#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 3.37 0.37 2.33 0.00 -1.26 -5.08 121.76 121.49 3fpv s ALA 17 Ca 0.00 -1.27 -0.25 0.00 0.00 0.00 0.00 51.96 50.44 3fpv s ALA 17 Cb 0.00 -2.42 -0.10 0.00 0.00 0.00 0.00 23.12 20.60 3fpv s ALA 17 CO 0.00 -0.77 0.99 0.00 0.00 0.00 0.00 175.76 175.98 3fpv s ALA 18 N 1.67 3.14 0.38 0.00 0.00 -1.26 -5.08 121.76 120.61 3fpv s ALA 18 Ca 0.06 0.59 -0.06 0.00 0.00 0.00 0.00 51.96 52.54 3fpv s ALA 18 Cb -0.17 -3.22 0.03 0.00 0.00 0.00 0.00 23.12 19.76 3fpv s ALA 18 CO 0.08 0.00 0.61 -0.98 0.00 0.00 0.00 175.76 175.47 3fpv s ARG 19 N -2.36 2.10 0.08 0.00 1.70 -1.26 -5.02 118.95 114.19 3fpv s ARG 19 Ca 0.55 -1.70 0.27 0.00 -0.47 0.00 0.00 55.73 54.38 3fpv s ARG 19 Cb -0.19 0.52 0.97 0.00 -0.57 0.00 0.00 34.95 35.68 3fpv s ARG 19 CO 0.24 -0.92 1.79 0.41 -1.08 0.00 0.00 175.30 175.75 3fpv n GLY 20 N -0.58 -1.55 0.18 3.88 0.00 -1.26 -3.09 105.19 102.78 3fpv n GLY 20 Ca -0.03 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.01 3fpv n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fpv n GLY 21 N 1.42 -0.73 0.51 -0.02 0.00 -1.26 -2.74 105.19 102.37 3fpv n GLY 21 Ca 0.06 -0.48 0.11 0.00 0.00 0.00 0.00 46.02 45.72 3fpv n GLY 21 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3fpv n GLU 22 N -0.92 1.68 -5.01 1.61 1.02 -1.18 -4.94 120.64 112.90 3fpv n GLU 22 Ca 0.08 -1.01 -0.32 0.00 -0.02 0.00 0.00 57.16 55.90 3fpv n GLU 22 Cb 0.37 -1.41 -0.14 0.00 -0.02 0.00 0.00 31.44 30.23 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 -1.69 2.42 0.08 -4.62 1.43 -1.11 -5.00 118.68 110.19 3fpv s LEU 23 Ca 0.34 -0.37 0.02 0.00 -1.03 0.00 0.00 54.13 53.09 3fpv s LEU 23 Cb 0.18 -1.45 -0.03 0.00 0.03 0.00 0.00 46.19 44.92 3fpv s LEU 23 CO 0.28 0.31 -0.07 0.28 0.23 0.00 0.00 176.35 177.38 3fpv s THR 24 N -0.73 0.64 0.13 5.49 -1.32 -1.26 -5.01 115.64 113.58 3fpv s THR 24 Ca 0.12 -1.59 0.05 0.00 -1.21 0.00 0.00 61.69 59.06 3fpv s THR 24 Cb -0.10 -1.25 -0.04 0.00 -1.51 0.00 0.00 72.50 69.60 3fpv s THR 24 CO 0.01 -0.67 0.06 -1.10 -2.21 0.00 0.00 174.62 170.70 3fpv s GLN 25 N -2.92 2.69 0.07 7.08 -1.52 -1.26 -5.13 119.66 118.67 3fpv s GLN 25 Ca 0.03 -0.87 0.02 0.00 -1.95 0.00 0.00 55.36 52.59 3fpv s GLN 25 Cb -0.01 -2.57 -0.03 0.00 -0.22 0.00 0.00 33.01 30.18 3fpv s GLN 25 CO -0.03 0.51 -0.07 -1.54 -0.25 0.00 0.00 175.29 173.91 3fpv s SER 26 N -2.69 0.97 -0.11 5.90 1.04 -1.26 -5.16 113.70 112.39 3fpv s SER 26 Ca 0.28 -0.75 -0.03 0.00 0.48 0.00 0.00 55.95 55.93 3fpv s SER 26 Cb -0.11 0.07 -0.03 0.00 0.10 0.00 0.00 66.02 66.04 3fpv s SER 26 CO 0.21 -0.32 0.02 -0.89 0.98 0.00 0.00 173.24 173.23 3fpv s THR 27 N -2.39 4.42 0.07 2.02 2.01 -1.26 -5.11 115.64 115.40 3fpv s THR 27 Ca -0.00 -0.19 0.03 0.00 0.31 0.00 0.00 61.69 61.84 3fpv s THR 27 Cb -0.03 -2.90 -0.03 0.00 0.01 0.00 0.00 72.50 69.55 3fpv s THR 27 CO -0.02 0.57 -0.10 -1.00 -0.69 0.00 0.00 174.62 173.38 3fpv s HIS 28 N -0.51 0.94 0.26 4.92 3.76 -1.26 -4.76 115.29 118.64 3fpv s HIS 28 Ca 0.09 -0.56 -0.30 0.00 -0.15 0.00 0.00 55.06 54.14 3fpv s HIS 28 Cb -0.12 -0.54 -0.14 0.00 1.11 0.00 0.00 32.58 32.90 3fpv s HIS 28 CO 0.02 -0.02 1.29 1.28 -0.85 0.00 0.00 174.74 176.46 3fpv n LEU 29 N 1.06 2.81 -4.75 0.89 4.77 -1.26 -5.04 117.00 115.48 3fpv n LEU 29 Ca -0.20 1.16 -0.31 0.00 -0.03 0.00 0.00 56.01 56.63 3fpv n LEU 29 Cb 0.56 -1.39 0.10 0.00 -2.33 0.00 0.00 43.42 40.36 3fpv n LEU 29 CO 0.23 -0.73 0.70 0.42 -1.33 0.00 0.00 177.39 176.69 3fpv s THR 30 N -0.46 3.02 0.30 -5.08 -4.23 -1.26 -4.87 115.64 103.06 3fpv s THR 30 Ca 0.64 0.34 0.00 0.00 -1.18 0.00 0.00 61.69 61.50 3fpv s THR 30 Cb -0.66 -2.73 0.28 0.00 1.34 0.00 0.00 72.50 70.72 3fpv s THR 30 CO 0.54 -0.42 1.93 0.25 -0.54 0.00 0.00 174.62 176.38 3fpv h LEU 31 N -1.19 0.90 -0.66 4.79 5.85 -1.98 0.22 115.31 123.24 3fpv h LEU 31 Ca -0.44 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.29 3fpv h LEU 31 Cb 1.24 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 3fpv h LEU 31 CO 0.49 0.60 0.43 -0.08 -0.34 0.00 0.00 178.44 179.54 3fpv h GLU 32 N 1.03 0.84 -0.44 1.25 4.57 -1.99 0.32 114.58 120.17 3fpv h GLU 32 Ca 0.37 -0.05 -0.12 0.00 -1.18 0.00 0.00 59.36 58.37 3fpv h GLU 32 Cb 0.13 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.52 3fpv h GLU 32 CO -0.13 0.56 -0.21 0.00 -1.18 0.00 0.00 179.01 178.05 3fpv h ALA 33 N 1.25 0.61 -0.37 2.92 0.00 -1.83 -2.53 119.26 119.31 3fpv h ALA 33 Ca 0.25 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 3fpv h ALA 33 Cb -0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3fpv h ALA 33 CO -0.07 0.59 -0.13 0.00 0.00 0.00 0.00 179.25 179.65 3fpv h ALA 34 N 0.84 0.51 -0.71 0.00 