#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 3.10 0.48 2.33 0.00 -1.26 -5.08 121.76 121.32 3fpv s ALA 17 Ca 0.00 -1.35 -0.24 0.00 0.00 0.00 0.00 51.96 50.37 3fpv s ALA 17 Cb 0.00 -2.13 -0.07 0.00 0.00 0.00 0.00 23.12 20.92 3fpv s ALA 17 CO 0.00 -0.79 1.33 0.00 0.00 0.00 0.00 175.76 176.30 3fpv s ALA 18 N 1.54 3.05 0.35 0.00 0.00 -1.26 -5.07 121.76 120.36 3fpv s ALA 18 Ca 0.04 1.28 -0.04 0.00 0.00 0.00 0.00 51.96 53.24 3fpv s ALA 18 Cb -0.16 -3.53 0.01 0.00 0.00 0.00 0.00 23.12 19.44 3fpv s ALA 18 CO 0.03 -1.10 0.52 -0.98 0.00 0.00 0.00 175.76 174.23 3fpv s ARG 19 N -2.61 1.97 0.00 0.00 1.70 -1.26 -5.03 118.95 113.72 3fpv s ARG 19 Ca 0.64 -1.72 0.28 0.00 -0.47 0.00 0.00 55.73 54.46 3fpv s ARG 19 Cb -0.39 0.47 1.00 0.00 -0.57 0.00 0.00 34.95 35.46 3fpv s ARG 19 CO 0.48 -0.83 1.76 0.41 -1.08 0.00 0.00 175.30 176.03 3fpv n GLY 20 N -0.57 -1.40 0.20 3.88 0.00 -1.26 -2.26 105.19 103.79 3fpv n GLY 20 Ca -0.00 -0.19 0.06 0.00 0.00 0.00 0.00 46.02 45.89 3fpv n GLY 20 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3fpv h GLY 21 N 5.00 0.00 -0.62 -0.02 0.00 -2.05 -3.00 103.07 102.38 3fpv h GLY 21 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3fpv h GLY 21 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.72 3fpv n GLU 22 N -3.70 1.69 -4.48 4.80 1.02 -0.96 -4.92 120.64 114.09 3fpv n GLU 22 Ca -0.01 -1.02 -0.30 0.00 -0.02 0.00 0.00 57.16 55.82 3fpv n GLU 22 Cb 0.43 -1.44 -0.12 0.00 -0.02 0.00 0.00 31.44 30.28 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 -1.80 2.53 0.06 -4.62 1.43 -1.14 -4.99 118.68 110.16 3fpv s LEU 23 Ca 0.35 -0.58 -0.04 0.00 -1.03 0.00 0.00 54.13 52.84 3fpv s LEU 23 Cb 0.19 -1.43 -0.03 0.00 0.03 0.00 0.00 46.19 44.95 3fpv s LEU 23 CO 0.30 0.21 0.05 0.28 0.23 0.00 0.00 176.35 177.42 3fpv s THR 24 N -1.03 0.19 0.13 5.49 -1.32 -1.26 -4.99 115.64 112.85 3fpv s THR 24 Ca 0.15 -1.58 0.03 0.00 -1.21 0.00 0.00 61.69 59.08 3fpv s THR 24 Cb -0.10 -1.46 -0.04 0.00 -1.51 0.00 0.00 72.50 69.39 3fpv s THR 24 CO 0.07 -0.87 0.19 -1.10 -2.21 0.00 0.00 174.62 170.70 3fpv s GLN 25 N -3.90 3.18 0.10 7.08 -1.52 -1.26 -5.13 119.66 118.21 3fpv s GLN 25 Ca 0.06 -0.67 0.04 0.00 -1.95 0.00 0.00 55.36 52.84 3fpv s GLN 25 Cb 0.07 -2.84 -0.04 0.00 -0.22 0.00 0.00 33.01 29.98 3fpv s GLN 25 CO -0.10 0.53 -0.10 -1.54 -0.25 0.00 0.00 175.29 173.83 3fpv s SER 26 N -2.93 1.44 -0.05 5.90 1.04 -1.26 -5.16 113.70 112.68 3fpv s SER 26 Ca 0.33 -0.82 -0.01 0.00 0.48 0.00 0.00 55.95 55.93 3fpv s SER 26 Cb -0.11 0.01 -0.04 0.00 0.10 0.00 0.00 66.02 65.98 3fpv s SER 26 CO 0.26 -0.27 0.05 -0.89 0.98 0.00 0.00 173.24 173.37 3fpv s THR 27 N -2.46 4.59 0.02 2.02 2.01 -1.26 -5.11 115.64 115.45 3fpv s THR 27 Ca 0.05 -0.30 -0.05 0.00 0.31 0.00 0.00 61.69 61.71 3fpv s THR 27 Cb -0.03 -3.02 -0.01 0.00 0.01 0.00 0.00 72.50 69.45 3fpv s THR 27 CO -0.00 0.48 0.08 -1.00 -0.69 0.00 0.00 174.62 173.49 3fpv s HIS 28 N -1.05 0.16 0.27 4.92 3.76 -1.26 -4.79 115.29 117.31 3fpv s HIS 28 Ca 0.18 -0.38 -0.30 0.00 -0.15 0.00 0.00 55.06 54.40 3fpv s HIS 28 Cb -0.12 -0.12 -0.12 0.00 1.11 0.00 0.00 32.58 33.33 3fpv s HIS 28 CO 0.08 -0.30 1.54 1.28 -0.85 0.00 0.00 174.74 176.49 3fpv n LEU 29 N 1.17 3.96 -4.69 0.89 4.77 -1.26 -5.03 117.00 116.81 3fpv n LEU 29 Ca -0.21 1.14 -0.33 0.00 -0.03 0.00 0.00 56.01 56.58 3fpv n LEU 29 Cb 0.57 -1.54 0.13 0.00 -2.33 0.00 0.00 43.42 40.25 3fpv n LEU 29 CO 0.22 -0.05 0.75 0.35 -1.33 0.00 0.00 177.39 177.33 3fpv n THR 30 N 2.12 1.90 -0.27 -5.08 -2.24 -1.26 -4.86 114.28 104.59 3fpv n THR 30 Ca 0.10 -0.20 0.03 0.00 -2.27 0.00 0.00 64.05 61.71 3fpv n THR 30 Cb 0.35 -1.18 0.16 0.00 -2.10 0.00 0.00 70.33 67.56 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 -0.96 0.55 -0.62 3.22 5.85 -1.97 -0.99 115.31 120.38 3fpv h LEU 31 Ca -0.46 0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.40 3fpv h LEU 31 Cb 1.30 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 42.22 3fpv h LEU 31 CO 0.45 0.30 0.27 -0.08 -0.34 0.00 0.00 178.44 179.05 3fpv h GLU 32 N 0.67 0.47 -0.33 1.25 4.57 -1.99 0.71 114.58 119.93 3fpv h GLU 32 Ca 0.38 -0.03 -0.12 0.00 -1.18 0.00 0.00 59.36 58.42 3fpv h GLU 32 Cb 0.41 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.89 3fpv h GLU 32 CO -0.28 0.31 -0.25 0.00 -1.18 0.00 0.00 179.01 177.62 3fpv h ALA 33 N 1.40 0.48 -0.72 2.92 0.00 -1.82 -2.15 119.26 119.37 3fpv h ALA 33 Ca 0.30 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 3fpv h ALA 33 Cb 0.33 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3fpv h ALA 33 CO -0.27 0.46 0.24 0.00 0.00 0.00 0.00 179.25 179.69 3fpv h ALA 34 N 0.75 0.94 -0.39 0.00 0.00 -0.74 -1.94 119.26 117.87 3fpv h ALA 