#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 1.50 0.20 2.33 0.00 -1.26 -5.10 121.76 119.43 3fpv s ALA 17 Ca 0.00 -1.52 -0.30 0.00 0.00 0.00 0.00 51.96 50.14 3fpv s ALA 17 Cb 0.00 -1.55 -0.08 0.00 0.00 0.00 0.00 23.12 21.49 3fpv s ALA 17 CO 0.00 -1.56 1.23 0.00 0.00 0.00 0.00 175.76 175.43 3fpv s ALA 18 N 1.63 3.46 0.12 0.00 0.00 -1.26 -5.06 121.76 120.66 3fpv s ALA 18 Ca 0.07 1.01 0.01 0.00 0.00 0.00 0.00 51.96 53.05 3fpv s ALA 18 Cb -0.17 -3.43 -0.01 0.00 0.00 0.00 0.00 23.12 19.51 3fpv s ALA 18 CO -0.21 -0.42 0.05 2.89 0.00 0.00 0.00 175.76 178.06 3fpv n ARG 19 N 2.41 0.75 0.05 0.00 1.85 -1.26 -4.92 116.66 115.54 3fpv n ARG 19 Ca 0.04 -1.06 0.13 0.00 -1.00 0.00 0.00 57.85 55.97 3fpv n ARG 19 Cb 0.44 0.61 0.44 0.00 -1.05 0.00 0.00 32.46 32.89 3fpv n ARG 19 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3fpv n GLY 20 N 1.20 -1.55 0.15 2.89 0.00 -1.26 -2.68 105.19 103.94 3fpv n GLY 20 Ca -0.01 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.02 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 4.74 0.00 -1.36 -0.02 0.00 -2.04 -2.96 103.07 101.43 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 -2.54 2.01 -3.95 4.80 1.02 -1.09 -4.95 120.64 115.94 3fpv n GLU 22 Ca 0.05 -1.80 -0.33 0.00 -0.02 0.00 0.00 57.16 55.06 3fpv n GLU 22 Cb 0.44 -1.30 -0.05 0.00 -0.02 0.00 0.00 31.44 30.51 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 -1.06 4.26 0.11 -4.62 1.43 -1.12 -4.99 118.68 112.69 3fpv s LEU 23 Ca 0.23 0.28 0.02 0.00 -1.03 0.00 0.00 54.13 53.63 3fpv s LEU 23 Cb 0.13 -2.61 -0.04 0.00 0.03 0.00 0.00 46.19 43.70 3fpv s LEU 23 CO 0.18 0.24 -0.06 0.28 0.23 0.00 0.00 176.35 177.23 3fpv s THR 24 N -1.34 0.68 0.03 5.49 -1.32 -1.26 -4.96 115.64 112.96 3fpv s THR 24 Ca 0.28 -1.94 0.03 0.00 -1.21 0.00 0.00 61.69 58.85 3fpv s THR 24 Cb -0.13 -1.73 -0.04 0.00 -1.51 0.00 0.00 72.50 69.10 3fpv s THR 24 CO 0.20 -0.83 -0.02 -1.10 -2.21 0.00 0.00 174.62 170.65 3fpv s GLN 25 N -3.84 2.64 0.13 7.08 -1.52 -1.26 -5.13 119.66 117.75 3fpv s GLN 25 Ca 0.13 -0.72 0.07 0.00 -1.95 0.00 0.00 55.36 52.89 3fpv s GLN 25 Cb 0.05 -2.58 -0.04 0.00 -0.22 0.00 0.00 33.01 30.23 3fpv s GLN 25 CO -0.04 0.59 -0.15 -1.54 -0.25 0.00 0.00 175.29 173.90 3fpv s SER 26 N -1.76 2.17 -0.07 5.90 1.04 -1.26 -5.16 113.70 114.56 3fpv s SER 26 Ca 0.21 -0.80 0.01 0.00 0.48 0.00 0.00 55.95 55.85 3fpv s SER 26 Cb -0.11 -0.09 -0.03 0.00 0.10 0.00 0.00 66.02 65.89 3fpv s SER 26 CO 0.12 -0.10 -0.09 -0.89 0.98 0.00 0.00 173.24 173.26 3fpv s THR 27 N -2.00 3.51 0.08 2.02 2.01 -1.26 -5.12 115.64 114.88 3fpv s THR 27 Ca 0.10 -0.55 0.03 0.00 0.31 0.00 0.00 61.69 61.58 3fpv s THR 27 Cb -0.06 -2.42 -0.03 0.00 0.01 0.00 0.00 72.50 70.00 3fpv s THR 27 CO 0.04 0.59 -0.09 -1.00 -0.69 0.00 0.00 174.62 173.47 3fpv s HIS 28 N -0.72 0.92 0.32 4.92 3.76 -1.26 -4.79 115.29 118.43 3fpv s HIS 28 Ca 0.11 -0.65 -0.28 0.00 -0.15 0.00 0.00 55.06 54.09 3fpv s HIS 28 Cb -0.11 -0.52 -0.13 0.00 1.11 0.00 0.00 32.58 32.93 3fpv s HIS 28 CO 0.01 -0.05 1.21 1.28 -0.85 0.00 0.00 174.74 176.35 3fpv n LEU 29 N 0.76 2.96 -4.73 0.89 4.77 -1.26 -5.04 117.00 115.35 3fpv n LEU 29 Ca -0.18 1.19 -0.34 0.00 -0.03 0.00 0.00 56.01 56.66 3fpv n LEU 29 Cb 0.57 -1.42 0.08 0.00 -2.33 0.00 0.00 43.42 40.33 3fpv n LEU 29 CO 0.25 -0.77 0.78 0.42 -1.33 0.00 0.00 177.39 176.74 3fpv s THR 30 N -0.99 2.56 0.28 -5.08 -4.23 -1.26 -4.88 115.64 102.04 3fpv s THR 30 Ca 0.58 0.27 0.01 0.00 -1.18 0.00 0.00 61.69 61.37 3fpv s THR 30 Cb -0.62 -2.80 0.27 0.00 1.34 0.00 0.00 72.50 70.69 3fpv s THR 30 CO 0.60 -0.16 1.70 0.25 -0.54 0.00 0.00 174.62 176.48 3fpv h LEU 31 N -0.26 0.28 -0.37 4.79 5.85 -1.97 -0.46 115.31 123.16 3fpv h LEU 31 Ca -0.47 0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.39 3fpv h LEU 31 Cb 1.28 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 3fpv h LEU 31 CO 0.51 0.02 0.23 -0.08 -0.34 0.00 0.00 178.44 178.77 3fpv h GLU 32 N 0.40 0.51 -0.40 1.25 4.57 -1.99 0.23 114.58 119.15 3fpv h GLU 32 Ca 0.52 -0.05 -0.16 0.00 -1.18 0.00 0.00 59.36 58.49 3fpv h GLU 32 Cb 0.93 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.41 3fpv h GLU 32 CO -0.51 0.38 -0.36 0.00 -1.18 0.00 0.00 179.01 177.34 3fpv h ALA 33 N 1.10 0.58 -0.64 2.92 0.00 -1.85 -0.28 119.26 121.09 3fpv h ALA 33 Ca 0.13 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.61 3fpv h ALA 33 Cb 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3fpv h ALA 33 CO -0.03 0.67 0.42 0.00 0.00 0.00 0.00 179.25 180.32 3fpv h ALA 34 N 0.78 0.82 -0.50 0.00 0.00 -0.81 -0.57 119.26 118.98 3fpv h ALA 34 Ca 0.07 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 3fpv h ALA 