLY 69 Ca 0.23 0.42 -0.30 0.00 0.00 0.00 0.00 44.72 45.07 3fpv s GLY 69 CO 0.17 0.78 1.55 0.99 0.00 0.00 0.00 173.10 176.60 3fpv s ASP 70 N -2.99 6.73 -0.46 1.64 1.01 -1.26 -2.28 116.67 119.06 3fpv s ASP 70 Ca 0.64 2.18 0.00 0.00 0.71 0.00 0.00 52.55 56.08 3fpv s ASP 70 Cb -0.19 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.19 3fpv s ASP 70 CO 0.51 -0.86 0.00 0.61 0.21 0.00 0.00 175.17 175.64 3fpv n GLY 71 N 3.95 0.71 3.77 0.21 0.00 -1.26 -4.78 105.19 107.78 3fpv n GLY 71 Ca 0.16 -0.52 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 3fpv n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fpv s ALA 72 N -2.06 3.25 0.55 4.61 0.00 -0.97 -4.82 121.76 122.31 3fpv s ALA 72 Ca 0.00 1.07 -0.22 0.00 0.00 0.00 0.00 51.96 52.81 3fpv s ALA 72 Cb 0.00 -3.42 -0.05 0.00 0.00 0.00 0.00 23.12 19.65 3fpv s ALA 72 CO 0.00 -0.59 1.35 0.41 0.00 0.00 0.00 175.76 176.93 3fpv n GLY 73 N 0.72 0.74 0.26 0.00 0.00 -1.26 -4.89 105.19 100.75 3fpv n GLY 73 Ca 0.03 0.02 0.17 0.00 0.00 0.00 0.00 46.02 46.24 3fpv n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fpv h PRO 74 N 1.40 0.00 0.00 1.61 0.13 -2.00 -2.02 132.00 131.11 3fpv h PRO 74 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3fpv h PRO 74 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 3fpv h PRO 74 CO 0.57 0.00 -0.19 -0.56 -0.23 0.00 0.00 178.00 177.59 3fpv h GLN 75 N 0.00 0.00 0.00 0.86 -0.00 -2.01 -3.36 115.11 110.60 3fpv h GLN 75 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 58.65 58.55 3fpv h GLN 75 Cb 0.40 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.87 3fpv h GLN 75 CO 0.00 0.00 -0.47 0.66 -0.00 0.00 0.00 178.83 179.02 3fpv h SER 76 N 0.00 0.00 0.45 0.06 4.64 -1.69 -2.94 113.55 114.07 3fpv h SER 76 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 3fpv h SER 76 Cb 0.79 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.88 3fpv h SER 76 CO 0.00 0.47 -0.31 0.22 -0.87 0.00 0.00 176.83 176.34 3fpv h TYR 77 N 0.00 -0.83 -0.08 4.77 5.03 -1.73 0.27 116.97 124.40 3fpv h TYR 77 Ca -0.00 -0.00 -0.07 0.00 2.58 0.00 0.00 58.73 61.23 3fpv h TYR 77 Cb 1.33 0.31 -0.01 0.00 1.55 0.00 0.00 36.73 39.90 3fpv h TYR 77 CO 0.00 -0.45 -0.26 0.93 -1.32 0.00 0.00 178.16 177.06 3fpv h GLU 78 N -0.72 0.14 -0.51 1.82 5.08 -1.84 -2.66 114.58 115.89 3fpv h GLU 78 Ca -0.06 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 3fpv h GLU 78 Cb 0.59 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 3fpv h GLU 78 CO 0.04 0.40 0.05 1.03 -1.00 0.00 0.00 179.01 179.53 3fpv h SER 79 N 0.13 0.83 -0.68 1.42 0.87 -1.40 -1.82 113.55 112.90 3fpv h SER 79 Ca 0.02 -0.28 -0.02 0.00 -1.23 0.00 0.00 61.79 60.29 3fpv h SER 79 Cb 0.54 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.24 3fpv h SER 79 CO 0.04 0.90 0.36 0.00 -0.53 0.00 0.00 176.83 177.60 3fpv h ALA 80 N 0.96 0.87 -0.15 6.23 0.00 -0.74 -2.02 119.26 124.41 3fpv h ALA 80 Ca 0.15 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.98 3fpv h ALA 80 Cb 0.45 