34 Ca 0.06 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 3fpv h ALA 34 Cb 0.81 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3fpv h ALA 34 CO 0.07 0.61 0.01 1.15 0.00 0.00 0.00 179.25 181.08 3fpv h THR 35 N 1.05 1.26 -0.35 0.00 2.02 -0.85 -1.31 112.91 114.73 3fpv h THR 35 Ca 0.23 -0.99 0.05 0.00 0.77 0.00 0.00 66.41 66.48 3fpv h THR 35 Cb 0.28 1.13 -0.05 0.00 -1.74 0.00 0.00 68.15 67.78 3fpv h THR 35 CO -0.01 0.33 0.07 0.50 0.37 0.00 0.00 175.52 176.79 3fpv h LYS 36 N 0.51 0.19 -0.31 6.66 3.64 -1.18 -0.80 116.57 125.28 3fpv h LYS 36 Ca 0.11 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 3fpv h LYS 36 Cb 0.46 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 3fpv h LYS 36 CO 0.02 0.13 0.03 0.00 -2.27 0.00 0.00 179.45 177.36 3fpv h ALA 37 N 1.26 0.41 -0.67 5.00 0.00 -1.28 -1.70 119.26 122.28 3fpv h ALA 37 Ca 0.17 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.88 3fpv h ALA 37 Cb 0.18 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 3fpv h ALA 37 CO -0.21 0.12 0.43 0.00 0.00 0.00 0.00 179.25 179.59 3fpv h ALA 38 N 0.87 0.86 -0.02 0.00 0.00 -1.01 -1.45 119.26 118.50 3fpv h ALA 38 Ca 0.09 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 3fpv h ALA 38 Cb 0.38 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3fpv h ALA 38 CO 0.01 0.23 -0.56 0.00 0.00 0.00 0.00 179.25 178.92 3fpv h ARG 39 N 0.86 0.05 -0.26 0.00 3.08 -1.07 -2.56 114.38 114.47 3fpv h ARG 39 Ca 0.25 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 60.14 3fpv h ARG 39 Cb -0.05 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 3fpv h ARG 39 CO -0.08 0.60 -0.41 0.00 -1.07 0.00 0.00 179.97 179.01 3fpv h ALA 40 N 1.40 0.80 -0.62 0.04 0.00 -0.86 -0.99 119.26 119.04 3fpv h ALA 40 Ca -0.00 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 3fpv h ALA 40 Cb 1.01 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 3fpv h ALA 40 CO 0.08 0.65 0.20 0.00 0.00 0.00 0.00 179.25 180.18 3fpv h ALA 41 N 1.04 0.81 -0.27 0.00 0.00 -1.09 -0.46 119.26 119.29 3fpv h ALA 41 Ca 0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3fpv h ALA 41 Cb 0.92 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3fpv h ALA 41 CO 0.08 0.47 0.10 0.28 0.00 0.00 0.00 179.25 180.18 3fpv h VAL 42 N 0.88 1.18 -0.44 0.00 2.07 -1.35 -2.18 116.25 116.42 3fpv h VAL 42 Ca 0.20 -0.56 -0.05 0.00 0.82 0.00 0.00 66.70 67.11 3fpv h VAL 42 Cb 0.28 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 3fpv h VAL 42 CO -0.01 0.19 0.05 -0.08 0.02 0.00 0.00 177.57 177.74 3fpv h GLU 43 N 0.28 0.68 -0.57 1.57 4.81 -1.03 0.18 114.58 120.50 3fpv h GLU 43 Ca 0.09 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 3fpv h GLU 43 Cb 0.20 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 3fpv h GLU 43 CO -0.01 0.66 0.30 0.00 -0.73 0.00 0.00 179.01 179.23 3fpv h ALA 44 N 1.41 0.73 -0.31 2.92 0.00 -0.99 -2.39 119.26 120.62 3fpv h ALA 44 Ca 0.14 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 3fpv h ALA 44 Cb 0.33 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3fpv h ALA 44 CO 0.01 0.26 -0.50 0.00 0.00 0.00 0.00 179.25 179.01 3fpv h ALA 45 N 1.13 0.52 0.00 0.00 0.00 -0.63 -3.04 119.26 117.25 3fpv h ALA 45 Ca 0.20 -0.50 -0.05 0.00 0.00 0.00 0.00 54.91 54.56 3fpv h ALA 45 Cb 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3fpv h ALA 45 CO -0.03 0.68 -0.22 0.93 0.00 0.00 0.00 179.25 180.61 3fpv h GLU 46 N 0.68 0.00 0.00 0.00 4.39 -0.66 -0.72 114.58 118.27 3fpv h GLU 46 Ca 0.03 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 3fpv h GLU 46 Cb 1.10 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.75 3fpv h GLU 46 CO 0.11 0.22 -0.11 -0.22 -1.16 0.00 0.00 179.01 177.85 3fpv h LYS 47 N 0.00 0.00 -0.57 2.33 3.64 -1.31 -1.91 116.57 118.75 3fpv h LYS 47 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3fpv h LYS 47 Cb 0.44 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 3fpv h LYS 47 CO 0.03 0.11 0.00 -0.25 -2.27 0.00 0.00 179.45 177.07 3fpv n ASP 48 N -3.93 3.74 -0.48 4.20 8.00 -0.52 -4.95 116.55 122.62 3fpv n ASP 48 Ca -0.02 -2.00 -0.04 0.00 0.71 0.00 0.00 54.79 53.44 3fpv n ASP 48 Cb 0.20 -0.38 -0.00 0.00 -0.02 0.00 0.00 41.12 40.92 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 1.58 0.23 3.47 0.44 0.00 -0.72 -5.02 105.19 105.17 3fpv n GLY 49 Ca 0.22 -0.72 -0.33 0.00 0.00 0.00 0.00 46.02 45.19 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 -4.09 3.00 -0.41 1.61 3.00 -0.39 -4.99 118.95 116.68 3fpv s ARG 50 Ca 0.00 -0.64 -0.11 0.00 0.00 0.00 0.00 55.73 54.99 3fpv s ARG 50 Cb 0.00 -2.58 0.06 0.00 0.00 0.00 0.00 34.95 32.43 3fpv s ARG 50 CO 0.00 0.45 0.27 -1.01 0.00 0.00 0.00 