34 Cb 0.96 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 3fpv h ALA 34 CO 0.09 0.24 -0.06 1.15 0.00 0.00 0.00 179.25 180.67 3fpv h THR 35 N 0.87 1.27 -0.31 0.00 2.02 -0.43 -0.75 112.91 115.57 3fpv h THR 35 Ca 0.24 -1.17 0.03 0.00 0.77 0.00 0.00 66.41 66.27 3fpv h THR 35 Cb -0.09 1.01 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 3fpv h THR 35 CO -0.05 0.41 0.14 0.50 0.37 0.00 0.00 175.52 176.88 3fpv h LYS 36 N 0.78 0.28 -0.16 6.66 3.64 -0.75 -0.37 116.57 126.66 3fpv h LYS 36 Ca 0.13 -0.02 -0.17 0.00 -1.27 0.00 0.00 60.65 59.33 3fpv h LYS 36 Cb 0.60 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.35 3fpv h LYS 36 CO 0.04 0.19 -0.61 0.00 -2.27 0.00 0.00 179.45 176.79 3fpv h ALA 37 N 1.18 0.64 0.18 5.00 0.00 -1.05 -2.04 119.26 123.18 3fpv h ALA 37 Ca 0.13 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 3fpv h ALA 37 Cb 0.07 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3fpv h ALA 37 CO -0.11 0.71 -0.11 0.00 0.00 0.00 0.00 179.25 179.73 3fpv h ALA 38 N 0.93 -0.27 -0.01 0.00 0.00 -0.97 -2.69 119.26 116.25 3fpv h ALA 38 Ca -0.01 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 3fpv h ALA 38 Cb 1.17 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 3fpv h ALA 38 CO 0.11 -0.66 -0.47 0.00 0.00 0.00 0.00 179.25 178.23 3fpv h ARG 39 N -0.28 0.03 -0.67 0.00 3.08 -0.99 -1.00 114.38 114.54 3fpv h ARG 39 Ca -0.02 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 3fpv h ARG 39 Cb 0.24 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 3fpv h ARG 39 CO 0.02 0.49 0.34 0.00 -1.07 0.00 0.00 179.97 179.75 3fpv h ALA 40 N 1.50 1.33 -0.27 0.04 0.00 -1.36 -0.88 119.26 119.63 3fpv h ALA 40 Ca -0.00 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.64 3fpv h ALA 40 Cb 0.85 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 3fpv h ALA 40 CO 0.06 0.53 -0.39 0.00 0.00 0.00 0.00 179.25 179.45 3fpv h ALA 41 N 1.43 0.41 -0.05 0.00 0.00 -0.85 -0.99 119.26 119.21 3fpv h ALA 41 Ca 0.24 -0.45 0.03 0.00 0.00 0.00 0.00 54.91 54.73 3fpv h ALA 41 Cb 0.07 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3fpv h ALA 41 CO -0.03 0.50 -0.20 0.28 0.00 0.00 0.00 179.25 179.80 3fpv h VAL 42 N 0.47 0.52 -0.58 0.00 2.07 -1.41 -2.33 116.25 114.99 3fpv h VAL 42 Ca 0.03 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.67 3fpv h VAL 42 Cb 0.98 0.52 -0.10 0.00 -1.52 0.00 0.00 31.29 31.17 3fpv h VAL 42 CO 0.09 0.00 0.00 -0.08 0.02 0.00 0.00 177.57 177.60 3fpv h GLU 43 N -0.29 0.11 -0.21 1.57 4.81 -0.84 0.13 114.58 119.87 3fpv h GLU 43 Ca 0.08 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.19 3fpv h GLU 43 Cb 0.40 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 3fpv h GLU 43 CO -0.22 0.08 -0.33 0.00 -0.73 0.00 0.00 179.01 177.80 3fpv h ALA 44 N 1.53 1.04 -0.46 2.92 0.00 -1.13 -0.19 119.26 122.98 3fpv h ALA 44 Ca 0.30 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 3fpv h ALA 44 Cb 0.48 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3fpv h ALA 44 CO -0.50 0.59 -0.03 0.00 0.00 0.00 0.00 179.25 179.31 3fpv h ALA 45 N 1.27 0.62 -0.05 0.00 0.00 -0.67 -3.13 119.26 117.30 3fpv h ALA 45 Ca 0.04 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.52 3fpv h ALA 45 Cb 0.77 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3fpv h ALA 45 CO 0.06 0.44 -0.60 0.93 0.00 0.00 0.00 179.25 180.09 3fpv h GLU 46 N 0.67 0.17 -0.68 0.00 4.39 -0.42 -0.60 114.58 118.12 3fpv h GLU 46 Ca 0.13 -0.12 0.17 0.00 0.34 0.00 0.00 59.36 59.88 3fpv h GLU 46 Cb 0.54 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.18 3fpv h GLU 46 CO 0.03 0.72 0.47 0.87 -1.16 0.00 0.00 179.01 179.94 3fpv h LYS 47 N 0.13 0.15 -0.56 2.33 1.57 -1.02 -0.87 116.57 118.30 3fpv h LYS 47 Ca -0.01 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3fpv h LYS 47 Cb 1.09 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.36 3fpv h LYS 47 CO 0.09 0.10 0.00 -3.47 -0.57 0.00 0.00 179.45 175.60 3fpv n ASP 48 N -4.40 3.20 -1.44 0.86 2.03 -0.66 -4.92 116.55 111.22 3fpv n ASP 48 Ca 0.13 -1.98 -0.13 0.00 0.52 0.00 0.00 54.79 53.33 3fpv n ASP 48 Cb 0.64 -0.37 -0.01 0.00 -0.72 0.00 0.00 41.12 40.66 3fpv n ASP 48 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3fpv n GLY 49 N 1.46 0.02 3.60 0.27 0.00 -0.33 -5.01 105.19 105.20 3fpv n GLY 49 Ca 0.20 -0.34 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 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 -4.46 2.16 -0.28 1.61 3.00 -0.32 -5.00 118.95 115.66 3fpv s ARG 50 Ca 0.00 -1.25 0.03 0.00 0.00 0.00 0.00 55.73 54.50 3fpv s ARG 50 Cb 0.00 -2.20 0.07 0.00 0.00 0.00 0.00 34.95 32.82 3fpv s ARG 50 CO 0.00 0.43 -0.06 -1.01 0.00 0.00 0.00 175.30 174.66 3fpv s HIS 51 N -1.78 3.20 0.24 -0.53 3.76 -1.26 -3.71 115.29 115.20 3fpv s HIS 51 Ca 0.26 -2.38 0.11 0.00 -0.15 0.00 0.00 55.06 52.90 3fpv s HIS 51 Cb -0.09 -2.10 -0.05 0.00 1.11 0.00 0.00 32.58 31.46 3fpv s HIS 51 CO 0.16 -0.88 -0.19 0.14 -0.85 0.00 0.00 174.74 173.13 3fpv s VAL 52 N 1.12 2.59 0.05 -0.90 -7.23 -1.26 -4.13 120.40 110.63 3fpv s VAL 52 Ca -0.03 -2.15 -0.08 0.00 -1.81 0.00 0.00 61.98 57.91 3fpv s VAL 52 Cb -0.20 -2.31 -0.05 0.00 0.56 0.00 0.00 36.38 34.38 3fpv s VAL 52 CO -0.06 -0.26 0.34 -0.44 -0.31 0.00 0.00 175.10 174.36 3fpv s SER 53 N -3.14 6.56 -0.05 4.85 0.01 -0.41 -1.36 113.70 120.16 3fpv s SER 53 Ca 0.26 0.66 0.03 0.00 1.31 0.00 0.00 55.95 58.22 3fpv s SER 53 Cb -0.07 -2.13 0.01 0.00 0.21 0.00 0.00 66.02 64.04 3fpv s SER 53 CO 0.13 0.20 -0.13 -0.69 0.41 0.00 0.00 173.24 173.16 3fpv s VAL 54 N -1.37 1.15 -0.03 3.43 1.01 0.13 -1.65 120.40 123.07 3fpv s VAL 54 Ca 0.31 -0.53 0.04 0.00 0.00 0.00 0.00 61.98 61.81 3fpv s VAL 54 Cb -0.13 -1.02 -0.00 0.00 0.00 0.00 0.00 36.38 35.22 3fpv s VAL 54 CO 0.18 0.35 -0.15 0.00 0.00 0.00 0.00 175.10 175.48 3fpv s ALA 55 N 0.37 1.31 -0.20 5.51 0.00 -0.03 -0.57 121.76 128.15 3fpv s ALA 55 Ca -0.09 -0.60 -0.06 0.00 0.00 0.00 0.00 51.96 51.21 3fpv s ALA 55 Cb -0.13 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.55 3fpv s ALA 55 CO 0.03 0.26 0.03 0.08 0.00 0.00 0.00 175.76 176.15 3fpv s VAL 56 N -0.05 4.25 -0.11 0.00 1.01 0.42 -0.08 120.40 125.85 3fpv s VAL 56 Ca -0.01 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 61.79 3fpv s VAL 56 Cb -0.09 -2.93 0.01 0.00 0.00 0.00 0.00 36.38 33.36 3fpv s VAL 56 CO 0.01 0.42 -0.20 -0.69 0.00 0.00 0.00 175.10 174.63 3fpv s VAL 57 N 0.93 1.84 0.85 2.92 1.01 0.42 -0.46 120.40 127.91 3fpv s VAL 57 Ca 0.02 -0.87 -0.11 0.00 0.00 0.00 0.00 61.98 61.02 3fpv s VAL 57 Cb -0.14 -1.62 0.11 0.00 0.00 0.00 0.00 36.38 34.73 3fpv s VAL 57 CO 0.02 0.51 1.15 -0.62 0.00 0.00 0.00 175.10 176.17 3fpv s ASP 58 N 0.60 3.45 0.56 3.32 2.15 0.69 0.43 116.67 127.88 3fpv s ASP 58 Ca -0.14 2.18 0.38 0.00 0.43 0.00 0.00 52.55 55.40 3fpv s ASP 58 Cb -0.17 -2.57 2.05 0.00 -0.30 0.00 0.00 42.92 41.93 3fpv s ASP 58 CO 0.04 -2.75 2.15 -0.09 -0.17 0.00 0.00 175.17 174.35 3fpv h ARG 59 N -1.39 0.00 -0.79 4.34 9.65 -1.50 -3.05 114.38 121.64 3fpv h ARG 59 Ca -0.44 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.41 3fpv h ARG 59 Cb 1.27 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.83 3fpv h ARG 59 CO 0.45 0.00 0.03 0.27 2.80 0.00 0.00 179.97 183.52 3fpv n ASN 60 N -2.83 3.61 -4.56 -3.80 0.23 -1.26 -4.92 115.26 101.73 3fpv n ASN 60 Ca -0.03 -2.55 -0.36 0.00 -0.53 0.00 0.00 54.58 51.11 3fpv n ASN 60 Cb 0.07 -0.61 -0.04 0.00 -2.08 0.00 0.00 39.78 37.12 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 -0.41 0.92 0.29 4.83 0.00 -1.15 -5.04 107.32 106.75 3fpv s GLY 61 Ca 0.30 -2.05 -0.29 0.00 0.00 0.00 0.00 44.72 42.68 3fpv s GLY 61 CO 0.09 2.96 1.22 0.70 0.00 0.00 0.00 173.10 178.07 3fpv n ASN 62 N 10.56 2.22 -4.72 1.64 3.02 -1.26 -4.72 115.26 122.01 3fpv n ASN 62 Ca 0.36 1.18 -0.42 0.00 -0.03 0.00 0.00 54.58 55.67 3fpv n ASN 62 Cb 0.49 -1.39 -0.03 0.00 -0.61 0.00 0.00 39.78 38.24 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 -0.78 2.98 -0.25 3.41 2.01 -1.26 -0.22 115.64 121.52 3fpv s THR 63 Ca 0.61 0.70 -0.08 0.00 0.31 0.00 0.00 61.69 63.22 3fpv s THR 63 Cb -0.65 -3.45 -0.16 0.00 0.01 0.00 0.00 72.50 68.26 3fpv s THR 63 CO 0.58 0.05 -0.20 0.18 -0.69 0.00 0.00 174.62 174.54 3fpv n LEU 64 N 3.99 2.37 -3.84 4.42 4.77 0.39 -4.90 117.00 124.21 3fpv n LEU 64 Ca 0.13 0.16 -0.18 0.00 -0.03 0.00 0.00 56.01 56.09 3fpv n LEU 64 Cb 0.40 -0.89 -0.16 0.00 -2.33 0.00 0.00 43.42 40.44 3fpv n LEU 64 CO 0.60 0.70 -0.38 -0.69 -1.33 0.00 0.00 177.39 176.29 3fpv s VAL 65 N -2.50 0.26 -0.05 4.08 1.01 -1.04 -4.99 120.40 117.17 3fpv s VAL 65 Ca -0.35 0.03 0.06 0.00 0.00 0.00 0.00 61.98 61.72 3fpv s VAL 65 Cb 0.11 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 36.14 3fpv s VAL 65 CO 0.56 0.16 -0.24 0.42 0.00 0.00 0.00 175.10 176.00 3fpv s THR 66 N 0.96 2.16 -0.12 3.92 -4.23 -1.26 -0.43 115.64 116.63 3fpv s THR 66 Ca -0.10 -1.05 0.01 0.00 -1.18 0.00 0.00 61.69 59.37 3fpv s THR 66 Cb -0.14 -1.77 0.02 0.00 1.34 0.00 0.00 72.50 71.95 3fpv s THR 66 CO -0.01 0.57 -0.13 -0.76 -0.54 0.00 0.00 174.62 173.75 3fpv s LEU 67 N -0.35 1.60 -0.36 4.79 1.43 0.26 -5.00 118.68 121.05 3fpv s LEU 67 Ca 0.02 -0.42 -0.19 0.00 -1.03 0.00 0.00 54.13 52.51 3fpv s LEU 67 Cb -0.12 -1.06 0.00 0.00 0.03 0.00 0.00 46.19 45.04 3fpv s LEU 67 CO 0.02 -0.03 0.57 -0.60 0.23 0.00 0.00 176.35 