0.00 -0.56 -1.27 119.26 118.07 3fpv h ALA 34 Ca 0.10 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 3fpv h ALA 34 Cb 0.78 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 3fpv h ALA 34 CO 0.06 0.40 0.20 1.15 0.00 0.00 0.00 179.25 181.06 3fpv h THR 35 N 0.53 1.26 -0.63 0.00 2.02 -1.02 -1.32 112.91 113.75 3fpv h THR 35 Ca 0.09 -0.92 -0.01 0.00 0.77 0.00 0.00 66.41 66.34 3fpv h THR 35 Cb 0.65 0.50 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 3fpv h THR 35 CO 0.04 0.36 0.34 0.50 0.37 0.00 0.00 175.52 177.13 3fpv h LYS 36 N 1.06 0.88 -0.05 6.66 3.64 -1.11 0.73 116.57 128.38 3fpv h LYS 36 Ca 0.23 -0.11 -0.18 0.00 -1.27 0.00 0.00 60.65 59.32 3fpv h LYS 36 Cb 0.33 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 3fpv h LYS 36 CO -0.00 0.67 -0.76 0.00 -2.27 0.00 0.00 179.45 177.09 3fpv h ALA 37 N 1.16 0.61 -0.01 5.00 0.00 -1.14 -2.56 119.26 122.34 3fpv h ALA 37 Ca 0.22 -0.63 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 3fpv h ALA 37 Cb 0.05 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 3fpv h ALA 37 CO -0.04 0.80 -0.01 0.00 0.00 0.00 0.00 179.25 180.01 3fpv h ALA 38 N 0.99 0.01 -0.98 0.00 0.00 -1.02 -2.54 119.26 115.71 3fpv h ALA 38 Ca -0.03 -0.24 0.08 0.00 0.00 0.00 0.00 54.91 54.73 3fpv h ALA 38 Cb 1.33 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 19.05 3fpv h ALA 38 CO 0.12 -0.25 0.63 0.00 0.00 0.00 0.00 179.25 179.76 3fpv h ARG 39 N -0.45 1.05 -0.45 0.00 3.08 -0.91 -1.84 114.38 114.86 3fpv h ARG 39 Ca 0.00 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 59.89 3fpv h ARG 39 Cb 0.47 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 3fpv h ARG 39 CO 0.00 0.70 -0.13 0.00 -1.07 0.00 0.00 179.97 179.47 3fpv h ALA 40 N 1.50 0.93 -0.62 0.04 0.00 -1.45 -2.25 119.26 117.40 3fpv h ALA 40 Ca 0.45 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3fpv h ALA 40 Cb 0.29 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3fpv h ALA 40 CO -0.20 0.62 0.22 0.00 0.00 0.00 0.00 179.25 179.90 3fpv h ALA 41 N 1.11 1.21 0.52 0.00 0.00 -0.95 -1.36 119.26 119.79 3fpv h ALA 41 Ca 0.12 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3fpv h ALA 41 Cb 0.63 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.18 3fpv h ALA 41 CO 0.04 0.56 -0.25 0.28 0.00 0.00 0.00 179.25 179.88 3fpv h VAL 42 N 0.91 0.48 -0.00 0.00 2.07 -0.91 -2.71 116.25 116.08 3fpv h VAL 42 Ca 0.21 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.62 3fpv h VAL 42 Cb 0.22 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 3fpv h VAL 42 CO -0.01 0.02 -0.11 -1.84 0.02 0.00 0.00 177.57 175.64 3fpv n GLU 43 N -5.37 0.59 0.09 1.57 -0.00 -0.89 -0.78 120.64 115.86 3fpv n GLU 43 Ca -0.12 -0.19 -0.06 0.00 -0.00 0.00 0.00 57.16 56.79 3fpv n GLU 43 Cb 0.30 -1.50 0.02 0.00 -0.00 0.00 0.00 31.44 30.27 3fpv n GLU 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3fpv h ALA 44 N 3.53 0.63 0.07 -1.84 0.00 -1.25 -2.76 119.26 117.65 3fpv h ALA 44 Ca 0.00 -0.71 -0.25 0.00 0.00 0.00 0.00 54.91 53.95 3fpv h ALA 44 Cb 0.36 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3fpv h ALA 44 CO 0.00 0.94 -1.10 0.00 0.00 0.00 0.00 179.25 179.09 3fpv h ALA 45 N 1.10 0.24 0.00 0.00 0.00 -0.81 -3.31 119.26 116.48 3fpv h ALA 45 Ca -0.02 -0.82 -0.05 0.00 0.00 0.00 0.00 54.91 54.02 3fpv h ALA 45 Cb 1.43 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 3fpv h ALA 45 CO 0.12 0.94 -0.23 0.93 0.00 0.00 0.00 179.25 181.01 3fpv h GLU 46 N 0.11 0.00 0.00 0.00 4.39 -1.03 -1.10 114.58 116.95 3fpv h GLU 46 Ca -0.10 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 3fpv h GLU 46 Cb 1.79 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 30.44 3fpv h GLU 46 CO 0.18 0.23 -0.05 -0.22 -1.16 0.00 0.00 179.01 177.98 3fpv h LYS 47 N 0.00 0.00 -0.57 2.33 3.64 -1.57 -2.63 116.57 117.77 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 0.84 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 3fpv h LYS 47 CO 0.03 0.05 0.00 -0.25 -2.27 0.00 0.00 179.45 177.01 3fpv n ASP 48 N -4.33 3.63 -1.56 4.20 8.00 -0.66 -4.94 116.55 120.89 3fpv n ASP 48 Ca -0.03 -1.98 -0.16 0.00 0.71 0.00 0.00 54.79 53.33 3fpv n ASP 48 Cb 0.14 -0.38 -0.03 0.00 -0.02 0.00 0.00 41.12 40.83 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 1.40 0.45 3.80 0.44 0.00 -0.99 -5.01 105.19 105.29 3fpv n GLY 49 Ca 0.21 -0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 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 -4.22 2.96 -0.22 1.61 3.00 -0.51 -5.01 118.95 116.57 3fpv s ARG 50 Ca 0.00 -0.71 0.01 0.00 0.00 0.00 0.00 55.73 55.02 3fpv s ARG 50 Cb 0.00 -2.74 0.06 0.00 0.00 0.00 0.00 34.95 32.26 3fpv