175.30 175.01 3fpv s HIS 51 N -0.25 3.29 0.26 -0.53 3.76 -1.26 -3.76 115.29 116.79 3fpv s HIS 51 Ca 0.02 -1.25 0.10 0.00 -0.15 0.00 0.00 55.06 53.79 3fpv s HIS 51 Cb -0.13 -2.82 -0.05 0.00 1.11 0.00 0.00 32.58 30.69 3fpv s HIS 51 CO 0.03 -0.78 -0.17 0.14 -0.85 0.00 0.00 174.74 173.11 3fpv s VAL 52 N 1.50 2.18 -0.04 -0.90 -7.23 -1.26 -4.24 120.40 110.41 3fpv s VAL 52 Ca 0.03 -2.32 -0.02 0.00 -1.81 0.00 0.00 61.98 57.85 3fpv s VAL 52 Cb -0.22 -2.24 -0.04 0.00 0.56 0.00 0.00 36.38 34.44 3fpv s VAL 52 CO 0.04 -0.45 0.10 -0.44 -0.31 0.00 0.00 175.10 174.04 3fpv s SER 53 N -3.45 5.87 -0.01 4.85 0.01 -0.10 -1.47 113.70 119.40 3fpv s SER 53 Ca 0.28 0.25 0.06 0.00 1.31 0.00 0.00 55.95 57.85 3fpv s SER 53 Cb -0.03 -1.76 -0.02 0.00 0.21 0.00 0.00 66.02 64.43 3fpv s SER 53 CO 0.12 0.32 -0.21 -0.69 0.41 0.00 0.00 173.24 173.20 3fpv s VAL 54 N -1.13 1.63 0.00 3.43 1.01 -0.14 -1.67 120.40 123.53 3fpv s VAL 54 Ca 0.20 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.29 3fpv s VAL 54 Cb -0.12 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.89 3fpv s VAL 54 CO 0.10 0.44 -0.08 0.00 0.00 0.00 0.00 175.10 175.56 3fpv s ALA 55 N -0.51 0.63 -0.18 5.51 0.00 0.11 -0.70 121.76 126.62 3fpv s ALA 55 Ca 0.08 -0.38 -0.02 0.00 0.00 0.00 0.00 51.96 51.63 3fpv s ALA 55 Cb -0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 3fpv s ALA 55 CO -0.01 0.14 -0.08 0.08 0.00 0.00 0.00 175.76 175.89 3fpv s VAL 56 N -0.32 3.31 -0.11 0.00 1.01 0.66 -0.17 120.40 124.77 3fpv s VAL 56 Ca 0.02 -0.54 0.03 0.00 0.00 0.00 0.00 61.98 61.48 3fpv s VAL 56 Cb -0.04 -2.46 0.01 0.00 0.00 0.00 0.00 36.38 33.90 3fpv s VAL 56 CO -0.00 0.47 -0.20 -0.69 0.00 0.00 0.00 175.10 174.68 3fpv s VAL 57 N 0.90 1.82 0.88 2.92 1.01 -0.31 -0.22 120.40 127.39 3fpv s VAL 57 Ca -0.02 -0.85 -0.10 0.00 0.00 0.00 0.00 61.98 61.01 3fpv s VAL 57 Cb -0.15 -1.61 0.12 0.00 0.00 0.00 0.00 36.38 34.75 3fpv s VAL 57 CO 0.01 0.50 1.12 -0.62 0.00 0.00 0.00 175.10 176.11 3fpv s ASP 58 N 0.70 3.38 0.31 3.32 2.15 0.14 -0.22 116.67 126.44 3fpv s ASP 58 Ca -0.11 2.02 0.24 0.00 0.43 0.00 0.00 52.55 55.12 3fpv s ASP 58 Cb -0.16 -2.53 1.11 0.00 -0.30 0.00 0.00 42.92 41.04 3fpv s ASP 58 CO 0.02 -2.78 1.72 -0.09 -0.17 0.00 0.00 175.17 173.87 3fpv h ARG 59 N -1.65 0.00 -0.85 4.34 9.65 -1.60 -3.13 114.38 121.14 3fpv h ARG 59 Ca -0.44 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.39 3fpv h ARG 59 Cb 1.26 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.81 3fpv h ARG 59 CO 0.45 0.00 0.06 0.27 2.80 0.00 0.00 179.97 183.56 3fpv n ASN 60 N -2.30 3.18 -4.56 -3.80 0.23 -1.26 -4.92 115.26 101.83 3fpv n ASN 60 Ca 0.00 -2.48 -0.33 0.00 -0.53 0.00 0.00 54.58 51.24 3fpv n ASN 60 Cb 0.15 -0.60 -0.04 0.00 -2.08 0.00 0.00 39.78 37.21 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 -0.28 0.69 0.38 4.83 0.00 -1.18 -5.05 107.32 106.70 3fpv s GLY 61 Ca 0.25 -1.88 -0.28 0.00 0.00 0.00 0.00 44.72 42.80 3fpv s GLY 61 CO 0.07 3.12 1.50 -1.31 0.00 0.00 0.00 173.10 176.48 3fpv s ASN 62 N 6.57 6.32 0.12 1.64 0.01 -1.26 -4.74 114.94 123.60 3fpv s ASN 62 Ca 0.59 3.07 -0.31 0.00 -0.71 0.00 0.00 52.86 55.50 3fpv s ASN 62 Cb -0.03 -2.67 -0.09 0.00 0.41 0.00 0.00 41.25 38.87 3fpv s ASN 62 CO -0.04 -0.90 1.48 -0.89 -1.51 0.00 0.00 177.10 175.24 3fpv s THR 63 N -1.08 3.05 -0.25 1.60 2.01 -1.26 0.24 115.64 119.95 3fpv s THR 63 Ca 0.53 0.73 0.03 0.00 0.31 0.00 0.00 61.69 63.29 3fpv s THR 63 Cb -0.47 -3.47 -0.18 0.00 0.01 0.00 0.00 72.50 68.40 3fpv s THR 63 CO 0.63 0.05 -0.20 0.18 -0.69 0.00 0.00 174.62 174.59 3fpv n LEU 64 N 4.18 2.70 -3.78 4.42 4.77 0.70 -4.91 117.00 125.07 3fpv n LEU 64 Ca 0.13 -0.13 -0.15 0.00 -0.03 0.00 0.00 56.01 55.84 3fpv n LEU 64 Cb 0.41 -0.77 -0.16 0.00 -2.33 0.00 0.00 43.42 40.57 3fpv n LEU 64 CO 0.60 0.89 -0.35 -0.69 -1.33 0.00 0.00 177.39 176.51 3fpv s VAL 65 N -2.51 -0.05 -0.01 4.08 1.01 -1.09 -5.00 120.40 116.83 3fpv s VAL 65 Ca -0.32 0.19 0.08 0.00 0.00 0.00 0.00 61.98 61.92 3fpv s VAL 65 Cb 0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 36.38 36.38 3fpv s VAL 65 CO 0.61 0.08 -0.24 0.42 0.00 0.00 0.00 175.10 175.97 3fpv s THR 66 N 0.94 1.91 -0.10 3.92 -4.23 -1.26 -0.25 115.64 116.57 3fpv s THR 66 Ca -0.08 -1.05 0.00 0.00 -1.18 0.00 0.00 61.69 59.38 3fpv s THR 66 Cb -0.11 -1.59 0.02 0.00 1.34 0.00 0.00 72.50 72.16 3fpv s THR 66 CO -0.03 0.52 -0.09 -0.76 -0.54 0.00 0.00 174.62 173.72 3fpv s LEU 67 N -0.62 1.34 -0.37 4.79 1.43 0.12 -5.01 118.68 120.36 3fpv s LEU 67 Ca 0.09 -0.30 -0.17 0.00 -1.03 0.00 0.00 54.13 52.72 3fpv s LEU 67 Cb -0.09 -0.84 0.00 0.00 0.03 0.00 0.00 46.19 45.29 3fpv s LEU 67 CO -0.01 -0.07 0.42 -0.60 0.23 0.00 0.00 176.35 