176.53 3fpv s ARG 68 N 1.28 3.60 0.60 1.70 3.52 -1.26 -0.70 118.95 127.69 3fpv s ARG 68 Ca -0.01 -0.12 -0.19 0.00 -0.13 0.00 0.00 55.73 55.28 3fpv s ARG 68 Cb -0.14 -3.83 -0.03 0.00 -1.56 0.00 0.00 34.95 29.40 3fpv s ARG 68 CO -0.06 -0.71 1.26 0.20 -0.81 0.00 0.00 175.30 175.18 3fpv s GLY 69 N 1.79 2.81 -0.09 8.12 0.00 -0.46 -4.93 107.32 114.56 3fpv s GLY 69 Ca 0.21 1.13 -0.29 0.00 0.00 0.00 0.00 44.72 45.77 3fpv s GLY 69 CO 0.14 1.56 1.91 0.99 0.00 0.00 0.00 173.10 177.70 3fpv s ASP 70 N -1.42 6.22 0.00 1.64 1.01 -1.26 -2.38 116.67 120.48 3fpv s ASP 70 Ca 0.78 2.19 0.00 0.00 0.71 0.00 0.00 52.55 56.23 3fpv s ASP 70 Cb -0.34 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.06 3fpv s ASP 70 CO 0.38 -1.30 0.00 0.61 0.21 0.00 0.00 175.17 175.06 3fpv n GLY 71 N 4.81 0.65 3.76 0.21 0.00 -1.26 -4.80 105.19 108.56 3fpv n GLY 71 Ca 0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.34 3.00 0.60 4.61 0.00 -1.00 -4.87 121.76 121.77 3fpv s ALA 72 Ca 0.00 1.26 -0.19 0.00 0.00 0.00 0.00 51.96 53.03 3fpv s ALA 72 Cb 0.00 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 3fpv s ALA 72 CO 0.00 -1.11 1.31 0.20 0.00 0.00 0.00 175.76 176.16 3fpv s GLY 73 N -0.92 2.86 0.45 0.00 0.00 -1.26 -4.91 107.32 103.54 3fpv s GLY 73 Ca 0.66 1.23 0.30 0.00 0.00 0.00 0.00 44.72 46.91 3fpv s GLY 73 CO 0.47 1.69 1.88 -0.56 0.00 0.00 0.00 173.10 176.58 3fpv h PRO 74 N 0.93 0.00 0.00 2.90 0.13 -2.01 -2.05 132.00 131.91 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 1.32 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.45 3fpv h PRO 74 CO 0.55 0.00 -0.01 -0.56 -0.23 0.00 0.00 178.00 177.75 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 -0.09 0.00 -0.00 0.00 0.00 58.65 58.56 3fpv h GLN 75 Cb 0.52 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.99 3fpv h GLN 75 CO 0.00 0.01 -0.45 0.66 -0.00 0.00 0.00 178.83 179.06 3fpv h SER 76 N 0.00 0.00 0.83 0.06 4.64 -1.69 -2.91 113.55 114.49 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 0.83 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.93 3fpv h SER 76 CO 0.00 0.45 -0.40 0.22 -0.87 0.00 0.00 176.83 176.23 3fpv h TYR 77 N 0.00 -1.04 -0.60 4.77 5.03 -1.73 0.12 116.97 123.52 3fpv h TYR 77 Ca -0.00 -0.02 -0.06 0.00 2.58 0.00 0.00 58.73 61.22 3fpv h TYR 77 Cb 1.27 0.34 -0.03 0.00 1.55 0.00 0.00 36.73 39.86 3fpv h TYR 77 CO 0.00 -0.64 0.12 1.49 -1.32 0.00 0.00 178.16 177.80 3fpv h GLU 78 N -1.25 0.95 -0.63 1.82 4.81 -1.84 -2.78 114.58 115.66 3fpv h GLU 78 Ca -0.11 -0.22 0.07 0.00 -0.13 0.00 0.00 59.36 58.96 3fpv h GLU 78 Cb 0.86 -0.13 -0.06 0.00 0.63 0.00 0.00 28.75 30.05 3fpv h GLU 78 CO 0.19 0.87 0.32 1.03 -0.73 0.00 0.00 179.01 180.68 3fpv h SER 79 N 0.90 0.44 -0.88 1.04 0.87 -1.43 -2.00 113.55 112.49 3fpv h SER 79 Ca 0.19 0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.80 3fpv h SER 79 Cb 0.37 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.25 3fpv h SER 79 CO 0.01 0.27 0.58 0.00 -0.53 0.00 0.00 176.83 177.16 3fpv h ALA 80 N 1.36 1.11 -0.41 6.23 0.00 -0.50 -2.33 119.26 124.73 3fpv h ALA 80 Ca 0.30 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 3fpv h ALA 80 Cb 0.25 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3fpv h ALA 80 CO -0.22 0.52 0.16 0.93 0.00 0.00 0.00 179.25 180.65 3fpv h GLU 81 N 1.19 0.61 0.00 0.00 5.08 -1.15 -2.30 114.58 118.00 3fpv h GLU 81 Ca 0.32 -0.11 -0.13 0.00 -1.00 0.00 0.00 59.36 58.44 3fpv h GLU 81 Cb -0.13 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.00 3fpv h GLU 81 CO -0.07 0.57 -0.60 0.00 -1.00 0.00 0.00 179.01 177.90 3fpv h ARG 82 N 0.51 0.00 -0.28 2.33 3.08 -1.31 -0.84 114.38 117.87 3fpv h ARG 82 Ca 0.14 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.16 3fpv h ARG 82 Cb 0.18 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 3fpv h ARG 82 CO -0.01 0.60 0.07 0.87 -1.07 0.00 0.00 179.97 180.44 3fpv h LYS 83 N 0.00 0.45 -0.17 0.04 1.57 -1.30 -0.19 116.57 116.97 3fpv h LYS 83 Ca -0.01 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 3fpv h LYS 83 Cb 1.24 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.48 3fpv h LYS 83 CO 0.08 0.53 0.08 0.00 -0.57 0.00 0.00 179.45 179.57 3fpv h ALA 84 N 0.90 0.22 -0.56 3.86 0.00 -1.17 -0.65 119.26 121.86 3fpv h ALA 84 Ca 0.09 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.99 3fpv h ALA 84 Cb 0.28 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 3fpv h ALA 84 CO 0.00 -0.22 0.24 0.35 0.00 0.00 0.00 179.25 179.62 3fpv h PHE 85 N 0.15 0.43 -0.59 0.00 3.04 -1.14 -2.06 116.94 116.76 3fpv h PHE 85 Ca 0.06 0.03 -0.08 0.00 3.98 0.00 0.00 57.97 61.95 3fpv h PHE 85 Cb 0.12 -0.11 -0.02 