s ARG 50 CO 0.00 0.55 -0.06 -1.01 0.00 0.00 0.00 175.30 174.77 3fpv s HIS 51 N -1.51 2.38 0.24 -0.53 3.76 -1.26 -3.82 115.29 114.55 3fpv s HIS 51 Ca 0.30 -1.70 0.06 0.00 -0.15 0.00 0.00 55.06 53.57 3fpv s HIS 51 Cb -0.12 -1.58 -0.05 0.00 1.11 0.00 0.00 32.58 31.94 3fpv s HIS 51 CO 0.23 -0.76 -0.07 0.14 -0.85 0.00 0.00 174.74 173.43 3fpv s VAL 52 N 1.40 1.49 -0.00 -0.90 -7.23 -1.26 -4.44 120.40 109.46 3fpv s VAL 52 Ca -0.05 -2.12 -0.02 0.00 -1.81 0.00 0.00 61.98 57.99 3fpv s VAL 52 Cb -0.18 -2.28 -0.04 0.00 0.56 0.00 0.00 36.38 34.44 3fpv s VAL 52 CO -0.07 -0.41 0.14 -0.44 -0.31 0.00 0.00 175.10 174.01 3fpv s SER 53 N -3.36 6.08 -0.04 4.85 0.01 -0.21 -1.13 113.70 119.90 3fpv s SER 53 Ca 0.26 0.26 0.05 0.00 1.31 0.00 0.00 55.95 57.84 3fpv s SER 53 Cb 0.03 -1.84 -0.01 0.00 0.21 0.00 0.00 66.02 64.41 3fpv s SER 53 CO 0.09 0.26 -0.20 -0.69 0.41 0.00 0.00 173.24 173.11 3fpv s VAL 54 N -1.28 1.66 -0.00 3.43 1.01 -0.17 -1.93 120.40 123.12 3fpv s VAL 54 Ca 0.26 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.42 3fpv s VAL 54 Cb -0.12 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.83 3fpv s VAL 54 CO 0.17 0.47 -0.13 0.00 0.00 0.00 0.00 175.10 175.61 3fpv s ALA 55 N -0.15 1.08 -0.21 5.51 0.00 0.05 -0.33 121.76 127.71 3fpv s ALA 55 Ca -0.01 -0.60 -0.01 0.00 0.00 0.00 0.00 51.96 51.34 3fpv s ALA 55 Cb -0.11 -0.25 0.02 0.00 0.00 0.00 0.00 23.12 22.77 3fpv s ALA 55 CO 0.02 0.25 -0.12 0.08 0.00 0.00 0.00 175.76 175.99 3fpv s VAL 56 N -0.41 2.60 -0.16 0.00 1.01 0.14 -0.11 120.40 123.49 3fpv s VAL 56 Ca 0.04 -0.90 -0.01 0.00 0.00 0.00 0.00 61.98 61.11 3fpv s VAL 56 Cb -0.05 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.10 3fpv s VAL 56 CO -0.00 0.38 -0.10 -0.69 0.00 0.00 0.00 175.10 174.69 3fpv s VAL 57 N 1.33 3.16 0.96 2.92 1.01 -0.29 -0.25 120.40 129.24 3fpv s VAL 57 Ca 0.03 -0.61 -0.10 0.00 0.00 0.00 0.00 61.98 61.30 3fpv s VAL 57 Cb -0.15 -2.36 0.17 0.00 0.00 0.00 0.00 36.38 34.04 3fpv s VAL 57 CO -0.08 0.50 1.13 -0.62 0.00 0.00 0.00 175.10 176.03 3fpv s ASP 58 N 0.66 2.56 0.32 3.32 2.15 0.10 -0.26 116.67 125.53 3fpv s ASP 58 Ca -0.06 2.11 0.24 0.00 0.43 0.00 0.00 52.55 55.27 3fpv s ASP 58 Cb -0.15 -2.54 1.16 0.00 -0.30 0.00 0.00 42.92 41.10 3fpv s ASP 58 CO 0.02 -3.32 1.72 -0.09 -0.17 0.00 0.00 175.17 173.34 3fpv h ARG 59 N -2.02 0.00 -0.83 4.34 9.65 -1.55 -3.20 114.38 120.77 3fpv h ARG 59 Ca -0.46 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 58.39 3fpv h ARG 59 Cb 1.28 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.84 3fpv h ARG 59 CO 0.42 0.00 0.04 0.27 2.80 0.00 0.00 179.97 183.51 3fpv n ASN 60 N -2.32 3.24 -4.56 -3.80 0.23 -1.26 -4.91 115.26 101.87 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 0.12 -0.60 -0.04 0.00 -2.08 0.00 0.00 39.78 37.18 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 -0.32 0.67 0.31 4.83 0.00 -1.21 -5.05 107.32 106.55 3fpv s GLY 61 Ca 0.26 -1.89 -0.29 0.00 0.00 0.00 0.00 44.72 42.80 3fpv s GLY 61 CO 0.07 3.14 1.48 -1.31 0.00 0.00 0.00 173.10 176.47 3fpv s ASN 62 N 6.59 6.50 0.27 1.64 0.01 -1.26 -4.76 114.94 123.92 3fpv s ASN 62 Ca 0.59 2.87 -0.30 0.00 -0.71 0.00 0.00 52.86 55.31 3fpv s ASN 62 Cb -0.03 -2.64 -0.11 0.00 0.41 0.00 0.00 41.25 38.87 3fpv s ASN 62 CO -0.04 -0.79 1.56 -0.89 -1.51 0.00 0.00 177.10 175.43 3fpv s THR 63 N -0.53 2.26 -0.17 1.60 2.01 -1.26 0.03 115.64 119.57 3fpv s THR 63 Ca 0.57 0.21 -0.02 0.00 0.31 0.00 0.00 61.69 62.76 3fpv s THR 63 Cb -0.45 -3.14 -0.10 0.00 0.01 0.00 0.00 72.50 68.83 3fpv s THR 63 CO 0.52 0.03 -0.17 0.18 -0.69 0.00 0.00 174.62 174.50 3fpv n LEU 64 N 2.38 2.47 -3.98 4.42 4.77 0.65 -4.87 117.00 122.84 3fpv n LEU 64 Ca 0.08 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.86 3fpv n LEU 64 Cb 0.38 -0.55 -0.15 0.00 -2.33 0.00 0.00 43.42 40.76 3fpv n LEU 64 CO 0.63 0.65 -0.43 -0.69 -1.33 0.00 0.00 177.39 176.22 3fpv s VAL 65 N -2.32 0.72 0.03 4.08 1.01 -1.07 -4.99 120.40 117.85 3fpv s VAL 65 Ca -0.23 -0.32 0.08 0.00 0.00 0.00 0.00 61.98 61.52 3fpv s VAL 65 Cb 0.07 -0.65 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 3fpv s VAL 65 CO 0.36 0.23 -0.24 0.42 0.00 0.00 0.00 175.10 175.87 3fpv s THR 66 N 0.27 1.91 -0.12 3.92 -4.23 -1.26 -0.68 115.64 115.44 3fpv s THR 66 Ca -0.04 -1.25 -0.01 0.00 -1.18 0.00 0.00 61.69 59.21 3fpv s THR 66 Cb -0.09 -1.63 0.03 0.00 1.34 0.00 0.00 72.50 72.15 3fpv s THR 66 CO 0.00 0.33 -0.03 -0.76 -0.54 0.00 0.00 174.62 173.62 3fpv s LEU 67 N -1.10 1.09 -0.42 4.79 1.43 0.55 -5.00 118.68 120.01 3fpv s LEU 67 Ca 0.10 -0.38 -0.25 0.00 -1.03 0.00 0.00 54.13 52.57 3fpv s LEU 67 Cb -0.09 -0.70 0.02 0.00 0.03 0.00 0.00 46.19 