176.33 3fpv s ARG 68 N 1.38 3.44 0.55 1.70 3.52 -1.26 -0.97 118.95 127.30 3fpv s ARG 68 Ca -0.01 -0.46 -0.19 0.00 -0.13 0.00 0.00 55.73 54.94 3fpv s ARG 68 Cb -0.14 -3.86 -0.05 0.00 -1.56 0.00 0.00 34.95 29.34 3fpv s ARG 68 CO -0.05 -0.66 1.15 0.20 -0.81 0.00 0.00 175.30 175.13 3fpv s GLY 69 N 1.77 2.66 0.05 8.12 0.00 -0.54 -4.94 107.32 114.45 3fpv s GLY 69 Ca 0.14 0.87 -0.30 0.00 0.00 0.00 0.00 44.72 45.42 3fpv s GLY 69 CO 0.13 1.24 1.95 0.99 0.00 0.00 0.00 173.10 177.41 3fpv s ASP 70 N -1.72 6.44 0.00 1.64 1.01 -1.26 -1.94 116.67 120.84 3fpv s ASP 70 Ca 0.73 2.69 0.00 0.00 0.71 0.00 0.00 52.55 56.68 3fpv s ASP 70 Cb -0.25 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.14 3fpv s ASP 70 CO 0.28 -1.05 0.00 0.61 0.21 0.00 0.00 175.17 175.22 3fpv n GLY 71 N 4.51 0.49 3.77 0.21 0.00 -1.26 -4.78 105.19 108.13 3fpv n GLY 71 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.13 3.30 0.52 4.61 0.00 -0.82 -4.85 121.76 122.39 3fpv s ALA 72 Ca 0.00 1.30 -0.22 0.00 0.00 0.00 0.00 51.96 53.03 3fpv s ALA 72 Cb 0.00 -3.51 -0.06 0.00 0.00 0.00 0.00 23.12 19.55 3fpv s ALA 72 CO 0.00 -0.89 1.33 0.41 0.00 0.00 0.00 175.76 176.61 3fpv n GLY 73 N 0.65 0.69 0.25 0.00 0.00 -1.26 -4.89 105.19 100.63 3fpv n GLY 73 Ca 0.03 0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.22 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 1.55 0.00 0.00 1.61 0.13 -2.00 -1.75 132.00 131.54 3fpv h PRO 74 Ca -0.50 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 3fpv h PRO 74 Cb 1.30 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.43 3fpv h PRO 74 CO 0.57 0.15 -0.06 -0.56 -0.23 0.00 0.00 178.00 177.87 3fpv h GLN 75 N 0.00 0.00 0.00 0.86 -0.00 -2.01 -3.34 115.11 110.61 3fpv h GLN 75 Ca -0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 58.65 58.53 3fpv h GLN 75 Cb 0.41 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.87 3fpv h GLN 75 CO 0.02 0.06 -0.55 0.66 -0.00 0.00 0.00 178.83 179.03 3fpv h SER 76 N 0.00 0.00 0.79 0.06 4.64 -1.64 -2.89 113.55 114.52 3fpv h SER 76 Ca -0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 3fpv h SER 76 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 3fpv h SER 76 CO 0.01 0.55 -0.43 0.22 -0.87 0.00 0.00 176.83 176.30 3fpv h TYR 77 N 0.00 -1.14 -0.31 4.77 5.03 -1.75 0.15 116.97 123.72 3fpv h TYR 77 Ca -0.01 -0.02 -0.10 0.00 2.58 0.00 0.00 58.73 61.19 3fpv h TYR 77 Cb 1.21 0.39 -0.01 0.00 1.55 0.00 0.00 36.73 39.87 3fpv h TYR 77 CO 0.00 -0.67 -0.23 0.93 -1.32 0.00 0.00 178.16 176.87 3fpv h GLU 78 N -1.14 0.59 -0.23 1.82 5.08 -1.84 -2.60 114.58 116.26 3fpv h GLU 78 Ca -0.11 -0.22 0.04 0.00 -1.00 0.00 0.00 59.36 58.07 3fpv h GLU 78 Cb 0.89 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.07 3fpv h GLU 78 CO 0.14 0.77 0.01 1.03 -1.00 0.00 0.00 179.01 179.96 3fpv h SER 79 N 0.52 -0.08 -0.92 1.42 0.87 -1.28 -1.08 113.55 113.00 3fpv h SER 79 Ca 0.08 0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.70 3fpv h SER 79 Cb 0.68 0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.68 3fpv h SER 79 CO 0.05 -0.01 0.61 0.00 -0.53 0.00 0.00 176.83 176.95 3fpv h ALA 80 N 1.19 1.35 -0.45 6.23 0.00 -0.60 -1.91 119.26 125.07 3fpv h ALA 80 Ca 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3fpv h ALA 80 Cb 0.13 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3fpv h ALA 80 CO -0.18 0.60 0.29 0.93 0.00 0.00 0.00 179.25 180.89 3fpv h GLU 81 N 1.24 0.61 -0.00 0.00 5.08 -0.99 -1.85 114.58 118.66 3fpv h GLU 81 Ca 0.34 -0.05 -0.18 0.00 -1.00 0.00 0.00 59.36 58.47 3fpv h GLU 81 Cb -0.13 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 28.97 3fpv h GLU 81 CO -0.08 0.43 -0.82 0.00 -1.00 0.00 0.00 179.01 177.55 3fpv h ARG 82 N 0.61 0.13 -0.42 2.33 3.08 -0.94 -1.53 114.38 117.63 3fpv h ARG 82 Ca 0.16 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 3fpv h ARG 82 Cb -0.03 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 3fpv h ARG 82 CO -0.03 0.87 0.02 0.87 -1.07 0.00 0.00 179.97 180.63 3fpv h LYS 83 N 0.08 0.72 -0.49 0.04 1.57 -1.26 0.16 116.57 117.39 3fpv h LYS 83 Ca -0.03 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 3fpv h LYS 83 Cb 1.42 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.64 3fpv h LYS 83 CO 0.12 0.79 0.32 0.00 -0.57 0.00 0.00 179.45 180.11 3fpv h ALA 84 N 0.91 0.62 -0.23 3.86 0.00 -1.22 -1.03 119.26 122.17 3fpv h ALA 84 Ca 0.12 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3fpv h ALA 84 Cb 0.45 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3fpv h ALA 84 CO 0.02 0.07 0.13 0.35 0.00 0.00 0.00 179.25 179.83 3fpv h PHE 85 N 0.66 0.25 -0.42 0.00 3.04 -1.08 -2.68 116.94 116.72 3fpv h PHE 85 Ca 0.18 