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 3fpv h ALA 80 CO 0.02 0.40 -0.10 0.93 0.00 0.00 0.00 179.25 180.50 3fpv h GLU 81 N 0.94 -0.10 -0.09 0.00 5.08 -1.17 -2.17 114.58 117.07 3fpv h GLU 81 Ca 0.24 0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.47 3fpv h GLU 81 Cb 0.06 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3fpv h GLU 81 CO -0.04 -0.06 -0.53 0.00 -1.00 0.00 0.00 179.01 177.38 3fpv h ARG 82 N -0.10 0.26 -0.57 2.33 3.08 -1.23 -1.22 114.38 116.93 3fpv h ARG 82 Ca 0.09 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 3fpv h ARG 82 Cb 0.23 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 3fpv h ARG 82 CO -0.21 0.73 0.23 0.87 -1.07 0.00 0.00 179.97 180.52 3fpv h LYS 83 N 0.20 0.85 -0.53 0.04 1.57 -1.25 -0.76 116.57 116.68 3fpv h LYS 83 Ca 0.00 -0.15 -0.11 0.00 -1.87 0.00 0.00 60.65 58.52 3fpv h LYS 83 Cb 1.00 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.16 3fpv h LYS 83 CO 0.08 0.73 -0.10 0.00 -0.57 0.00 0.00 179.45 179.59 3fpv h ALA 84 N 1.08 0.72 -0.38 3.86 0.00 -1.03 -1.02 119.26 122.50 3fpv h ALA 84 Ca 0.19 -0.34 0.05 0.00 0.00 0.00 0.00 54.91 54.81 3fpv h ALA 84 Cb 0.19 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 3fpv h ALA 84 CO -0.02 0.63 0.10 0.35 0.00 0.00 0.00 179.25 180.31 3fpv h PHE 85 N 0.87 0.17 -0.42 0.00 3.04 -1.13 -2.46 116.94 117.00 3fpv h PHE 85 Ca 0.14 0.02 -0.15 0.00 3.98 0.00 0.00 57.97 61.96 3fpv h PHE 85 Cb 0.66 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.15 3fpv h PHE 85 CO 0.05 0.05 -0.31 1.15 -2.02 0.00 0.00 178.31 177.22 3fpv h THR 86 N 0.23 1.27 -0.42 4.41 2.02 -0.85 -1.91 112.91 117.67 3fpv h THR 86 Ca 0.18 -1.48 -0.02 0.00 0.77 0.00 0.00 66.41 65.86 3fpv h THR 86 Cb 0.19 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 3fpv h THR 86 CO -0.21 0.50 0.20 0.00 0.37 0.00 0.00 175.52 176.38 3fpv h ALA 87 N 0.84 0.54 0.00 6.16 0.00 -1.14 -2.98 119.26 122.68 3fpv h ALA 87 Ca 0.08 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 3fpv h ALA 87 Cb 0.90 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3fpv h ALA 87 CO 0.08 0.11 -0.49 -0.24 0.00 0.00 0.00 179.25 178.71 3fpv h VAL 88 N 0.54 1.03 -0.24 0.00 3.04 -1.35 -0.83 116.25 118.43 3fpv h VAL 88 Ca 0.14 -1.94 -0.07 0.00 -1.01 0.00 0.00 66.70 63.82 3fpv h VAL 88 Cb 0.13 2.16 -0.01 0.00 -2.01 0.00 0.00 31.29 31.55 3fpv h VAL 88 CO -0.02 0.48 -0.16 0.28 -1.01 0.00 0.00 177.57 177.15 3fpv h SER 89 N 0.00 0.40 0.00 3.17 0.02 -1.19 -3.23 113.55 112.72 3fpv h SER 89 Ca -0.00 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 3fpv h SER 89 Cb 1.12 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.55 3fpv h SER 89 CO 0.06 0.59 0.00 0.79 -1.14 0.00 0.00 176.83 177.13 3fpv n TRP 90 N -4.20 0.00 -3.74 3.45 8.01 -1.20 -5.02 117.44 114.74 3fpv n TRP 90 Ca 0.00 -0.21 -0.23 0.00 -1.31 0.00 0.00 57.50 55.75 3fpv n TRP 90 Cb 0.33 -0.02 0.03 0.00 -2.01 0.00 0.00 31.31 29.64 3fpv n TRP 90 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.69 