45.45 3fpv s LEU 67 CO 0.01 -0.18 0.87 -0.60 0.23 0.00 0.00 176.35 176.68 3fpv s ARG 68 N 1.80 3.62 0.61 1.70 3.52 -1.26 -1.00 118.95 127.95 3fpv s ARG 68 Ca 0.03 0.23 -0.18 0.00 -0.13 0.00 0.00 55.73 55.69 3fpv s ARG 68 Cb -0.14 -3.88 -0.02 0.00 -1.56 0.00 0.00 34.95 29.35 3fpv s ARG 68 CO -0.07 -1.06 1.19 0.20 -0.81 0.00 0.00 175.30 174.75 3fpv s GLY 69 N 2.07 2.62 -0.03 8.12 0.00 -0.28 -4.92 107.32 114.89 3fpv s GLY 69 Ca 0.35 0.93 -0.30 0.00 0.00 0.00 0.00 44.72 45.71 3fpv s GLY 69 CO 0.22 1.32 1.96 0.99 0.00 0.00 0.00 173.10 177.59 3fpv s ASP 70 N -1.76 6.29 0.00 1.64 1.01 -1.26 -1.90 116.67 120.69 3fpv s ASP 70 Ca 0.76 2.42 0.00 0.00 0.71 0.00 0.00 52.55 56.44 3fpv s ASP 70 Cb -0.29 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.12 3fpv s ASP 70 CO 0.35 -1.22 0.00 0.61 0.21 0.00 0.00 175.17 175.12 3fpv n GLY 71 N 4.73 0.49 3.77 0.21 0.00 -1.26 -4.84 105.19 108.28 3fpv n GLY 71 Ca 0.21 -0.38 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.00 3.21 0.55 4.61 0.00 -0.80 -4.89 121.76 122.45 3fpv s ALA 72 Ca 0.00 1.14 -0.21 0.00 0.00 0.00 0.00 51.96 52.89 3fpv s ALA 72 Cb 0.00 -3.45 -0.05 0.00 0.00 0.00 0.00 23.12 19.62 3fpv s ALA 72 CO 0.00 -0.73 1.25 0.41 0.00 0.00 0.00 175.76 176.69 3fpv n GLY 73 N 0.67 0.47 0.27 0.00 0.00 -1.26 -4.90 105.19 100.44 3fpv n GLY 73 Ca 0.04 -0.01 0.15 0.00 0.00 0.00 0.00 46.02 46.20 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 1.19 0.00 0.00 1.61 0.13 -2.01 -2.11 132.00 130.82 3fpv h PRO 74 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3fpv h PRO 74 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 3fpv h PRO 74 CO 0.56 0.09 0.00 -0.56 -0.23 0.00 0.00 178.00 177.85 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 0.48 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.95 3fpv h GLN 75 CO 0.01 0.00 -0.61 0.66 -0.00 0.00 0.00 178.83 178.89 3fpv h SER 76 N 0.00 0.00 0.83 0.06 4.64 -1.70 -2.80 113.55 114.58 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 0.75 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.85 3fpv h SER 76 CO 0.00 0.46 -0.41 0.22 -0.87 0.00 0.00 176.83 176.22 3fpv h TYR 77 N 0.00 -1.08 -0.03 4.77 5.03 -1.74 0.21 116.97 124.13 3fpv h TYR 77 Ca -0.03 -0.02 -0.14 0.00 2.58 0.00 0.00 58.73 61.12 3fpv h TYR 77 Cb 1.37 0.36 -0.01 0.00 1.55 0.00 0.00 36.73 40.00 3fpv h TYR 77 CO 0.00 -0.66 -0.60 0.93 -1.32 0.00 0.00 178.16 176.51 3fpv h GLU 78 N -1.13 0.12 -0.27 1.82 5.08 -1.84 -2.82 114.58 115.54 3fpv h GLU 78 Ca -0.11 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.17 3fpv h GLU 78 Cb 0.88 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 3fpv h GLU 78 CO 0.17 0.69 0.15 1.03 -1.00 0.00 0.00 179.01 180.06 3fpv h SER 79 N 0.09 0.25 -0.66 1.42 0.87 -1.40 -1.94 113.55 112.19 3fpv h SER 79 Ca -0.01 0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.61 3fpv h SER 79 Cb 1.09 -0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 62.94 3fpv h SER 79 CO 0.09 0.19 0.38 0.00 -0.53 0.00 0.00 176.83 176.95 3fpv h ALA 80 N 1.12 0.87 -0.45 6.23 0.00 -0.88 -2.19 119.26 123.95 3fpv h ALA 80 Ca 0.10 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.05 3fpv h ALA 80 Cb -0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3fpv h ALA 80 CO -0.05 0.07 0.25 0.93 0.00 0.00 0.00 179.25 180.45 3fpv h GLU 81 N 0.71 0.48 0.00 0.00 5.08 -1.19 -1.83 114.58 117.83 3fpv h GLU 81 Ca 0.29 -0.03 -0.19 0.00 -1.00 0.00 0.00 59.36 58.43 3fpv h GLU 81 Cb 0.14 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 3fpv h GLU 81 CO -0.16 0.32 -0.90 0.00 -1.00 0.00 0.00 179.01 177.26 3fpv h ARG 82 N 0.49 0.00 -0.14 2.33 3.08 -1.24 -1.62 114.38 117.28 3fpv h ARG 82 Ca 0.19 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 3fpv h ARG 82 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 3fpv h ARG 82 CO -0.11 0.90 0.06 0.87 -1.07 0.00 0.00 179.97 180.63 3fpv h LYS 83 N 0.00 0.20 -0.84 0.04 1.57 -1.23 0.82 116.57 117.13 3fpv h LYS 83 Ca -0.01 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 3fpv h LYS 83 Cb 1.61 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.85 3fpv h LYS 83 CO 0.12 0.26 0.50 0.00 -0.57 0.00 0.00 179.45 179.75 3fpv h ALA 84 N 0.93 1.07 -0.19 3.86 0.00 -1.25 -0.28 119.26 123.40 3fpv h ALA 84 Ca 0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3fpv h ALA 84 Cb 0.13 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3fpv h ALA 84 CO -0.01 0.54 0.09 0.35 0.00 0.00 0.00 179.25 180.22 3fpv h PHE 85 N 1.15 0.27 -0.46 0.00 3.04 -1.18 -2.61 116.94 117.15 3fpv h PHE 85 Ca 0.30 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 62.24 3fpv h PHE 85 Cb -0.04 -0.08 -0.02 0.00 2.56 0.00 0.00 35.95 38.36 3fpv h PHE 85 CO -0.00 0.29 0.30 1.15 -2.02 0.00 0.00 178.31 178.03 3fpv h THR 86 N 0.18 1.11 -0.40 4.41 2.02 -0.54 -2.40 112.91 117.28 3fpv h THR 86 Ca 0.07 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 3fpv h THR 86 Cb 0.12 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 3fpv h THR 86 CO -0.01 0.11 0.24 0.00 0.37 0.00 0.00 175.52 176.23 3fpv h ALA 87 N 1.17 0.52 0.00 6.16 0.00 -0.96 -2.48 119.26 123.67 3fpv h ALA 87 Ca 0.17 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3fpv h ALA 87 Cb -0.06 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3fpv h ALA 87 CO -0.04 0.01 -0.13 -0.24 0.00 0.00 0.00 179.25 178.85 3fpv h VAL 88 N 0.53 0.28 -0.14 0.00 3.04 -1.42 0.74 116.25 119.27 3fpv h VAL 88 Ca 0.14 -1.04 -0.13 0.00 -1.01 0.00 0.00 66.70 64.66 3fpv h VAL 88 Cb 0.01 1.83 -0.01 0.00 -2.01 0.00 0.00 31.29 31.11 3fpv h VAL 88 CO -0.03 0.13 -0.48 0.28 -1.01 0.00 0.00 177.57 176.46 3fpv h SER 89 N 0.00 0.38 0.00 3.17 0.02 -0.95 -3.23 113.55 112.94 3fpv h SER 89 Ca -0.00 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 3fpv h SER 89 Cb 0.82 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.26 3fpv h SER 89 CO 0.02 0.80 -0.00 0.79 -1.14 0.00 0.00 176.83 177.30 3fpv n TRP 90 N -3.98 0.00 -3.93 3.45 8.01 -1.18 -5.01 117.44 114.80 3fpv n TRP 90 Ca -0.02 -0.42 -0.30 0.00 -1.31 0.00 0.00 57.50 55.46 3fpv n TRP 90 Cb 0.54 -0.04 0.02 0.00 -2.01 0.00 0.00 31.31 29.82 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 -0.43 -3.89 -4.06 -0.99 5.15 0.20 -4.98 115.26 106.27 3fpv n ASN 91 Ca 0.00 -0.83 -0.10 0.00 -0.60 0.00 0.00 54.58 53.06 3fpv n ASN 91 Cb 0.30 -3.72 -0.11 0.00 -0.53 0.00 0.00 39.78 35.72 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 -3.39 0.48 0.34 5.20 0.00 -0.90 -4.91 121.76 118.59 3fpv s ALA 92 Ca 0.55 -0.93 -0.27 0.00 0.00 0.00 0.00 51.96 51.31 3fpv s ALA 92 Cb -0.28 0.16 -0.13 0.00 0.00 0.00 0.00 23.12 22.87 3fpv s ALA 92 CO 0.84 -0.19 1.15 -2.30 0.00 0.00 0.00 175.76 175.26 3fpv n PRO 93 N 0.89 1.73 0.23 0.00 -0.02 -1.26 -4.36 135.00 132.21 3fpv n PRO 93 Ca -0.19 0.61 0.11 0.00 -2.02 0.00 0.00 63.50 62.01 3fpv n PRO 93 Cb 0.57 -2.12 0.48 0.00 -0.02 0.00 0.00 33.50 32.42 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 2.18 0.44 -0.51 3.45 1.35 -1.26 -0.68 112.91 117.88 3fpv h THR 94 Ca -0.44 -1.03 -0.06 0.00 -0.55 0.00 0.00 66.41 64.33 3fpv h THR 94 Cb 1.31 1.74 -0.02 0.00 -1.73 0.00 0.00 68.15 69.45 3fpv h THR 94 CO 0.61 0.18 0.06 0.77 -0.25 0.00 0.00 175.52 176.89 3fpv h SER 95 N 0.00 0.77 -0.38 5.36 4.64 -1.82 0.00 113.55 122.11 3fpv h SER 95 Ca -0.00 -0.16 -0.10 0.00 -0.47 0.00 0.00 61.79 61.06 3fpv h SER 95 Cb 0.73 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 3fpv h SER 95 CO 0.02 0.79 -0.15 -0.08 -0.87 0.00 0.00 176.83 176.54 3fpv h GLU 96 N 0.77 0.78 -0.18 4.77 4.81 -1.72 -3.33 114.58 120.47 3fpv h GLU 96 Ca 0.16 -0.33 -0.12 0.00 -0.13 0.00 0.00 59.36 58.95 3fpv h GLU 96 Cb 0.37 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 3fpv h GLU 96 CO 0.01 0.94 -0.39 -0.07 -0.73 0.00 0.00 179.01 178.77 3fpv h LEU 97 N 0.58 0.43 -1.61 1.64 3.38 -0.74 -2.72 115.31 116.25 3fpv h LEU 97 Ca 0.09 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 3fpv h LEU 97 Cb 0.69 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3fpv h LEU 97 CO 0.05 0.78 -0.20 0.00 0.09 0.00 0.00 178.44 179.16 3fpv h ALA 98 N 1.24 1.61 0.00 1.53 0.00 -1.12 -1.14 119.26 121.39 3fpv h ALA 98 Ca 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3fpv h ALA 98 Cb 0.85 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.60 3fpv h ALA 98 CO 0.07 0.25 0.00 0.87 0.00 0.00 0.00 179.25 180.44 3fpv h LYS 99 N 0.00 0.00 0.00 0.00 1.57 -1.61 -2.59 116.57 113.94 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 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 3fpv h LYS 99 CO 0.03 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.45 3fpv n ARG 100 N -2.33 0.01 0.17 3.15 1.74 -0.43 -3.40 116.66 115.57 3fpv n ARG 100 Ca 0.02 0.10 0.12 0.00 -0.77 0.00 0.00 57.85 57.32 3fpv n ARG 100 Cb 0.22 -1.52 0.25 0.00 -1.02 0.00 0.00 32.46 30.39 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 -0.32 0.55 3.38 -1.61 -2.46 115.31 114.85 3fpv h LEU 101 Ca 0.00 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.00 3fpv h LEU 101 Cb 0.42 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 3fpv h LEU 101 CO 0.00 0.00 0.09 0.00 0.09 0.00 0.00 178.44 178.63 3fpv h ALA 102 N 2.20 0.36 -0.01 1.53 0.00 -1.77 -2.16 119.26 119.41 3fpv h ALA 102 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3fpv