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.10 3fpv h PHE 85 Cb -0.07 -0.08 -0.02 0.00 2.56 0.00 0.00 35.95 38.34 3fpv h PHE 85 CO -0.04 0.15 0.11 1.15 -2.02 0.00 0.00 178.31 177.66 3fpv h THR 86 N 0.28 1.23 -0.12 4.41 2.02 -0.48 -2.33 112.91 117.91 3fpv h THR 86 Ca 0.09 -0.77 0.01 0.00 0.77 0.00 0.00 66.41 66.50 3fpv h THR 86 Cb -0.01 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 3fpv h THR 86 CO -0.04 0.27 0.05 0.00 0.37 0.00 0.00 175.52 176.18 3fpv h ALA 87 N 0.96 0.14 0.00 6.16 0.00 -1.15 -2.62 119.26 122.75 3fpv h ALA 87 Ca 0.13 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3fpv h ALA 87 Cb 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3fpv h ALA 87 CO -0.00 -0.39 0.00 -0.24 0.00 0.00 0.00 179.25 178.62 3fpv h VAL 88 N 0.12 0.00 -0.00 0.00 3.04 -1.41 0.08 116.25 118.08 3fpv h VAL 88 Ca 0.05 -0.48 -0.14 0.00 -1.01 0.00 0.00 66.70 65.12 3fpv h VAL 88 Cb 0.01 1.39 -0.02 0.00 -2.01 0.00 0.00 31.29 30.67 3fpv h VAL 88 CO -0.04 0.00 -0.67 0.28 -1.01 0.00 0.00 177.57 176.13 3fpv h SER 89 N 0.00 0.01 0.00 3.17 0.02 -1.03 -3.32 113.55 112.41 3fpv h SER 89 Ca 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 3fpv h SER 89 Cb 0.60 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.14 3fpv h SER 89 CO 0.00 0.68 0.00 0.79 -1.14 0.00 0.00 176.83 177.16 3fpv n TRP 90 N -3.75 0.00 -3.79 3.45 8.01 -1.12 -5.03 117.44 115.22 3fpv n TRP 90 Ca -0.01 -0.24 -0.25 0.00 -1.31 0.00 0.00 57.50 55.68 3fpv n TRP 90 Cb 0.66 -0.02 0.01 0.00 -2.01 0.00 0.00 31.31 29.95 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 -0.24 -2.02 -3.56 -0.99 5.15 -0.02 -4.99 115.26 108.60 3fpv n ASN 91 Ca 0.00 -0.95 -0.17 0.00 -0.60 0.00 0.00 54.58 52.86 3fpv n ASN 91 Cb 0.28 -3.49 -0.06 0.00 -0.53 0.00 0.00 39.78 35.98 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 -3.73 -1.64 0.37 5.20 0.00 -1.02 -4.96 121.76 115.98 3fpv s ALA 92 Ca 0.14 1.25 -0.27 0.00 0.00 0.00 0.00 51.96 53.08 3fpv s ALA 92 Cb -0.05 -0.08 -0.12 0.00 0.00 0.00 0.00 23.12 22.88 3fpv s ALA 92 CO 0.85 -0.35 1.19 -2.30 0.00 0.00 0.00 175.76 175.16 3fpv n PRO 93 N 1.09 1.83 0.10 0.00 -0.02 -1.26 -4.40 135.00 132.34 3fpv n PRO 93 Ca -0.19 0.64 -0.01 0.00 -2.02 0.00 0.00 63.50 61.93 3fpv n PRO 93 Cb 0.57 -2.22 0.28 0.00 -0.02 0.00 0.00 33.50 32.11 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 2.17 1.27 -0.87 3.45 1.35 -1.26 0.03 112.91 119.05 3fpv h THR 94 Ca -0.45 -1.27 0.09 0.00 -0.55 0.00 0.00 66.41 64.22 3fpv h THR 94 Cb 1.30 1.52 -0.06 0.00 -1.73 0.00 0.00 68.15 69.18 3fpv h THR 94 CO 0.61 0.38 0.56 0.77 -0.25 0.00 0.00 175.52 177.59 3fpv h SER 95 N 0.21 0.80 -0.29 5.36 4.64 -1.80 0.32 113.55 122.79 3fpv h SER 95 Ca 0.03 0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 61.21 3fpv h SER 95 Cb 0.66 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3fpv h SER 95 CO 0.05 0.49 -0.42 -0.08 -0.87 0.00 0.00 176.83 175.99 3fpv h GLU 96 N 0.89 0.79 -0.18 4.77 4.81 -1.58 -3.30 114.58 120.78 3fpv h GLU 96 Ca 0.39 -0.47 -0.11 0.00 -0.13 0.00 0.00 59.36 59.04 3fpv h GLU 96 Cb 0.35 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 3fpv h GLU 96 CO -0.16 1.10 -0.36 -0.07 -0.73 0.00 0.00 179.01 178.79 3fpv h LEU 97 N 0.55 0.41 -1.90 1.64 3.38 -0.18 -2.79 115.31 116.42 3fpv h LEU 97 Ca 0.03 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 3fpv h LEU 97 Cb 1.02 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 3fpv h LEU 97 CO 0.10 0.74 -0.09 0.00 0.09 0.00 0.00 178.44 179.28 3fpv h ALA 98 N 1.28 1.75 0.00 1.53 0.00 -0.47 -1.69 119.26 121.66 3fpv h ALA 98 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3fpv h ALA 98 Cb 0.79 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3fpv h ALA 98 CO 0.06 0.11 0.00 0.87 0.00 0.00 0.00 179.25 180.29 3fpv h LYS 99 N 0.00 0.00 0.00 0.00 1.57 -1.59 -2.70 116.57 113.85 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 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 3fpv h LYS 99 CO 0.01 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.43 3fpv n ARG 100 N -2.62 0.21 0.22 3.15 1.74 -0.64 -3.57 116.66 115.16 3fpv n ARG 100 Ca 0.01 0.30 0.14 0.00 -0.77 0.00 0.00 57.85 57.53 3fpv n ARG 100 Cb 0.26 -1.82 0.42 0.00 -1.02 0.00 0.00 32.46 30.30 3fpv n ARG 100 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3fpv h LEU 101 N 0.00 0.00 -0.05 0.55 3.38 -1.63 -1.62 115.31 115.94 3fpv h LEU 101 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3fpv h LEU 101 Cb 0.