174.97 3fpv n ASN 91 N -0.21 -1.90 -3.65 -0.99 5.15 -0.36 -4.99 115.26 108.31 3fpv n ASN 91 Ca 0.00 -0.81 -0.14 0.00 -0.60 0.00 0.00 54.58 53.03 3fpv n ASN 91 Cb 0.16 -4.02 -0.07 0.00 -0.53 0.00 0.00 39.78 35.32 3fpv n ASN 91 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3fpv s ALA 92 N -3.60 -1.12 0.35 5.20 0.00 -0.97 -4.94 121.76 116.68 3fpv s ALA 92 Ca 0.14 0.51 -0.27 0.00 0.00 0.00 0.00 51.96 52.33 3fpv s ALA 92 Cb -0.07 0.24 -0.12 0.00 0.00 0.00 0.00 23.12 23.17 3fpv s ALA 92 CO 0.82 -0.41 1.21 -2.30 0.00 0.00 0.00 175.76 175.08 3fpv n PRO 93 N 0.72 1.88 0.22 0.00 -0.02 -1.26 -4.34 135.00 132.20 3fpv n PRO 93 Ca -0.19 0.66 0.07 0.00 -2.02 0.00 0.00 63.50 62.02 3fpv n PRO 93 Cb 0.59 -2.22 0.51 0.00 -0.02 0.00 0.00 33.50 32.36 3fpv n PRO 93 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3fpv h THR 94 N 2.28 0.94 -0.63 3.45 1.35 -1.35 -0.18 112.91 118.78 3fpv h THR 94 Ca -0.45 -0.94 0.00 0.00 -0.55 0.00 0.00 66.41 64.47 3fpv h THR 94 Cb 1.30 1.54 -0.03 0.00 -1.73 0.00 0.00 68.15 69.23 3fpv h THR 94 CO 0.61 0.25 0.40 0.77 -0.25 0.00 0.00 175.52 177.30 3fpv h SER 95 N 0.00 0.73 -0.79 5.36 4.64 -1.80 0.16 113.55 121.85 3fpv h SER 95 Ca -0.00 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.24 3fpv h SER 95 Cb 0.52 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 62.39 3fpv h SER 95 CO 0.03 0.55 0.34 -0.08 -0.87 0.00 0.00 176.83 176.81 3fpv h GLU 96 N 0.85 1.16 -0.00 4.77 4.81 -1.70 -3.27 114.58 121.20 3fpv h GLU 96 Ca 0.23 -0.19 -0.15 0.00 -0.13 0.00 0.00 59.36 59.12 3fpv h GLU 96 Cb -0.07 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.09 3fpv h GLU 96 CO -0.05 0.92 -0.70 -0.07 -0.73 0.00 0.00 179.01 178.39 3fpv h LEU 97 N 1.13 0.03 -1.70 1.64 3.38 -0.40 -2.80 115.31 116.59 3fpv h LEU 97 Ca 0.27 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.18 3fpv h LEU 97 Cb 0.17 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 3fpv h LEU 97 CO -0.03 0.72 -0.18 0.00 0.09 0.00 0.00 178.44 179.04 3fpv h ALA 98 N 1.28 1.32 0.00 1.53 0.00 -0.75 -1.65 119.26 120.99 3fpv h ALA 98 Ca -0.01 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3fpv h ALA 98 Cb 1.24 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 3fpv h ALA 98 CO 0.09 0.22 -0.00 0.87 0.00 0.00 0.00 179.25 180.43 3fpv h LYS 99 N 0.00 0.00 0.00 0.00 1.57 -1.58 -2.91 116.57 113.65 3fpv h LYS 99 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3fpv h LYS 99 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3fpv h LYS 99 CO 0.02 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.91 3fpv h ARG 100 N 0.00 0.00 0.00 3.15 3.08 -1.42 -3.19 114.38 116.00 3fpv h ARG 100 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3fpv h ARG 100 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3fpv h ARG 100 CO 0.00 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.18 3fpv n LEU 101 N -2.45 0.59 0.09 3.04 4.77 -1.10 -1.57 117.00 120.37 3fpv n LEU 101 Ca 0.03 0.58 -0.12 0.00 -0.03 0.00 0.00 56.01 56.46 3fpv n LEU 101 Cb 0.34 -0.41 -0.07 0.00 -2.33 0.00 0.00 43.42 40.95 3fpv n LEU 101 CO 0.26 -0.23 0.81 0.00 -1.33 0.00 0.00 177.39 176.90 3fpv h ALA 102 N 2.56 -0.17 0.01 -1.18 0.00 -1.78 -3.07 119.26 115.64 3fpv h ALA 102 Ca 0.00 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.61 3fpv h ALA 102 Cb 0.59 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 3fpv h ALA 102 CO 0.00 -0.61 -1.50 -0.56 0.00 0.00 0.00 179.25 176.58 3fpv h GLN 103 N -0.19 0.03 -2.46 0.00 -0.00 -1.77 -3.43 115.11 107.29 3fpv h GLN 103 Ca 0.00 -0.04 -0.59 0.00 -0.00 0.00 0.00 58.65 58.01 3fpv h GLN 103 Cb 0.18 0.02 -0.39 0.00 -0.00 0.00 0.00 27.48 27.29 3fpv h GLN 103 CO -0.02 0.70 -0.89 0.00 -0.00 0.00 0.00 178.83 178.62 3fpv n ALA 104 N -2.52 2.98 0.62 0.06 0.00 -0.61 -4.98 120.51 116.06 3fpv n ALA 104 Ca -0.12 -3.51 0.13 0.00 0.00 0.00 0.00 53.44 49.93 3fpv n ALA 104 Cb 1.02 -0.82 0.45 0.00 0.00 0.00 0.00 19.45 20.10 3fpv n ALA 104 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3fpv n PRO 105 N 2.38 0.20 -0.30 0.00 -0.02 -1.16 -2.70 135.00 133.41 3fpv n PRO 105 Ca 0.27 0.23 0.11 0.00 -2.02 0.00 0.00 63.50 62.09 3fpv n PRO 105 Cb 0.46 -1.77 0.28 0.00 -0.02 0.00 0.00 33.50 32.45 3fpv n PRO 105 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3fpv n THR 106 N -2.12 0.78 0.27 3.45 -2.24 -1.26 -3.85 114.28 109.31 3fpv n THR 106 Ca 0.05 -0.84 0.09 0.00 -2.27 0.00 0.00 64.05 61.08 3fpv n THR 106 Cb 0.36 0.54 0.68 0.00 -2.10 0.00 0.00 70.33 69.81 3fpv n THR 106 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3fpv h LEU 107 N 3.91 0.00 -0.08 3.22 3.38 -1.91 -2.40 115.31 121.44 3fpv h LEU 107 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3fpv h LEU 107 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 3fpv h LEU 107 CO 0.00 0.00 -0.02 2.29 0.09 0.00 0.00 178.44 180.81 3fpv n LYS 108 N -4.44 0.76 0.00 1.13 2.85 -1.25 -2.79 118.16 114.43 3fpv n LYS 108 Ca -0.03 -0.08 0.12 0.00 -1.05 0.00 0.00 58.31 57.28 3fpv n LYS 108 Cb 0.09 -1.50 0.27 0.00 -0.65 0.00 0.00 35.03 33.24 3fpv n LYS 108 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3fpv n ASP 109 N -1.05 1.14 -4.67 -5.58 8.00 -0.90 -4.85 116.55 108.63 3fpv n ASP 109 Ca 0.19 -0.92 -0.42 0.00 0.71 0.00 0.00 54.79 54.34 3fpv n ASP 109 Cb 0.20 0.26 -0.03 0.00 -0.02 0.00 0.00 41.12 41.52 3fpv n ASP 109 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3fpv s ILE 110 N -2.59 3.36 0.26 0.53 1.01 -1.12 -4.93 121.20 117.72 3fpv s ILE 110 Ca 0.21 0.59 -0.30 0.00 0.00 0.00 0.00 60.65 61.14 3fpv s ILE 110 Cb 0.19 -3.38 -0.14 0.00 0.01 0.00 0.00 42.46 39.14 3fpv s ILE 110 CO 0.57 -0.03 1.28 -2.65 0.00 0.00 0.00 174.94 174.11 3fpv n PRO 111 N 6.57 1.79 -0.40 2.79 -0.02 -1.26 -2.86 135.00 141.62 3fpv n PRO 111 Ca 0.17 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 3fpv n PRO 111 Cb 0.42 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 3fpv n PRO 111 