h ALA 102 Cb 0.90 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3fpv h ALA 102 CO 0.00 -0.31 -0.71 0.00 0.00 0.00 0.00 179.25 178.23 3fpv n GLN 103 N -5.05 0.97 -3.38 0.00 10.64 -1.24 -4.63 117.38 114.70 3fpv n GLN 103 Ca 0.00 -0.37 -0.26 0.00 -1.83 0.00 0.00 57.00 54.54 3fpv n GLN 103 Cb 0.12 -1.40 -0.09 0.00 -0.86 0.00 0.00 30.24 28.01 3fpv n GLN 103 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3fpv n ALA 104 N -0.90 2.83 0.31 2.61 0.00 -0.93 -5.00 120.51 119.42 3fpv n ALA 104 Ca 0.05 -3.33 0.19 0.00 0.00 0.00 0.00 53.44 50.35 3fpv n ALA 104 Cb 0.35 -0.79 0.98 0.00 0.00 0.00 0.00 19.45 19.99 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 5.15 0.00 -0.31 0.00 0.13 -1.65 -2.91 132.00 132.40 3fpv h PRO 105 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 3fpv h PRO 105 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 3fpv h PRO 105 CO 0.43 0.03 0.00 0.25 -0.23 0.00 0.00 178.00 178.48 3fpv n THR 106 N -3.31 0.40 0.02 1.56 -2.24 -1.26 -3.81 114.28 105.64 3fpv n THR 106 Ca -0.02 -0.67 0.12 0.00 -2.27 0.00 0.00 64.05 61.21 3fpv n THR 106 Cb 0.15 1.00 0.57 0.00 -2.10 0.00 0.00 70.33 69.95 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 4.32 0.21 0.00 3.22 3.38 -1.90 -2.13 115.31 122.41 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 0.95 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.65 3fpv h LEU 107 CO 0.00 0.13 0.00 2.29 0.09 0.00 0.00 178.44 180.95 3fpv n LYS 108 N -4.46 0.27 0.00 1.13 2.85 -1.25 -2.55 118.16 114.15 3fpv n LYS 108 Ca 0.06 0.08 0.13 0.00 -1.05 0.00 0.00 58.31 57.53 3fpv n LYS 108 Cb 0.33 -1.50 0.25 0.00 -0.65 0.00 0.00 35.03 33.46 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 -1.32 1.99 -4.68 -5.58 8.00 -0.80 -4.84 116.55 109.32 3fpv n ASP 109 Ca 0.10 -1.54 -0.42 0.00 0.71 0.00 0.00 54.79 53.64 3fpv n ASP 109 Cb 0.19 0.13 -0.03 0.00 -0.02 0.00 0.00 41.12 41.40 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 -2.20 3.20 0.31 0.53 1.01 -1.06 -4.96 121.20 118.03 3fpv s ILE 110 Ca 0.28 0.52 -0.29 0.00 0.00 0.00 0.00 60.65 61.15 3fpv s ILE 110 Cb 0.20 -3.33 -0.13 0.00 0.01 0.00 0.00 42.46 39.21 3fpv s ILE 110 CO 0.41 -0.02 1.33 -2.65 0.00 0.00 0.00 174.94 174.02 3fpv n PRO 111 N 6.22 2.11 0.00 2.79 -0.02 -1.26 -3.08 135.00 141.76 3fpv n PRO 111 Ca 0.17 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 3fpv n PRO 111 Cb 0.41 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 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 1.27 1.31 3.93 -1.23 0.00 -1.26 -5.04 105.19 104.16 3fpv n GLY 112 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.35 5.31 -0.07 2.61 -4.23 -1.18 -4.67 115.64 111.06 3fpv s THR 113 Ca 0.00 -0.50 -0.02 0.00 -1.18 0.00 0.00 61.69 59.99 3fpv s THR 113 Cb 0.00 -3.70 0.03 0.00 1.34 0.00 0.00 72.50 70.17 3fpv s THR 113 CO 0.00 -0.03 0.05 -0.22 -0.54 0.00 0.00 174.62 173.87 3fpv s LEU 114 N -3.01 0.35 -1.17 4.79 2.96 -1.24 -4.99 118.68 116.39 3fpv s LEU 114 Ca 0.36 -0.11 -0.10 0.00 -0.22 0.00 0.00 54.13 54.06 3fpv s LEU 114 Cb -0.12 -0.27 0.23 0.00 0.50 0.00 0.00 46.19 46.54 3fpv s LEU 114 CO 0.28 -0.25 1.38 0.49 -1.32 0.00 0.00 176.35 176.93 3fpv n PHE 115 N 5.24 4.41 -3.64 5.38 3.01 -1.26 -4.55 117.46 126.05 3fpv n PHE 115 Ca -0.05 -3.38 -0.08 0.00 1.01 0.00 0.00 57.45 54.95 3fpv n PHE 115 Cb 0.50 -1.83 -0.07 0.00 -0.01 0.00 0.00 39.48 38.06 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 -0.42 -0.84 0.46 4.37 2.96 -1.26 -4.62 118.68 119.34 3fpv s LEU 116 Ca 0.36 1.39 -0.25 0.00 -0.22 0.00 0.00 54.13 55.42 3fpv s LEU 116 Cb -0.03 2.30 -0.08 0.00 0.50 0.00 0.00 46.19 48.89 3fpv s LEU 116 CO -0.01 -0.22 1.39 0.00 -1.32 0.00 0.00 176.35 176.18 3fpv s ALA 117 N 1.34 3.16 0.00 5.97 0.00 -1.26 -4.29 121.76 126.68 3fpv s ALA 117 Ca -0.08 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.28 3fpv s ALA 117 Cb -0.05 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.51 3fpv s ALA 117 CO -0.15 -1.16 0.00 0.41 0.00 0.00 0.00 175.76 174.86 3fpv n GLY 118 N 0.61 0.57 3.53 0.00 0.00 -1.14 -4.46 105.19 104.30 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 -0.32 1.66 -0.09 -0.02 0.00 -1.26 -0.90 107.32 106.39 3fpv s GLY 119 Ca 0.00 -0.89 -0.05 0.00 0.00 0.00 0.00 44.72 43.78 3fpv s GLY 119 CO 0.00 -0.51 0.20 -1.08 0.00 0.00 0.00 173.10 171.71 3fpv s THR 120 N -0.45 -0.03 0.41 0.90 -1.32 -0.58 -0.76 115.64 113.81 3fpv s THR 120 Ca 0.07 0.12 -0.23 0.00 -1.21 0.00 0.00 61.69 60.43 3fpv s THR 120 Cb -0.12 -0.31 -0.10 0.00 -1.51 0.00 0.00 72.50 70.46 3fpv s THR 120 CO 0.02 0.05 1.00 -2.16 -2.21 0.00 0.00 174.62 171.32 3fpv s PRO 121 