0.00 2.56 0.00 0.00 35.95 38.50 3fpv h PHE 85 CO -0.03 0.16 0.05 1.15 -2.02 0.00 0.00 178.31 177.62 3fpv h THR 86 N 0.45 1.26 -0.18 4.41 2.02 -0.82 -1.83 112.91 118.22 3fpv h THR 86 Ca 0.27 -1.07 0.02 0.00 0.77 0.00 0.00 66.41 66.40 3fpv h THR 86 Cb 0.27 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 3fpv h THR 86 CO -0.24 0.39 0.06 0.00 0.37 0.00 0.00 175.52 176.10 3fpv h ALA 87 N 1.00 0.20 0.00 6.16 0.00 -0.73 -3.04 119.26 122.85 3fpv h ALA 87 Ca 0.17 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 3fpv h ALA 87 Cb 0.49 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3fpv h ALA 87 CO 0.02 -0.37 -0.29 -0.24 0.00 0.00 0.00 179.25 178.37 3fpv h VAL 88 N 0.15 0.52 -0.68 0.00 3.04 -1.33 0.11 116.25 118.06 3fpv h VAL 88 Ca 0.08 -1.67 -0.04 0.00 -1.01 0.00 0.00 66.70 64.06 3fpv h VAL 88 Cb 0.05 2.20 -0.03 0.00 -2.01 0.00 0.00 31.29 31.50 3fpv h VAL 88 CO -0.08 0.29 0.27 0.28 -1.01 0.00 0.00 177.57 177.31 3fpv h SER 89 N 0.00 0.92 0.00 3.17 0.02 -1.21 -3.28 113.55 113.17 3fpv h SER 89 Ca -0.00 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 3fpv h SER 89 Cb 1.18 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.48 3fpv h SER 89 CO 0.04 0.83 0.00 0.79 -1.14 0.00 0.00 176.83 177.34 3fpv n TRP 90 N -4.30 0.00 -3.55 3.45 8.01 -1.18 -5.03 117.44 114.84 3fpv n TRP 90 Ca 0.06 -0.26 -0.20 0.00 -1.31 0.00 0.00 57.50 55.79 3fpv n TRP 90 Cb 0.18 -0.03 0.07 0.00 -2.01 0.00 0.00 31.31 29.53 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 -0.26 -2.88 -3.54 -0.99 5.15 0.37 -4.99 115.26 108.12 3fpv n ASN 91 Ca 0.00 -0.66 -0.12 0.00 -0.60 0.00 0.00 54.58 53.20 3fpv n ASN 91 Cb 0.18 -4.80 -0.04 0.00 -0.53 0.00 0.00 39.78 34.59 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 -3.41 -1.31 0.47 5.20 0.00 -1.01 -4.95 121.76 116.75 3fpv s ALA 92 Ca 0.16 0.37 -0.24 0.00 0.00 0.00 0.00 51.96 52.25 3fpv s ALA 92 Cb -0.07 0.65 -0.07 0.00 0.00 0.00 0.00 23.12 23.62 3fpv s ALA 92 CO 0.75 -0.64 1.39 -2.14 0.00 0.00 0.00 175.76 175.13 3fpv s PRO 93 N -3.29 3.59 0.50 0.00 0.02 -1.26 -4.40 135.00 130.14 3fpv s PRO 93 Ca -0.01 2.33 0.19 0.00 0.02 0.00 0.00 61.00 63.54 3fpv s PRO 93 Cb 0.00 -2.57 1.25 0.00 0.02 0.00 0.00 34.50 33.21 3fpv s PRO 93 CO -0.09 -0.87 2.07 1.79 -0.33 0.00 0.00 177.00 179.58 3fpv h THR 94 N 2.11 0.91 -0.61 0.99 1.35 -1.40 -0.30 112.91 115.96 3fpv h THR 94 Ca -0.51 -0.41 -0.04 0.00 -0.55 0.00 0.00 66.41 64.91 3fpv h THR 94 Cb 1.27 1.23 -0.03 0.00 -1.73 0.00 0.00 68.15 68.90 3fpv h THR 94 CO 0.60 0.11 0.24 0.77 -0.25 0.00 0.00 175.52 176.99 3fpv h SER 95 N 0.00 0.84 -0.50 5.36 4.64 -1.82 0.34 113.55 122.41 3fpv h SER 95 Ca -0.00 -0.17 -0.01 0.00 -0.47 0.00 0.00 61.79 61.13 3fpv h SER 95 Cb 0.22 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 3fpv h SER 95 CO 0.01 0.79 0.27 -0.08 -0.87 0.00 0.00 176.83 176.96 3fpv h GLU 96 N 0.85 0.71 -0.12 4.77 4.81 -1.64 -3.22 114.58 120.74 3fpv h GLU 96 Ca 0.20 -0.08 -0.12 0.00 -0.13 0.00 0.00 59.36 59.23 3fpv h GLU 96 Cb 0.21 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3fpv h GLU 96 CO -0.02 0.55 -0.46 -0.07 -0.73 0.00 0.00 179.01 178.29 3fpv h LEU 97 N 0.67 0.31 -2.20 1.64 3.38 -0.65 -2.49 115.31 115.97 3fpv h LEU 97 Ca 0.18 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3fpv h LEU 97 Cb 0.06 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3fpv h LEU 97 CO -0.03 0.73 0.01 0.00 0.09 0.00 0.00 178.44 179.24 3fpv h ALA 98 N 1.29 1.81 0.00 1.53 0.00 -0.35 -1.26 119.26 122.28 3fpv h ALA 98 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3fpv h ALA 98 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3fpv h ALA 98 CO 0.07 -0.02 0.00 0.87 0.00 0.00 0.00 179.25 180.18 3fpv h LYS 99 N 0.00 0.00 0.00 0.00 1.57 -1.49 -2.80 116.57 113.85 3fpv h LYS 99 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3fpv h LYS 99 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 3fpv h LYS 99 CO -0.00 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.42 3fpv n ARG 100 N -2.59 0.07 0.18 3.15 1.74 -0.47 -3.66 116.66 115.08 3fpv n ARG 100 Ca 0.01 0.17 0.12 0.00 -0.77 0.00 0.00 57.85 57.39 3fpv n ARG 100 Cb 0.26 -1.61 0.26 0.00 -1.02 0.00 0.00 32.46 30.36 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 -0.31 0.55 3.38 -1.66 -1.67 115.31 115.60 3fpv h LEU 101 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 3fpv h LEU 101 Cb 0.45 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3fpv h LEU 101 CO 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 178.44 178.46 3fpv h ALA 102 N 2.20 0.42 0.11 1.53 0.00 -1.80 -2.11 119.26 119.61 3fpv h ALA 102 Ca 0.00 -0.29 -0.28 0.00 