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fpv n GLY 112 N 1.72 0.76 3.92 -1.23 0.00 -1.26 -5.03 105.19 104.06 3fpv n GLY 112 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 3fpv n GLY 112 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fpv s THR 113 N -2.83 5.17 -0.19 2.61 -4.23 -1.14 -4.72 115.64 110.31 3fpv s THR 113 Ca 0.00 -0.20 -0.04 0.00 -1.18 0.00 0.00 61.69 60.27 3fpv s THR 113 Cb 0.00 -3.71 0.07 0.00 1.34 0.00 0.00 72.50 70.20 3fpv s THR 113 CO 0.00 -0.15 0.09 -0.22 -0.54 0.00 0.00 174.62 173.80 3fpv s LEU 114 N -3.19 0.52 -1.29 4.79 2.96 -1.24 -4.98 118.68 116.24 3fpv s LEU 114 Ca 0.40 -0.75 -0.12 0.00 -0.22 0.00 0.00 54.13 53.45 3fpv s LEU 114 Cb -0.11 -0.31 0.14 0.00 0.50 0.00 0.00 46.19 46.41 3fpv s LEU 114 CO 0.28 -0.36 1.81 0.49 -1.32 0.00 0.00 176.35 177.25 3fpv n PHE 115 N 5.24 3.66 -3.71 5.38 3.01 -1.26 -4.52 117.46 125.26 3fpv n PHE 115 Ca -0.07 -2.96 -0.11 0.00 1.01 0.00 0.00 57.45 55.31 3fpv n PHE 115 Cb 0.48 -2.14 -0.10 0.00 -0.01 0.00 0.00 39.48 37.70 3fpv n PHE 115 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 3fpv s LEU 116 N 0.94 0.05 0.28 4.37 2.96 -1.26 -4.57 118.68 121.44 3fpv s LEU 116 Ca 0.42 0.91 -0.30 0.00 -0.22 0.00 0.00 54.13 54.94 3fpv s LEU 116 Cb 0.07 1.43 -0.13 0.00 0.50 0.00 0.00 46.19 48.06 3fpv s LEU 116 CO -0.00 -0.18 1.32 0.00 -1.32 0.00 0.00 176.35 176.17 3fpv n ALA 117 N 3.73 1.02 0.00 5.97 0.00 -1.26 -4.32 120.51 125.65 3fpv n ALA 117 Ca -0.19 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3fpv n ALA 117 Cb 0.56 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.77 3fpv n ALA 117 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpv n GLY 118 N 1.54 -0.99 3.27 0.00 0.00 -1.18 -4.37 105.19 103.46 3fpv n GLY 118 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 3fpv n GLY 118 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3fpv s GLY 119 N 0.00 1.27 -0.01 -0.02 0.00 -1.26 0.01 107.32 107.31 3fpv s GLY 119 Ca 0.00 -1.05 0.01 0.00 0.00 0.00 0.00 44.72 43.68 3fpv s GLY 119 CO 0.00 -0.71 -0.04 -1.08 0.00 0.00 0.00 173.10 171.27 3fpv s THR 120 N -0.28 0.34 0.43 0.90 -1.32 -0.47 -0.97 115.64 114.27 3fpv s THR 120 Ca 0.00 -0.16 -0.23 0.00 -1.21 0.00 0.00 61.69 60.10 3fpv s THR 120 Cb -0.13 -0.30 -0.08 0.00 -1.51 0.00 0.00 72.50 70.48 3fpv s THR 120 CO 0.02 0.11 1.07 -2.16 -2.21 0.00 0.00 174.62 171.45 3fpv s PRO 121 N 0.06 3.98 -0.13 7.08 0.04 -1.26 -1.30 135.00 143.47 3fpv s PRO 121 Ca -0.00 1.53 -0.01 0.00 0.04 0.00 0.00 61.00 62.55 3fpv s PRO 121 Cb -0.04 -2.40 -0.02 0.00 0.04 0.00 0.00 34.50 32.09 3fpv s PRO 121 CO -0.00 -0.31 -0.08 0.08 0.04 0.00 0.00 177.00 176.73 3fpv s VAL 122 N -1.72 3.50 0.18 -0.36 1.01 0.22 -4.89 120.40 118.34 3fpv s VAL 122 Ca 0.61 -0.51 0.08 0.00 0.00 0.00 0.00 61.98 62.17 3fpv s VAL 122 Cb -0.22 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 3fpv s VAL 122 CO 0.27 0.52 -0.07 0.42 0.00 0.00 0.00 175.10 176.24 3fpv s THR 123 N 0.17 3.33 -0.13 3.92 -4.23 -1.26 -0.61 115.64 