N 0.93 4.18 -0.10 7.08 0.04 -1.26 -1.39 135.00 144.47 3fpv s PRO 121 Ca -0.07 1.35 -0.01 0.00 0.04 0.00 0.00 61.00 62.31 3fpv s PRO 121 Cb -0.08 -2.40 -0.03 0.00 0.04 0.00 0.00 34.50 32.02 3fpv s PRO 121 CO -0.05 -0.10 -0.05 0.08 0.04 0.00 0.00 177.00 176.91 3fpv s VAL 122 N -1.85 3.80 0.25 -0.36 1.01 0.79 -4.91 120.40 119.13 3fpv s VAL 122 Ca 0.59 -0.42 0.09 0.00 0.00 0.00 0.00 61.98 62.24 3fpv s VAL 122 Cb -0.17 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 3fpv s VAL 122 CO 0.22 0.56 0.01 0.42 0.00 0.00 0.00 175.10 176.31 3fpv s THR 123 N -0.38 3.57 -0.10 3.92 -4.23 -1.26 -0.51 115.64 116.64 3fpv s THR 123 Ca 0.06 -1.79 -0.02 0.00 -1.18 0.00 0.00 61.69 58.75 3fpv s THR 123 Cb -0.12 -2.89 0.04 0.00 1.34 0.00 0.00 72.50 70.86 3fpv s THR 123 CO 0.02 -0.33 0.01 0.00 -0.54 0.00 0.00 174.62 173.79 3fpv s ALA 124 N -2.21 0.76 -1.40 3.99 0.00 0.12 -4.80 121.76 118.24 3fpv s ALA 124 Ca 0.31 -0.27 -0.04 0.00 0.00 0.00 0.00 51.96 51.96 3fpv s ALA 124 Cb -0.07 -0.86 0.02 0.00 0.00 0.00 0.00 23.12 22.22 3fpv s ALA 124 CO 0.20 -0.65 0.68 1.63 0.00 0.00 0.00 175.76 177.61 3fpv n LYS 125 N 5.13 -4.49 0.00 0.00 4.76 -1.26 -2.93 118.16 119.37 3fpv n LYS 125 Ca -0.08 0.54 0.00 0.00 -2.87 0.00 0.00 58.31 55.91 3fpv n LYS 125 Cb 0.49 -5.05 0.00 0.00 -1.84 0.00 0.00 35.03 28.63 3fpv n LYS 125 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3fpv n GLY 126 N -1.70 3.01 3.76 0.72 0.00 -1.26 -4.99 105.19 104.73 3fpv n GLY 126 Ca -0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.81 3.60 0.20 4.61 0.00 -1.15 -4.96 121.76 122.25 3fpv s ALA 127 Ca 0.00 -0.71 -0.30 0.00 0.00 0.00 0.00 51.96 50.95 3fpv s ALA 127 Cb 0.00 -1.84 -0.09 0.00 0.00 0.00 0.00 23.12 21.20 3fpv s ALA 127 CO 0.00 0.49 1.33 -1.25 0.00 0.00 0.00 175.76 176.33 3fpv s PRO 128 N -0.60 4.37 0.00 0.00 0.04 -1.26 0.16 135.00 137.71 3fpv s PRO 128 Ca 0.11 2.08 0.00 0.00 0.04 0.00 0.00 61.00 63.24 3fpv s PRO 128 Cb -0.12 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.23 3fpv s PRO 128 CO 0.02 -0.29 0.00 1.33 0.04 0.00 0.00 177.00 178.11 3fpv n VAL 129 N 2.71 0.00 -3.58 -0.36 0.24 0.33 -4.77 118.33 112.91 3fpv n VAL 129 Ca 0.07 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.26 3fpv n VAL 129 Cb 0.42 0.03 -0.04 0.00 -1.47 0.00 0.00 33.84 32.78 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 -1.81 -1.13 0.04 2.33 0.00 -1.13 -1.45 121.76 118.61 3fpv s ALA 130 Ca 0.00 0.09 0.08 0.00 0.00 0.00 0.00 51.96 52.13 3fpv s ALA 130 Cb 0.00 0.77 -0.03 0.00 0.00 0.00 0.00 23.12 23.86 3fpv s ALA 130 CO 0.00 -0.70 -0.22 0.20 0.00 0.00 0.00 175.76 175.04 3fpv s GLY 131 N -2.79 1.47 -0.21 0.00 0.00 0.64 -0.15 107.32 106.28 3fpv s GLY 131 Ca 0.03 -1.22 -0.05 0.00 0.00 0.00 0.00 44.72 43.48 3fpv s GLY 131 CO -0.11 -1.10 0.00 -0.42 0.00 0.00 0.00 173.10 171.47 3fpv s ILE 132 N -0.84 3.92 -0.13 0.90 1.01 -0.49 -1.14 121.20 124.43 3fpv s ILE 132 Ca 0.13 -0.32 0.01 0.00 0.00 0.00 0.00 60.65 60.46 3fpv s ILE 132 Cb -0.10 -2.78 -0.01 0.00 0.01 0.00 0.00 42.46 39.58 3fpv s ILE 132 CO 0.03 0.42 -0.15 -0.83 0.00 0.00 0.00 174.94 174.41 3fpv s GLY 133 N 1.10 1.49 -0.07 6.18 0.00 0.85 -1.52 107.32 115.36 3fpv s GLY 133 Ca 0.02 -0.95 0.05 0.00 0.00 0.00 0.00 44.72 43.85 3fpv s GLY 133 CO 0.01 -0.14 -0.24 0.14 0.00 0.00 0.00 173.10 172.87 3fpv s VAL 134 N 0.49 2.01 -0.01 1.40 1.01 -0.08 -0.77 120.40 124.45 3fpv s VAL 134 Ca -0.10 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 60.87 3fpv s VAL 134 Cb -0.16 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 3fpv s VAL 134 CO 0.05 0.56 -0.09 0.00 0.00 0.00 0.00 175.10 175.61 3fpv s ALA 135 N -0.02 0.77 0.00 5.51 0.00 -0.81 -4.58 121.76 122.63 3fpv s ALA 135 Ca -0.08 -0.39 0.00 0.00 0.00 0.00 0.00 51.96 51.49 3fpv s ALA 135 Cb -0.15 -0.21 0.00 0.00 0.00 0.00 0.00 23.12 22.77 3fpv s ALA 135 CO 0.05 0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.40 3fpv n GLY 136 N 2.89 -0.46 3.63 0.00 0.00 -1.26 -1.04 105.19 108.95 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 -0.54 0.70 0.45 4.61 0.00 -1.26 -4.72 121.76 120.99 3fpv s ALA 137 Ca 0.00 -0.11 0.24 0.00 0.00 0.00 0.00 51.96 52.09 3fpv s ALA 137 Cb 0.00 -3.21 1.25 0.00 0.00 0.00 0.00 23.12 21.16 3fpv s ALA 137 CO 0.00 -3.02 1.79 -1.35 0.00 0.00 0.00 175.76 173.18 3fpv h PRO 138 N -2.03 0.25 -4.11 0.00 0.11 -1.98 -3.43 132.00 120.81 3fpv h PRO 138 Ca -0.54 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.44 3fpv h PRO 138 Cb 1.31 -0.06 -0.15 0.00 0.11 0.00 0.00 31.00 32.22 3fpv h PRO 138 CO 0.53 0.17 -0.57 -1.54 -0.21 0.00 0.00 178.00 176.37 3fpv s SER 139 N -5.27 0.35 0.44 -2.05 1.04 -1.26 -5.04 