0.00 0.00 0.00 54.91 54.35 3fpv h ALA 102 Cb 0.90 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 3fpv h ALA 102 CO 0.00 0.25 -1.31 0.37 0.00 0.00 0.00 179.25 178.56 3fpv h GLN 103 N 0.36 0.22 -2.54 0.00 5.75 -1.80 -3.41 115.11 113.69 3fpv h GLN 103 Ca 0.08 -0.38 -0.60 0.00 -0.15 0.00 0.00 58.65 57.60 3fpv h GLN 103 Cb 0.56 0.14 -0.39 0.00 1.07 0.00 0.00 27.48 28.87 3fpv h GLN 103 CO 0.03 1.14 -0.88 0.00 -2.65 0.00 0.00 178.83 176.47 3fpv s ALA 104 N -2.65 1.87 0.38 3.38 0.00 -0.63 -5.00 121.76 119.11 3fpv s ALA 104 Ca -0.05 -2.69 0.34 0.00 0.00 0.00 0.00 51.96 49.57 3fpv s ALA 104 Cb 0.07 -1.72 1.70 0.00 0.00 0.00 0.00 23.12 23.18 3fpv s ALA 104 CO 0.87 -2.01 2.13 -1.00 0.00 0.00 0.00 175.76 175.75 3fpv h PRO 105 N 5.71 0.00 -0.11 0.00 0.13 -1.62 -3.03 132.00 133.08 3fpv h PRO 105 Ca 0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.35 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 0.44 0.05 0.00 0.25 -0.23 0.00 0.00 178.00 178.50 3fpv n THR 106 N -3.30 0.13 0.14 1.56 -2.24 -1.26 -3.58 114.28 105.74 3fpv n THR 106 Ca -0.01 -0.33 0.12 0.00 -2.27 0.00 0.00 64.05 61.56 3fpv n THR 106 Cb 0.22 0.49 0.64 0.00 -2.10 0.00 0.00 70.33 69.57 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 2.45 0.03 0.00 3.22 3.38 -1.92 -1.55 115.31 120.92 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 0.53 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3fpv h LEU 107 CO 0.00 0.02 0.00 2.29 0.09 0.00 0.00 178.44 180.84 3fpv n LYS 108 N -4.48 0.09 0.00 1.13 2.85 -1.23 -2.47 118.16 114.05 3fpv n LYS 108 Ca 0.02 0.16 0.12 0.00 -1.05 0.00 0.00 58.31 57.57 3fpv n LYS 108 Cb 0.28 -1.50 0.27 0.00 -0.65 0.00 0.00 35.03 33.43 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 -1.43 1.30 -4.67 -5.58 8.00 -0.58 -4.83 116.55 108.76 3fpv n ASP 109 Ca 0.06 -1.06 -0.42 0.00 0.71 0.00 0.00 54.79 54.08 3fpv n ASP 109 Cb 0.19 0.24 -0.03 0.00 -0.02 0.00 0.00 41.12 41.50 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 -2.50 3.20 0.22 0.53 1.01 -1.03 -4.94 121.20 117.68 3fpv s ILE 110 Ca 0.22 0.37 -0.32 0.00 0.00 0.00 0.00 60.65 60.92 3fpv s ILE 110 Cb 0.19 -3.24 -0.14 0.00 0.01 0.00 0.00 42.46 39.28 3fpv s ILE 110 CO 0.54 -0.02 1.39 -2.65 0.00 0.00 0.00 174.94 174.19 3fpv n PRO 111 N 6.89 1.89 -0.33 2.79 -0.02 -1.26 -2.93 135.00 142.03 3fpv n PRO 111 Ca 0.18 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 3fpv n PRO 111 Cb 0.41 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 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 2.29 0.72 3.93 -1.23 0.00 -1.26 -5.04 105.19 104.60 3fpv n GLY 112 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.70 5.25 -0.19 2.61 -4.23 -1.15 -4.67 115.64 110.57 3fpv s THR 113 Ca 0.00 -0.49 -0.04 0.00 -1.18 0.00 0.00 61.69 59.98 3fpv s THR 113 Cb 0.00 -3.74 0.09 0.00 1.34 0.00 0.00 72.50 70.19 3fpv s THR 113 CO 0.00 -0.14 0.21 -0.22 -0.54 0.00 0.00 174.62 173.93 3fpv s LEU 114 N -3.28 -0.09 -1.22 4.79 2.96 -1.24 -4.98 118.68 115.62 3fpv s LEU 114 Ca 0.37 -0.16 -0.08 0.00 -0.22 0.00 0.00 54.13 54.04 3fpv s LEU 114 Cb -0.11 0.35 0.21 0.00 0.50 0.00 0.00 46.19 47.14 3fpv s LEU 114 CO 0.29 -0.32 1.76 0.49 -1.32 0.00 0.00 176.35 177.25 3fpv n PHE 115 N 5.32 2.72 -3.71 5.38 3.01 -1.26 -4.54 117.46 124.38 3fpv n PHE 115 Ca -0.06 -2.72 -0.11 0.00 1.01 0.00 0.00 57.45 55.57 3fpv n PHE 115 Cb 0.50 -1.74 -0.11 0.00 -0.01 0.00 0.00 39.48 38.11 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 0.18 0.42 4.37 2.96 -1.26 -4.57 118.68 119.83 3fpv s LEU 116 Ca 0.37 0.75 -0.25 0.00 -0.22 0.00 0.00 54.13 54.78 3fpv s LEU 116 Cb 0.08 1.15 -0.10 0.00 0.50 0.00 0.00 46.19 47.82 3fpv s LEU 116 CO 0.04 -0.17 1.25 0.00 -1.32 0.00 0.00 176.35 176.14 3fpv n ALA 117 N 4.03 1.19 0.00 5.97 0.00 -1.26 -4.31 120.51 126.12 3fpv n ALA 117 Ca -0.22 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3fpv n ALA 117 Cb 0.55 -2.25 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 0.85 -0.20 3.43 0.00 0.00 -1.22 -4.47 105.19 103.57 3fpv n GLY 118 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.11 1.46 -0.00 -0.02 0.00 -1.26 0.35 107.32 107.74 3fpv s GLY 119 Ca 0.00 -1.01 -0.01 0.00 0.00 0.00 0.00 44.72 43.70 3fpv s GLY 119 CO 0.00 -0.78 0.02 -1.08 0.00 0.00 0.00 173.10 171.26 3fpv s THR 120 N -0.64 0.01 0.31 0.90 -1.32 0.26 -1.07 115.64 114.10 3fpv s THR 120 Ca 0.10 -0.12 -0.22 0.00 -1.21 0.00 0.00 61.69 60.24 3fpv s THR 120 Cb -0.11 -0.07 -0.09 0.00 -1.51 0.00 0.00 72.50 70.72 3fpv s THR 120 CO 0.00 -0.06 0.86 -2.16 -2.21 0.00 0.00 174.62 171.05 3fpv s PRO 121 N -0.18 4.37 -0.10 7.08 0.04 -1.26 -0.51 135.00 144.44 3fpv s PRO 121 Ca -0.02 1.10 -0.01 0.00 0.04 0.00 0.00 61.00 62.11 3fpv s PRO 121 Cb -0.01 -2.68 -0.03 0.00 0.04 0.00 0.00 34.50 31.81 3fpv s PRO 121 CO -0.00 0.25 -0.06 0.08 0.04 0.00 0.00 177.00 177.31 3fpv s VAL 122 N -1.72 3.75 0.20 -0.36 1.01 0.49 -4.90 120.40 118.87 3fpv s VAL 122 Ca 0.50 -0.44 0.08 0.00 0.00 0.00 0.00 61.98 62.12 3fpv s VAL 122 Cb -0.16 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 3fpv s VAL 122 CO 0.20 0.56 0.03 0.42 0.00 0.00 0.00 175.10 176.31 3fpv s THR 123 N -0.37 3.78 -0.07 3.92 -4.23 -1.26 -0.72 115.64 116.68 3fpv s THR 123 Ca 0.06 -1.52 0.00 0.00 -1.18 0.00 0.00 61.69 59.04 3fpv s THR 123 Cb -0.12 -2.95 0.02 0.00 1.34 0.00 0.00 72.50 70.79 3fpv s THR 123 CO 0.02 -0.20 -0.04 0.00 -0.54 0.00 0.00 174.62 173.86 3fpv s ALA 124 N -1.92 0.86 -1.49 3.99 0.00 0.77 -4.83 121.76 119.14 3fpv s ALA 124 Ca 0.29 -0.21 -0.08 0.00 0.00 0.00 0.00 51.96 51.97 3fpv s ALA 124 Cb -0.08 -0.64 0.06 0.00 0.00 0.00 0.00 23.12 22.46 3fpv s ALA 124 CO 0.20 -0.23 0.70 1.63 0.00 0.00 0.00 175.76 178.06 3fpv n LYS 125 N 4.56 -4.15 0.00 0.00 5.02 -1.26 -2.42 118.16 119.91 3fpv n LYS 125 Ca -0.16 0.49 0.00 0.00 -2.02 0.00 0.00 58.31 56.61 3fpv n LYS 125 Cb 0.50 -5.02 0.00 0.00 -0.02 0.00 0.00 35.03 30.49 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 -1.70 2.73 3.82 0.72 0.00 -1.26 -5.00 105.19 104.50 3fpv n GLY 126 Ca -0.13 -0.09 -0.38 0.00 0.00 0.00 0.00 46.02 45.42 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 3.58 0.16 4.61 0.00 -1.01 -4.98 121.76 122.45 3fpv s ALA 127 Ca 0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 51.96 51.64 3fpv s ALA 127 Cb 0.00 -2.60 -0.09 0.00 0.00 0.00 0.00 23.12 20.43 3fpv s ALA 127 CO 0.00 0.41 1.39 -1.25 0.00 0.00 0.00 175.76 176.31 3fpv s PRO 128 N -1.38 4.32 0.00 0.00 0.04 -1.26 -0.16 135.00 136.56 3fpv s PRO 128 Ca 0.32 2.12 0.00 0.00 0.04 0.00 0.00 61.00 63.48 3fpv s PRO 128 Cb -0.18 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.15 3fpv s PRO 128 CO 0.19 -0.40 0.00 1.33 0.04 0.00 0.00 177.00 178.16 3fpv n VAL 129 N 3.41 0.00 -3.75 -0.36 0.24 0.10 -4.75 118.33 113.21 3fpv n VAL 129 Ca 0.10 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.30 3fpv n VAL 129 Cb 0.42 -0.32 -0.05 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 -1.91 -0.65 -0.05 2.33 0.00 -1.09 -1.32 121.76 119.08 3fpv s ALA 130 Ca 0.00 -0.33 0.06 0.00 0.00 0.00 0.00 51.96 51.69 3fpv s ALA 130 Cb 0.00 0.73 -0.01 0.00 0.00 0.00 0.00 23.12 23.84 3fpv s ALA 130 CO 0.00 -0.66 -0.24 0.20 0.00 0.00 0.00 175.76 175.05 3fpv s GLY 131 N -2.86 1.24 -0.23 0.00 0.00 0.17 -0.38 107.32 105.26 3fpv s GLY 131 Ca 0.07 -1.02 -0.09 0.00 0.00 0.00 0.00 44.72 43.68 3fpv s GLY 131 CO -0.07 -0.69 0.11 -0.42 0.00 0.00 0.00 173.10 172.03 3fpv s ILE 132 N -0.25 4.88 -0.07 0.90 1.01 0.34 -0.44 121.20 127.57 3fpv s ILE 132 Ca -0.00 0.01 0.05 0.00 0.00 0.00 0.00 60.65 60.71 3fpv s ILE 132 Cb -0.12 -3.26 -0.01 0.00 0.01 0.00 0.00 42.46 39.07 3fpv s ILE 132 CO 0.02 0.36 -0.24 -0.83 0.00 0.00 0.00 174.94 174.26 3fpv s GLY 133 N 1.11 1.33 -0.05 6.18 0.00 0.89 -0.57 107.32 116.21 3fpv s GLY 133 Ca 0.06 -1.02 0.04 0.00 0.00 0.00 0.00 44.72 43.80 3fpv s GLY 133 CO 0.04 -0.56 -0.18 0.14 0.00 0.00 0.00 173.10 172.54 3fpv s VAL 134 N -0.05 1.51 -0.02 1.40 1.01 0.16 -0.85 120.40 123.55 3fpv s VAL 134 Ca -0.07 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.17 3fpv s VAL 134 Cb -0.15 -1.30 0.01 0.00 0.00 0.00 0.00 36.38 34.95 3fpv s VAL 134 CO 0.05 0.43 -0.03 0.00 0.00 0.00 0.00 175.10 175.55 3fpv s ALA 135 N 0.03 0.46 0.00 5.51 0.00 -0.66 -4.58 121.76 122.53 3fpv s ALA 135 Ca -0.04 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 51.86 3fpv s ALA 135 Cb -0.12 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.75 3fpv s ALA 135 CO 0.03 0.02 0.00 0.41 0.00 0.00 0.00 175.76 176.22 3fpv n GLY 136 N 3.60 1.11 3.23 0.00 0.00 -1.26 -1.29 105.19 110.57 3fpv n GLY 136 Ca -0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 3fpv n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fpv n ALA 137 N 0.00 -3.75 0.33 4.61 0.00 -1.26 -4.71 120.51 115.73 3fpv n ALA 137 Ca 0.00 -0.54 0.21 0.00 0.00 0.00 0.00 53.44 53.12 3fpv n ALA 137 Cb 0.00 -1.48 1.15 0.00 0.00 0.00 0.00 19.45 19.12 3fpv n ALA 137 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3fpv h PRO 138 N -0.99 0.00 -3.21 0.00 0.11 -1.99 -3.43 132.00 122.49 3fpv h PRO 138 Ca -0.44 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.67 3fpv h PRO 138 Cb 1.32 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.33 3fpv h PRO 138 CO 0.31 0.00 0.09 -1.54 -0.21 0.00 0.00 178.00 176.66 3fpv s SER 139 N -5.12 -0.30 0.31 -2.05 1.04 -1.26 -5.07 113.70 101.26 3fpv s SER 139 Ca -0.05 -0.46 0.15 0.00 0.48 0.00 0.00 55.95 56.07 3fpv s SER 139 Cb 0.13 0.62 0.45 0.00 0.10 0.00 0.00 66.02 67.31 3fpv s SER 139 CO 0.40 -1.11 1.63 1.23 0.98 0.00 0.00 173.24 176.38 3fpv h GLY 140 N 2.13 0.00 1.78 7.32 0.00 -1.83 -2.27 103.07 110.19 3fpv h GLY 140 Ca -0.27 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.00 3fpv h GLY 140 CO 0.34 0.00 -0.16 1.29 0.00 0.00 0.00 176.54 178.01 3fpv h ASP 141 N 0.00 0.26 -0.06 0.19 3.04 -1.98 -0.29 116.42 117.59 3fpv h ASP 141 Ca -0.01 -0.06 -0.08 0.00 -3.24 0.00 0.00 57.03 53.65 3fpv h ASP 141 Cb 1.07 -0.07 0.00 0.00 -1.04 0.00 0.00 39.33 39.29 3fpv h ASP 141 CO 0.07 0.45 -0.27 -0.07 -2.04 0.00 0.00 179.24 177.38 3fpv h LEU 142 N 0.26 0.34 -0.80 0.15 3.38 -1.85 -2.65 115.31 114.14 3fpv h LEU 142 Ca 0.05 -0.65 0.15 0.00 0.09 0.00 0.00 57.88 57.52 3fpv h LEU 142 Cb 0.44 -0.10 -0.15 0.00 0.09 0.00 0.00 40.66 40.94 3fpv h LEU 142 CO 0.03 0.93 -0.26 0.44 0.09 0.00 0.00 178.44 179.66 3fpv h ASP 143 N -0.23 -0.96 0.61 -0.43 3.32 -1.07 -1.62 116.42 116.05 3fpv h ASP 143 Ca -0.02 0.25 -0.12 0.00 0.02 0.00 0.00 57.03 57.17 3fpv h ASP 143 Cb 0.92 0.57 -0.02 0.00 0.22 0.00 0.00 39.33 41.01 3fpv h ASP 143 CO 0.06 -0.28 -0.55 -0.08 -1.72 0.00 0.00 179.24 176.66 3fpv h GLU 144 N -0.04 0.00 -0.61 3.56 4.81 -1.09 -0.98 114.58 120.24 3fpv h GLU 144 Ca 0.35 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.62 3fpv h GLU 144 Cb 0.59 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.93 3fpv h GLU 144 CO -0.84 0.55 0.36 0.37 -0.73 0.00 0.00 179.01 178.72 3fpv h GLN 145 N 0.00 0.67 -0.01 1.92 4.15 -0.93 0.15 115.11 121.06 3fpv h GLN 145 Ca -0.01 -0.04 -0.14 0.00 0.77 0.00 0.00 58.65 59.23 3fpv h GLN 145 Cb 1.01 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 28.53 3fpv h GLN 145 CO 0.07 0.44 -0.66 1.88 -1.93 0.00 0.00 178.83 178.63 3fpv h TYR 146 N 0.69 0.06 -0.49 3.99 0.05 -0.97 -2.39 116.97 117.90 3fpv h TYR 146 Ca 0.25 -0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.97 3fpv h TYR 146 Cb 0.07 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 37.78 3fpv h TYR 146 CO -0.07 0.69 0.14 0.00 -1.05 0.00 0.00 178.16 177.88 3fpv h ALA 147 N 1.30 0.64 -0.78 3.88 0.00 -0.67 -2.02 119.26 121.62 3fpv h ALA 147 Ca -0.01 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3fpv h ALA 147 Cb 1.17 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 3fpv h ALA 147 CO 0.09 0.31 0.35 0.00 0.00 0.00 0.00 179.25 180.00 3fpv h ARG 148 N 0.66 1.12 -0.63 0.00 3.08 -0.62 -2.12 114.38 115.87 3fpv h ARG 148 Ca 0.16 -0.17 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 3fpv h ARG 148 Cb 0.29 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 3fpv h ARG 148 CO -0.00 0.88 0.10 0.00 -1.07 0.00 0.00 179.97 179.88 3fpv h ALA 149 N 1.27 0.99 -0.53 0.04 0.00 -1.24 -1.50 119.26 118.30 3fpv h ALA 149 Ca 0.26 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3fpv h ALA 149 Cb 0.14 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3fpv h ALA 149 CO -0.03 0.64 0.28 0.78 0.00 0.00 0.00 179.25 180.92 3fpv h GLY 150 N 1.04 0.79 2.00 0.00 0.00 -1.14 -2.77 103.07 102.98 3fpv h GLY 150 Ca 0.19 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 3fpv h GLY 150 CO 0.01 0.35 -0.12 0.00 0.00 0.00 0.00 176.54 176.77 3fpv h ALA 151 N 1.12 1.48 0.00 3.60 0.00 -0.95 -3.13 119.26 121.38 3fpv h ALA 151 Ca 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3fpv h ALA 151 Cb 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3fpv h ALA 151 CO -0.03 0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.38 3fpv h ALA 152 N 1.88 1.00 -0.00 0.00 0.00 -0.98 -2.40 119.26 118.75 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 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3fpv h ALA 152 CO 0.02 0.00 -0.07 1.33 0.00 0.00 0.00 179.25 180.53 3fpv n VAL 153 N -2.57 0.00 -3.34 0.00 0.24 -1.18 -4.70 118.33 106.78 3fpv n VAL 153 Ca 0.04 -0.03 -0.21 0.00 -2.04 0.00 0.00 64.34 62.10 3fpv n VAL 153 Cb 0.43 -0.28 -0.00 0.00 -1.47 0.00 0.00 33.84 32.52 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 -2.53 3.90 0.00 1.34 1.43 -0.91 -4.64 118.68 117.27 3fpv s LEU 154 Ca 0.29 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 3fpv s LEU 154 Cb 0.20 -2.98 0.00 0.00 0.03 0.00 0.00 46.19 43.44 3fpv s LEU 154 CO 0.47 -0.47 0.00 0.61 0.23 0.00 0.00 176.35 177.19 3fpv n GLY 155 N -1.79 -2.87 0.00 -3.19 0.00 -1.26 -5.03 105.19 91.05 3fpv n GLY 155 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3fpv n GLY 155 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93