116.82 3fpv s THR 123 Ca -0.04 -1.61 0.00 0.00 -1.18 0.00 0.00 61.69 58.86 3fpv s THR 123 Cb -0.14 -2.66 0.02 0.00 1.34 0.00 0.00 72.50 71.06 3fpv s THR 123 CO 0.04 -0.12 -0.12 0.00 -0.54 0.00 0.00 174.62 173.88 3fpv s ALA 124 N -1.73 1.62 -1.55 3.99 0.00 0.31 -4.78 121.76 119.63 3fpv s ALA 124 Ca 0.26 -0.74 -0.01 0.00 0.00 0.00 0.00 51.96 51.47 3fpv s ALA 124 Cb -0.09 -0.97 0.01 0.00 0.00 0.00 0.00 23.12 22.07 3fpv s ALA 124 CO 0.16 -0.35 0.06 1.63 0.00 0.00 0.00 175.76 177.26 3fpv n LYS 125 N 4.76 -1.17 0.00 0.00 5.02 -1.26 -2.35 118.16 123.16 3fpv n LYS 125 Ca -0.16 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 3fpv n LYS 125 Cb 0.50 -3.71 0.00 0.00 -0.02 0.00 0.00 35.03 31.80 3fpv n LYS 125 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fpv n GLY 126 N -2.48 2.98 3.83 0.72 0.00 -1.26 -5.02 105.19 103.96 3fpv n GLY 126 Ca -0.31 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.21 3fpv n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fpv s ALA 127 N -2.67 3.79 0.22 4.61 0.00 -0.99 -4.93 121.76 121.79 3fpv s ALA 127 Ca 0.00 -0.56 -0.30 0.00 0.00 0.00 0.00 51.96 51.10 3fpv s ALA 127 Cb 0.00 -2.11 -0.10 0.00 0.00 0.00 0.00 23.12 20.91 3fpv s ALA 127 CO 0.00 0.47 1.42 -1.25 0.00 0.00 0.00 175.76 176.40 3fpv s PRO 128 N -0.68 4.29 0.00 0.00 0.04 -1.26 -0.53 135.00 136.87 3fpv s PRO 128 Ca 0.15 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.43 3fpv s PRO 128 Cb -0.13 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.27 3fpv s PRO 128 CO 0.05 -0.40 0.00 1.33 0.04 0.00 0.00 177.00 178.02 3fpv n VAL 129 N 2.64 0.00 -3.68 -0.36 0.24 0.22 -4.80 118.33 112.58 3fpv n VAL 129 Ca 0.08 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.26 3fpv n VAL 129 Cb 0.41 -0.29 -0.06 0.00 -1.47 0.00 0.00 33.84 32.42 3fpv n VAL 129 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3fpv s ALA 130 N -1.82 -0.89 0.02 2.33 0.00 -1.02 -1.21 121.76 119.16 3fpv s ALA 130 Ca 0.00 0.11 0.07 0.00 0.00 0.00 0.00 51.96 52.14 3fpv s ALA 130 Cb 0.00 0.44 -0.03 0.00 0.00 0.00 0.00 23.12 23.53 3fpv s ALA 130 CO 0.00 -0.50 -0.21 0.20 0.00 0.00 0.00 175.76 175.25 3fpv s GLY 131 N -2.28 1.46 -0.23 0.00 0.00 0.13 0.70 107.32 107.11 3fpv s GLY 131 Ca -0.02 -1.17 -0.07 0.00 0.00 0.00 0.00 44.72 43.46 3fpv s GLY 131 CO -0.06 -1.03 0.06 -0.42 0.00 0.00 0.00 173.10 171.66 3fpv s ILE 132 N -0.80 4.34 -0.09 0.90 1.01 -0.42 -1.06 121.20 125.07 3fpv s ILE 132 Ca 0.12 -0.17 0.01 0.00 0.00 0.00 0.00 60.65 60.61 3fpv s ILE 132 Cb -0.10 -3.01 -0.02 0.00 0.01 0.00 0.00 42.46 39.34 3fpv s ILE 132 CO 0.02 0.37 -0.10 -0.83 0.00 0.00 0.00 174.94 174.40 3fpv s GLY 133 N 1.33 1.60 -0.02 6.18 0.00 0.90 -1.36 107.32 115.95 3fpv s GLY 133 Ca 0.05 -0.91 0.04 0.00 0.00 0.00 0.00 44.72 43.90 3fpv s GLY 133 CO 0.03 -0.49 -0.14 0.14 0.00 0.00 0.00 173.10 172.65 3fpv s VAL 134 N -0.31 1.10 -0.01 1.40 1.01 0.10 -0.86 120.40 122.83 3fpv s VAL 134 Ca 0.03 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 