113.70 101.91 3fpv s SER 139 Ca -0.07 -0.91 0.23 0.00 0.48 0.00 0.00 55.95 55.68 3fpv s SER 139 Cb 0.24 0.26 0.98 0.00 0.10 0.00 0.00 66.02 67.60 3fpv s SER 139 CO 0.80 -0.66 1.86 1.23 0.98 0.00 0.00 173.24 177.45 3fpv h GLY 140 N 2.99 0.00 1.39 7.32 0.00 -1.83 -2.37 103.07 110.57 3fpv h GLY 140 Ca -0.34 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 46.86 3fpv h GLY 140 CO 0.62 0.00 -0.36 -0.55 0.00 0.00 0.00 176.54 176.25 3fpv h ASP 141 N 0.00 0.71 0.11 0.19 5.19 -1.97 -1.45 116.42 119.20 3fpv h ASP 141 Ca -0.00 -0.30 -0.14 0.00 -0.62 0.00 0.00 57.03 55.96 3fpv h ASP 141 Cb 0.68 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.99 3fpv h ASP 141 CO 0.03 1.00 -0.48 -0.07 -3.12 0.00 0.00 179.24 176.60 3fpv h LEU 142 N 0.56 0.47 -0.34 1.55 3.38 -1.89 -2.10 115.31 116.95 3fpv h LEU 142 Ca 0.06 -0.23 0.03 0.00 0.09 0.00 0.00 57.88 57.82 3fpv h LEU 142 Cb 0.88 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.47 3fpv h LEU 142 CO 0.08 0.88 0.15 0.44 0.09 0.00 0.00 178.44 180.09 3fpv h ASP 143 N 0.35 0.21 0.79 -0.43 3.32 -1.19 -2.56 116.42 116.91 3fpv h ASP 143 Ca 0.02 0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.01 3fpv h ASP 143 Cb 0.98 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 3fpv h ASP 143 CO 0.09 0.16 -0.40 -0.08 -1.72 0.00 0.00 179.24 177.29 3fpv h GLU 144 N 0.32 0.00 -0.17 3.56 4.81 -1.16 -0.41 114.58 121.54 3fpv h GLU 144 Ca 0.15 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.37 3fpv h GLU 144 Cb 0.08 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 3fpv h GLU 144 CO -0.12 0.40 0.10 0.37 -0.73 0.00 0.00 179.01 179.03 3fpv h GLN 145 N 0.00 0.23 -0.12 1.92 4.15 -1.18 0.14 115.11 120.25 3fpv h GLN 145 Ca -0.00 -0.02 -0.10 0.00 0.77 0.00 0.00 58.65 59.30 3fpv h GLN 145 Cb 0.90 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.53 3fpv h GLN 145 CO 0.05 0.21 -0.36 1.88 -1.93 0.00 0.00 178.83 178.68 3fpv h TYR 146 N 0.18 0.27 -0.44 3.99 0.05 -1.10 -1.77 116.97 118.16 3fpv h TYR 146 Ca 0.06 -0.07 -0.12 0.00 0.05 0.00 0.00 58.73 58.65 3fpv h TYR 146 Cb 0.04 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 37.71 3fpv h TYR 146 CO -0.05 0.58 -0.21 0.00 -1.05 0.00 0.00 178.16 177.43 3fpv h ALA 147 N 1.42 0.80 -0.37 3.88 0.00 -0.84 -0.12 119.26 124.03 3fpv h ALA 147 Ca 0.02 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 3fpv h ALA 147 Cb 0.74 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3fpv h ALA 147 CO 0.06 0.65 -0.13 0.00 0.00 0.00 0.00 179.25 179.83 3fpv h ARG 148 N 0.76 0.66 -0.09 0.00 3.08 -0.55 -2.09 114.38 116.15 3fpv h ARG 148 Ca 0.10 -0.21 -0.11 0.00 0.07 0.00 0.00 59.98 59.83 3fpv h ARG 148 Cb 0.76 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 3fpv h ARG 148 CO 0.06 0.77 -0.45 0.00 -1.07 0.00 0.00 179.97 179.27 3fpv h ALA 149 N 1.26 1.07 0.02 0.04 0.00 -1.00 -1.78 119.26 118.88 3fpv h ALA 149 Ca 0.10 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.59 3fpv h ALA 149 Cb 0.56 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3fpv h ALA 149 CO 0.04 0.62 -0.08 0.78 0.00 0.00 0.00 179.25 180.60 3fpv h GLY 150 N 1.29 -0.11 2.00 0.00 0.00 -0.80 -3.07 103.07 102.39 3fpv h GLY 150 Ca 0.01 0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3fpv h GLY 150 CO 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 176.54 176.52 3fpv n ALA 151 N -2.29 1.69 0.47 3.60 0.00 -0.81 -3.21 120.51 119.96 3fpv n ALA 151 Ca -0.06 0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.53 3fpv n ALA 151 Cb 0.13 -1.33 0.26 0.00 0.00 0.00 0.00 19.45 18.51 3fpv n ALA 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fpv h ALA 152 N 2.38 0.87 0.00 0.00 0.00 -1.23 -3.01 119.26 118.26 3fpv h ALA 152 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3fpv h ALA 152 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3fpv h ALA 152 CO 0.00 0.00 -0.31 1.33 0.00 0.00 0.00 179.25 180.27 3fpv n VAL 153 N -2.47 0.36 -2.63 0.00 0.24 -1.20 -4.64 118.33 107.99 3fpv n VAL 153 Ca 0.04 -0.22 -0.27 0.00 -2.04 0.00 0.00 64.34 61.86 3fpv n VAL 153 Cb 0.47 -0.30 0.01 0.00 -1.47 0.00 0.00 33.84 32.55 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 -4.06 3.56 0.15 1.34 1.43 -1.14 -3.88 118.68 116.09 3fpv s LEU 154 Ca 0.09 0.83 0.26 0.00 -1.03 0.00 0.00 54.13 54.29 3fpv s LEU 154 Cb 0.14 -3.76 0.94 0.00 0.03 0.00 0.00 46.19 43.54 3fpv s LEU 154 CO 0.65 -0.67 1.80 0.61 0.23 0.00 0.00 176.35 178.97 3fpv n GLY 155 N -2.30 -1.60 0.00 -3.19 0.00 -1.26 -4.99 105.19 91.85 3fpv n GLY 155 Ca 0.01 -0.04 0.03 0.00 0.00 0.00 0.00 46.02 46.02 3fpv n GLY 155 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93