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 3fpv h LEU 101 CO 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 178.44 178.50 3fpv h ALA 102 N 2.09 0.01 0.17 1.53 0.00 -1.79 -2.34 119.26 118.94 3fpv h ALA 102 Ca 0.00 0.02 -0.33 0.00 0.00 0.00 0.00 54.91 54.60 3fpv h ALA 102 Cb 0.73 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.60 3fpv h ALA 102 CO 0.00 -0.51 -1.57 1.96 0.00 0.00 0.00 179.25 179.13 3fpv h GLN 103 N -0.03 0.37 -2.63 0.00 1.08 -1.79 -3.41 115.11 108.70 3fpv h GLN 103 Ca 0.03 -0.63 -0.60 0.00 -1.45 0.00 0.00 58.65 56.00 3fpv h GLN 103 Cb 0.08 0.23 -0.41 0.00 -0.05 0.00 0.00 27.48 27.33 3fpv h GLN 103 CO -0.07 1.27 -0.70 0.00 -0.95 0.00 0.00 178.83 178.38 3fpv n ALA 104 N -2.73 3.40 0.31 3.87 0.00 -0.62 -4.97 120.51 119.76 3fpv n ALA 104 Ca -0.19 -4.23 0.16 0.00 0.00 0.00 0.00 53.44 49.18 3fpv n ALA 104 Cb 1.07 -0.93 0.70 0.00 0.00 0.00 0.00 19.45 20.29 3fpv n ALA 104 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3fpv h PRO 105 N 4.99 0.00 -0.09 0.00 0.13 -1.66 -2.68 132.00 132.69 3fpv h PRO 105 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 3fpv h PRO 105 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3fpv h PRO 105 CO 0.66 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.68 3fpv n THR 106 N -2.82 0.10 -0.06 1.56 -2.24 -1.26 -3.78 114.28 105.78 3fpv n THR 106 Ca 0.00 -0.36 0.16 0.00 -2.27 0.00 0.00 64.05 61.59 3fpv n THR 106 Cb 0.24 0.67 0.59 0.00 -2.10 0.00 0.00 70.33 69.73 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 2.89 0.21 0.00 3.22 3.38 -1.86 -0.99 115.31 122.16 3fpv h LEU 107 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3fpv h LEU 107 Cb 0.62 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.34 3fpv h LEU 107 CO 0.00 0.12 0.00 2.29 0.09 0.00 0.00 178.44 180.94 3fpv n LYS 108 N -4.44 0.48 0.00 1.13 2.85 -1.25 -2.44 118.16 114.50 3fpv n LYS 108 Ca 0.11 0.03 0.13 0.00 -1.05 0.00 0.00 58.31 57.53 3fpv n LYS 108 Cb 0.51 -1.50 0.40 0.00 -0.65 0.00 0.00 35.03 33.78 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 -1.22 1.39 -4.66 -5.58 8.00 -0.37 -4.84 116.55 109.26 3fpv n ASP 109 Ca 0.14 -1.23 -0.42 0.00 0.71 0.00 0.00 54.79 53.98 3fpv n ASP 109 Cb 0.18 0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.35 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 -2.27 3.68 0.28 0.53 1.01 -1.02 -4.95 121.20 118.46 3fpv s ILE 110 Ca 0.30 0.87 -0.30 0.00 0.00 0.00 0.00 60.65 61.52 3fpv s ILE 110 Cb 0.20 -3.56 -0.13 0.00 0.01 0.00 0.00 42.46 38.98 3fpv s ILE 110 CO 0.44 -0.07 1.32 -2.65 0.00 0.00 0.00 174.94 173.98 3fpv n PRO 111 N 6.79 1.99 -0.04 2.79 -0.02 -1.26 -2.88 135.00 142.37 3fpv n PRO 111 Ca 0.16 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 3fpv n PRO 111 Cb 0.43 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 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 1.50 0.50 3.93 -1.23 0.00 -1.26 -5.04 105.19 103.59 3fpv n GLY 112 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.20 5.28 -0.20 2.61 -4.23 -1.14 -4.66 115.64 111.10 3fpv s THR 113 Ca 0.00 -0.51 -0.05 0.00 -1.18 0.00 0.00 61.69 59.95 3fpv s THR 113 Cb 0.00 -3.72 0.07 0.00 1.34 0.00 0.00 72.50 70.19 3fpv s THR 113 CO 0.00 -0.09 0.10 -0.22 -0.54 0.00 0.00 174.62 173.87 3fpv s LEU 114 N -3.16 0.45 -1.31 4.79 2.96 -1.25 -4.98 118.68 116.18 3fpv s LEU 114 Ca 0.36 -0.80 -0.11 0.00 -0.22 0.00 0.00 54.13 53.36 3fpv s LEU 114 Cb -0.11 -0.29 0.14 0.00 0.50 0.00 0.00 46.19 46.42 3fpv s LEU 114 CO 0.28 -0.37 1.90 0.49 -1.32 0.00 0.00 176.35 177.33 3fpv n PHE 115 N 5.26 3.39 -3.70 5.38 3.01 -1.26 -4.57 117.46 124.96 3fpv n PHE 115 Ca -0.07 -2.90 -0.11 0.00 1.01 0.00 0.00 57.45 55.38 3fpv n PHE 115 Cb 0.47 -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 0.77 0.04 0.39 4.37 2.96 -1.26 -4.58 118.68 121.38 3fpv s LEU 116 Ca 0.42 0.92 -0.26 0.00 -0.22 0.00 0.00 54.13 54.99 3fpv s LEU 116 Cb 0.09 1.47 -0.11 0.00 0.50 0.00 0.00 46.19 48.14 3fpv s LEU 116 CO -0.01 -0.18 1.27 0.00 -1.32 0.00 0.00 176.35 176.11 3fpv n ALA 117 N 3.65 1.28 0.00 5.97 0.00 -1.26 -4.27 120.51 125.88 3fpv n ALA 117 Ca -0.19 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.55 3fpv n ALA 117 Cb 0.56 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.75 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 0.80 0.66 3.55 0.00 0.00 -1.15 -4.43 105.19 104.62 3fpv n GLY 118 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.29 1.70 -0.04 -0.02 0.00 -1.26 -0.93 107.32 106.48 3fpv s GLY 119 Ca 0.00 -0.87 -0.02 0.00 0.00 0.00 0.00 44.72 43.83 3fpv s GLY 119 CO 0.00 -0.50 0.09 -1.08 0.00 0.00 0.00 173.10 171.61 3fpv s THR 120 N -0.48 -0.02 0.54 0.90 -1.32 -0.44 -0.79 115.64 114.02 3fpv s THR 120 Ca 0.07 0.09 -0.16 0.00 -1.21 0.00 0.00 61.69 60.48 3fpv s THR 120 Cb -0.12 -0.15 -0.07 0.00 -1.51 0.00 0.00 72.50 70.65 3fpv