3fpv s VAL 134 Cb -0.13 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.33 3fpv s VAL 134 CO 0.03 0.32 0.04 0.00 0.00 0.00 0.00 175.10 175.48 3fpv s ALA 135 N -0.18 -0.10 0.00 5.51 0.00 -0.80 -4.61 121.76 121.58 3fpv s ALA 135 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 51.96 51.98 3fpv s ALA 135 Cb -0.07 -0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.02 3fpv s ALA 135 CO 0.00 -0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.11 3fpv n GLY 136 N 2.69 0.78 3.74 0.00 0.00 -1.26 -1.15 105.19 109.99 3fpv n GLY 136 Ca -0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 3fpv n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fpv s ALA 137 N -1.71 1.60 0.55 4.61 0.00 -1.26 -4.71 121.76 120.83 3fpv s ALA 137 Ca 0.00 -0.29 0.27 0.00 0.00 0.00 0.00 51.96 51.94 3fpv s ALA 137 Cb 0.00 -3.11 1.46 0.00 0.00 0.00 0.00 23.12 21.47 3fpv s ALA 137 CO 0.00 -2.33 2.00 -1.35 0.00 0.00 0.00 175.76 174.08 3fpv h PRO 138 N -1.53 0.00 -4.08 0.00 0.11 -1.98 -3.42 132.00 121.10 3fpv h PRO 138 Ca -0.51 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.49 3fpv h PRO 138 Cb 1.30 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.27 3fpv h PRO 138 CO 0.58 0.00 -0.55 -1.54 -0.21 0.00 0.00 178.00 176.29 3fpv s SER 139 N -5.95 0.32 0.42 -2.05 1.04 -1.26 -5.04 113.70 101.19 3fpv s SER 139 Ca -0.05 -0.88 0.20 0.00 0.48 0.00 0.00 55.95 55.71 3fpv s SER 139 Cb 0.18 0.27 0.94 0.00 0.10 0.00 0.00 66.02 67.51 3fpv s SER 139 CO 0.66 -0.67 1.86 1.23 0.98 0.00 0.00 173.24 177.30 3fpv h GLY 140 N 2.95 0.00 1.19 7.32 0.00 -1.81 -2.05 103.07 110.67 3fpv h GLY 140 Ca -0.34 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 46.90 3fpv h GLY 140 CO 0.61 0.00 -0.03 -0.55 0.00 0.00 0.00 176.54 176.57 3fpv h ASP 141 N 0.00 0.94 -0.36 0.19 3.32 -1.97 -0.04 116.42 118.51 3fpv h ASP 141 Ca -0.00 -0.27 -0.16 0.00 0.02 0.00 0.00 57.03 56.62 3fpv h ASP 141 Cb 0.66 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 3fpv h ASP 141 CO 0.04 1.02 -0.40 -0.07 -1.72 0.00 0.00 179.24 178.10 3fpv h LEU 142 N 0.88 0.98 -0.54 1.55 3.38 -1.90 -2.48 115.31 117.19 3fpv h LEU 142 Ca 0.16 -0.46 0.11 0.00 0.09 0.00 0.00 57.88 57.78 3fpv h LEU 142 Cb 0.55 -0.28 -0.09 0.00 0.09 0.00 0.00 40.66 40.93 3fpv h LEU 142 CO 0.03 1.25 -0.05 0.44 0.09 0.00 0.00 178.44 180.20 3fpv h ASP 143 N 0.74 -0.33 0.65 -0.43 3.32 -1.07 -2.26 116.42 117.04 3fpv h ASP 143 Ca 0.06 0.14 -0.10 0.00 0.02 0.00 0.00 57.03 57.15 3fpv h ASP 143 Cb 0.99 0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.80 3fpv h ASP 143 CO 0.10 -0.12 -0.49 -0.08 -1.72 0.00 0.00 179.24 176.93 3fpv h GLU 144 N 0.07 0.00 -0.67 3.56 4.81 -0.93 -1.08 114.58 120.34 3fpv h GLU 144 Ca 0.27 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.48 3fpv h GLU 144 Cb 0.42 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 3fpv h GLU 144 CO -0.49 0.49 0.36 0.37 -0.73 0.00 0.00 179.01 179.01 3fpv h GLN 145 N 0.00 0.95 -0.15 1.92 4.15 -0.98 0.36 115.11 121.35 3fpv h GLN 145 Ca -0.00 -0.12 -0.13 0.00 0.77 0.00 0.00 58.65 59.17 3fpv h GLN 145 Cb 0.94 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 28.44 3fpv h GLN 145 CO 0.06 0.72 -0.48 1.88 -1.93 0.00 0.00 178.83 179.08 3fpv h TYR 146 N 0.93 0.46 -0.71 3.99 0.05 -0.90 -1.60 116.97 119.18 3fpv h TYR 146 Ca 0.24 -0.14 -0.07 0.00 0.05 0.00 0.00 58.73 58.80 3fpv h TYR 146 Cb 0.05 -0.09 -0.03 0.00 1.01 0.00 0.00 36.73 37.67 3fpv h TYR 146 CO -0.00 0.79 0.18 0.00 -1.05 0.00 0.00 178.16 178.07 3fpv h ALA 147 N 1.19 0.93 -0.41 3.88 0.00 -0.90 -0.64 119.26 123.31 3fpv h ALA 147 Ca 0.02 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 3fpv h ALA 147 Cb 0.96 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 3fpv h ALA 147 CO 0.08 0.65 -0.14 0.00 0.00 0.00 0.00 179.25 179.85 3fpv h ARG 148 N 1.07 0.76 -0.43 0.00 3.08 -0.79 -1.19 114.38 116.88 3fpv h ARG 148 Ca 0.22 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 3fpv h ARG 148 Cb 0.36 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 3fpv h ARG 148 CO 0.00 0.86 0.17 0.00 -1.07 0.00 0.00 179.97 179.93 3fpv h ALA 149 N 1.16 1.49 -0.17 0.04 0.00 -0.99 -1.15 119.26 119.65 3fpv h ALA 149 Ca 0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3fpv h ALA 149 Cb 0.62 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3fpv h ALA 149 CO 0.04 0.39 0.04 0.78 0.00 0.00 0.00 179.25 180.51 3fpv h GLY 150 N 0.76 0.28 2.00 0.00 0.00 -0.53 -2.99 103.07 102.60 3fpv h GLY 150 Ca 0.15 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 3fpv h GLY 150 CO -0.01 0.16 -0.08 0.00 0.00 0.00 0.00 176.54 176.61 3fpv h ALA 151 N 0.85 1.61 0.00 3.60 0.00 -0.92 -3.19 119.26 121.22 3fpv h ALA 151 Ca 0.05 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3fpv h ALA 151 Cb 0.25 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3fpv h ALA 151 CO -0.00 0.10 -0.41 0.00 0.00 0.00 0.00 179.25 178.94 3fpv h ALA 152 N 1.92 1.10 0.00 0.00 0.00 -1.06 -2.37 119.26 118.85 3fpv h ALA 152 Ca -0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3fpv h ALA 152 Cb 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3fpv h ALA 152 CO 0.01 0.51 0.00 1.33 0.00 0.00 0.00 179.25 181.10 3fpv n VAL 153 N -3.73 0.60 -2.70 0.00 0.24 -1.21 -4.67 118.33 106.86 3fpv n VAL 153 Ca -0.01 -0.08 -0.30 0.00 -2.04 0.00 0.00 64.34 61.92 3fpv n VAL 153 Cb 0.49 -0.75 -0.02 0.00 -1.47 0.00 0.00 33.84 32.08 3fpv n VAL 153 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3fpv s LEU 154 N -4.20 3.72 0.04 1.34 1.43 -0.89 -4.12 118.68 116.00 3fpv s LEU 154 Ca 0.09 1.12 -0.30 0.00 -1.03 0.00 0.00 54.13 54.02 3fpv s LEU 154 Cb 0.12 -4.04 -0.16 0.00 0.03 0.00 0.00 46.19 42.14 3fpv s LEU 154 CO 0.51 -0.49 1.40 1.23 0.23 0.00 0.00 176.35 179.23 3fpv h GLY 155 N 0.86 -1.12 -1.82 -3.19 0.00 -1.83 -3.50 103.07 92.47 3fpv h GLY 155 Ca -0.47 0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.28 3fpv h GLY 155 CO 0.63 -0.41 0.00 1.42 0.00 0.00 0.00 176.54 178.18