s THR 120 CO 0.02 0.04 1.01 -2.16 -2.21 0.00 0.00 174.62 171.32 3fpv s PRO 121 N 0.54 3.75 -0.07 7.08 0.04 -1.26 -1.14 135.00 143.94 3fpv s PRO 121 Ca -0.04 1.04 0.06 0.00 0.04 0.00 0.00 61.00 62.10 3fpv s PRO 121 Cb -0.06 -2.10 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 3fpv s PRO 121 CO -0.02 -0.44 -0.25 0.08 0.04 0.00 0.00 177.00 176.41 3fpv s VAL 122 N -2.55 2.04 0.20 -0.36 1.01 0.15 -4.88 120.40 116.01 3fpv s VAL 122 Ca 0.61 -1.05 0.09 0.00 0.00 0.00 0.00 61.98 61.62 3fpv s VAL 122 Cb -0.12 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 3fpv s VAL 122 CO 0.33 0.56 -0.06 0.42 0.00 0.00 0.00 175.10 176.35 3fpv s THR 123 N -0.06 3.33 -0.07 3.92 -4.23 -1.26 -0.39 115.64 116.88 3fpv s THR 123 Ca -0.07 -1.69 0.01 0.00 -1.18 0.00 0.00 61.69 58.77 3fpv s THR 123 Cb -0.15 -2.69 0.02 0.00 1.34 0.00 0.00 72.50 71.03 3fpv s THR 123 CO 0.05 -0.18 -0.09 0.00 -0.54 0.00 0.00 174.62 173.87 3fpv s ALA 124 N -1.87 1.07 -1.67 3.99 0.00 0.85 -4.75 121.76 119.39 3fpv s ALA 124 Ca 0.27 -0.32 -0.14 0.00 0.00 0.00 0.00 51.96 51.77 3fpv s ALA 124 Cb -0.08 -0.60 0.13 0.00 0.00 0.00 0.00 23.12 22.57 3fpv s ALA 124 CO 0.17 -0.05 0.62 1.63 0.00 0.00 0.00 175.76 178.13 3fpv n LYS 125 N 4.15 -2.58 0.00 0.00 5.02 -1.26 -2.47 118.16 121.02 3fpv n LYS 125 Ca -0.21 0.31 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 3fpv n LYS 125 Cb 0.51 -4.79 0.00 0.00 -0.02 0.00 0.00 35.03 30.73 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 -1.56 3.17 3.83 0.72 0.00 -1.26 -4.99 105.19 105.10 3fpv n GLY 126 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.67 3.64 0.17 4.61 0.00 -1.03 -4.94 121.76 122.54 3fpv s ALA 127 Ca 0.00 -0.14 -0.30 0.00 0.00 0.00 0.00 51.96 51.52 3fpv s ALA 127 Cb 0.00 -2.47 -0.08 0.00 0.00 0.00 0.00 23.12 20.57 3fpv s ALA 127 CO 0.00 0.46 1.18 -1.25 0.00 0.00 0.00 175.76 176.16 3fpv s PRO 128 N -1.38 4.50 0.00 0.00 0.04 -1.26 -0.10 135.00 136.79 3fpv s PRO 128 Ca 0.29 1.84 0.00 0.00 0.04 0.00 0.00 61.00 63.17 3fpv s PRO 128 Cb -0.17 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.11 3fpv s PRO 128 CO 0.17 -0.09 0.00 1.33 0.04 0.00 0.00 177.00 178.45 3fpv n VAL 129 N 2.67 0.00 -3.69 -0.36 0.24 0.47 -4.78 118.33 112.89 3fpv n VAL 129 Ca 0.05 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.24 3fpv n VAL 129 Cb 0.45 -0.10 -0.05 0.00 -1.47 0.00 0.00 33.84 32.67 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 -1.96 -0.79 0.03 2.33 0.00 -1.04 -1.61 121.76 118.72 3fpv s ALA 130 Ca 0.00 -0.11 0.08 0.00 0.00 0.00 0.00 51.96 51.93 3fpv s ALA 130 Cb 0.00 0.59 -0.03 0.00 0.00 0.00 0.00 23.12 23.68 3fpv s ALA 130 CO 0.00 -0.58 -0.23 0.20 0.00 0.00 0.00 175.76 175.15 3fpv s GLY 131 N -2.67 1.44 -0.24 0.00 0.00 0.69 0.31 107.32 106.86 3fpv s GLY 131 Ca 0.02 -1.21 -0.07 0.00 0.00 0.00 0.00 44.72 43.46 3fpv s GLY 131 CO -0.10 -1.08 0.05 -0.42 0.00 0.00 0.00 173.10 171.55 3fpv s ILE 132 N -0.81 4.16 -0.13 0.90 1.01 -0.29 -1.17 121.20 124.88 3fpv s ILE 132 Ca 0.12 -0.23 -0.02 0.00 0.00 0.00 0.00 60.65 60.53 3fpv s ILE 132 Cb -0.10 -2.93 -0.02 0.00 0.01 0.00 0.00 42.46 39.41 3fpv s ILE 132 CO 0.02 0.37 -0.07 -0.83 0.00 0.00 0.00 174.94 174.43 3fpv s GLY 133 N 1.47 1.67 -0.06 6.18 0.00 0.76 -1.33 107.32 116.01 3fpv s GLY 133 Ca 0.06 -0.85 0.03 0.00 0.00 0.00 0.00 44.72 43.96 3fpv s GLY 133 CO 0.02 -0.24 -0.15 0.14 0.00 0.00 0.00 173.10 172.88 3fpv s VAL 134 N 0.08 1.28 -0.01 1.40 1.01 -0.10 -0.72 120.40 123.34 3fpv s VAL 134 Ca -0.02 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.39 3fpv s VAL 134 Cb -0.14 -1.13 -0.00 0.00 0.00 0.00 0.00 36.38 35.11 3fpv s VAL 134 CO 0.03 0.38 -0.08 0.00 0.00 0.00 0.00 175.10 175.43 3fpv s ALA 135 N 0.37 0.68 0.00 5.51 0.00 -0.67 -4.59 121.76 123.06 3fpv s ALA 135 Ca -0.10 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 51.52 3fpv s ALA 135 Cb -0.14 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.80 3fpv s ALA 135 CO 0.03 0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.36 3fpv n GLY 136 N 2.93 0.34 3.90 0.00 0.00 -1.26 -0.93 105.19 110.18 3fpv n GLY 136 Ca -0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.16 2.57 0.41 4.61 0.00 -1.26 -4.67 121.76 122.27 3fpv s ALA 137 Ca 0.00 -0.74 0.19 0.00 0.00 0.00 0.00 51.96 51.41 3fpv s ALA 137 Cb 0.00 -2.93 1.11 0.00 0.00 0.00 0.00 23.12 21.30 3fpv s ALA 137 CO 0.00 -1.81 1.81 -1.35 0.00 0.00 0.00 175.76 174.41 3fpv h PRO 138 N -1.16 0.37 -4.27 0.00 0.11 -1.97 -3.42 132.00 121.66 3fpv h PRO 138 Ca -0.46 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.50 3fpv h PRO 138 Cb 1.31 -0.08 -0.15 0.00 0.11 0.00 0.00 31.00 32.19 3fpv h PRO 138 CO 0.61 0.25 -0.68 -1.54 -0.21 0.00 0.00 178.00 176.43 3fpv s SER 139 N -5.42 0.55 0.40 -2.05 1.04 -1.26 -5.04 113.70 101.93 3fpv s SER 139 Ca -0.08 -0.98 0.12 0.00 0.48 0.00 0.00 55.95 55.49 3fpv s SER 139 Cb 0.24 0.18 0.84 0.00 0.10 0.00 0.00 66.02 67.39 3fpv s SER 139 CO 0.79 -0.57 1.92 1.23 0.98 0.00 0.00 173.24 177.59 3fpv h GLY 140 N 3.20 0.12 1.76 7.32 0.00 -1.81 -1.47 103.07 112.19 3fpv h GLY 140 Ca -0.34 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 46.89 3fpv h GLY 140 CO 0.65 0.07 0.06 -0.55 0.00 0.00 0.00 176.54 176.77 3fpv h ASP 141 N 0.11 0.28 0.23 0.19 3.32 -1.97 -0.43 116.42 118.16 3fpv h ASP 141 Ca 0.02 -0.03 -0.32 0.00 0.02 0.00 0.00 57.03 56.72 3fpv h ASP 141 Cb 0.41 -0.07 0.03 0.00 0.22 0.00 0.00 39.33 39.92 3fpv h ASP 141 CO 0.03 0.29 -1.45 -0.07 -1.72 0.00 0.00 179.24 176.32 3fpv h LEU 142 N 0.32 0.75 -0.91 1.55 3.38 -1.80 -2.67 115.31 115.92 3fpv h LEU 142 Ca 0.08 -0.93 0.18 0.00 0.09 0.00 0.00 57.88 57.30 3fpv h LEU 142 Cb 0.12 -0.24 -0.17 0.00 0.09 0.00 0.00 40.66 40.46 3fpv h LEU 142 CO -0.00 1.69 -0.24 0.44 0.09 0.00 0.00 178.44 180.42 3fpv h ASP 143 N 0.06 -0.87 0.63 -0.43 3.32 -1.06 -2.04 116.42 116.03 3fpv h ASP 143 Ca -0.26 0.27 -0.15 0.00 0.02 0.00 0.00 57.03 56.91 3fpv h ASP 143 Cb 2.08 0.57 -0.02 0.00 0.22 0.00 0.00 39.33 42.19 3fpv h ASP 143 CO 0.24 -0.30 -0.71 -0.08 -1.72 0.00 0.00 179.24 176.66 3fpv h GLU 144 N -0.00 0.07 -0.67 3.56 4.81 -1.04 -0.31 114.58 120.99 3fpv h GLU 144 Ca 0.43 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.61 3fpv h GLU 144 Cb 0.66 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.02 3fpv h GLU 144 CO -0.94 0.75 0.44 0.37 -0.73 0.00 0.00 179.01 178.90 3fpv h GLN 145 N 0.04 0.88 -0.17 1.92 4.15 -1.09 0.16 115.11 121.00 3fpv h GLN 145 Ca -0.01 -0.05 -0.13 0.00 0.77 0.00 0.00 58.65 59.23 3fpv h GLN 145 Cb 1.26 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.74 3fpv h GLN 145 CO 0.10 0.58 -0.44 1.88 -1.93 0.00 0.00 178.83 179.02 3fpv h TYR 146 N 0.90 0.50 -0.37 3.99 0.05 -0.92 -1.79 116.97 119.33 3fpv h TYR 146 Ca 0.25 -0.15 -0.01 0.00 0.05 0.00 0.00 58.73 58.87 3fpv h TYR 146 Cb -0.09 -0.10 -0.02 0.00 1.01 0.00 0.00 36.73 37.52 3fpv h TYR 146 CO -0.03 0.79 0.19 0.00 -1.05 0.00 0.00 178.16 178.06 3fpv h ALA 147 N 1.19 0.48 -0.97 3.88 0.00 -0.67 -0.73 119.26 122.44 3fpv h ALA 147 Ca 0.02 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.86 3fpv h ALA 147 Cb 0.91 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 3fpv h ALA 147 CO 0.08 0.02 0.64 0.00 0.00 0.00 0.00 179.25 179.99 3fpv h ARG 148 N 0.47 1.27 0.00 0.00 3.08 -0.53 -0.64 114.38 118.03 3fpv h ARG 148 Ca 0.13 -0.08 -0.07 0.00 0.07 0.00 0.00 59.98 60.03 3fpv h ARG 148 Cb 0.08 -0.29 -0.01 0.00 0.08 0.00 0.00 29.97 29.84 3fpv h ARG 148 CO -0.02 0.84 -0.35 0.00 -1.07 0.00 0.00 179.97 179.37 3fpv h ALA 149 N 1.40 1.30 -0.33 0.04 0.00 -1.07 -0.41 119.26 120.20 3fpv h ALA 149 Ca 0.36 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3fpv h ALA 149 Cb -0.14 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3fpv h ALA 149 CO -0.08 0.44 0.08 0.78 0.00 0.00 0.00 179.25 180.47 3fpv h GLY 150 N 1.24 0.57 2.00 0.00 0.00 -0.24 -3.15 103.07 103.49 3fpv h GLY 150 Ca -0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 46.94 3fpv h GLY 150 CO 0.05 0.33 -0.14 0.00 0.00 0.00 0.00 176.54 176.77 3fpv h ALA 151 N 0.92 1.09 0.00 3.60 0.00 -0.48 -3.27 119.26 121.12 3fpv h ALA 151 Ca 0.10 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 3fpv h ALA 151 Cb 0.29 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3fpv h ALA 151 CO 0.00 0.18 -0.27 0.00 0.00 0.00 0.00 179.25 179.16 3fpv h ALA 152 N 1.86 0.86 -0.00 0.00 0.00 -1.05 -2.42 119.26 118.51 3fpv h ALA 152 Ca -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3fpv h ALA 152 Cb 0.54 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3fpv h ALA 152 CO 0.02 0.34 -0.07 1.33 0.00 0.00 0.00 179.25 180.87 3fpv n VAL 153 N -3.22 0.00 -2.85 0.00 0.24 -1.23 -4.71 118.33 106.56 3fpv n VAL 153 Ca 0.02 -0.02 -0.25 0.00 -2.04 0.00 0.00 64.34 62.05 3fpv n VAL 153 Cb 0.58 -0.31 0.01 0.00 -1.47 0.00 0.00 33.84 32.65 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 -2.63 3.63 0.00 1.34 1.43 -0.91 -4.47 118.68 117.08 3fpv s LEU 154 Ca 0.25 0.59 0.00 0.00 -1.03 0.00 0.00 54.13 53.94 3fpv s LEU 154 Cb 0.20 -3.47 0.00 0.00 0.03 0.00 0.00 46.19 42.94 3fpv s LEU 154 CO 0.49 -0.66 0.29 0.61 0.23 0.00 0.00 176.35 177.32 3fpv n GLY 155 N -2.17 -2.54 0.43 -3.19 0.00 -1.26 -5.03 105.19 91.44 3fpv n GLY 155 Ca 0.01 0.18 0.05 0.00 0.00 0.00 0.00 46.02 46.26 3fpv n GLY 155 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74