#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1va9 s SER 2 N 0.00 -0.52 -0.28 1.61 1.04 -1.26 -5.18 113.70 109.12 1va9 s SER 2 Ca 0.00 0.15 -0.26 0.00 0.48 0.00 0.00 55.95 56.33 1va9 s SER 2 Cb 0.00 0.51 0.16 0.00 0.10 0.00 0.00 66.02 66.79 1va9 s SER 2 CO 0.00 -0.77 1.25 -0.94 0.98 0.00 0.00 173.24 173.76 1va9 s SER 3 N -2.29 -0.22 0.00 7.02 1.04 -1.26 -5.19 113.70 112.80 1va9 s SER 3 Ca -0.00 0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.83 1va9 s SER 3 Cb -0.01 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.51 1va9 s SER 3 CO -0.07 -0.09 0.00 0.61 0.98 0.00 0.00 173.24 174.67 1va9 n GLY 4 N 1.68 4.60 3.03 7.32 0.00 -1.26 -5.17 105.19 115.38 1va9 n GLY 4 Ca -0.10 -1.80 -0.15 0.00 0.00 0.00 0.00 46.02 43.97 1va9 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1va9 s SER 5 N -0.50 0.84 0.28 1.61 0.15 -1.26 -5.16 113.70 109.65 1va9 s SER 5 Ca 0.00 -0.36 0.07 0.00 0.70 0.00 0.00 55.95 56.36 1va9 s SER 5 Cb 0.00 -0.02 -0.06 0.00 -1.71 0.00 0.00 66.02 64.23 1va9 s SER 5 CO 0.00 -0.08 -0.07 -0.44 1.20 0.00 0.00 173.24 173.86 1va9 s SER 6 N -0.96 2.81 0.37 5.45 0.01 -1.26 -5.08 113.70 115.03 1va9 s SER 6 Ca -0.04 -1.18 0.00 0.00 1.31 0.00 0.00 55.95 56.04 1va9 s SER 6 Cb -0.07 -0.18 0.00 0.00 0.21 0.00 0.00 66.02 65.99 1va9 s SER 6 CO 0.00 -0.32 0.00 0.61 0.41 0.00 0.00 173.24 173.95 1va9 n GLY 7 N -0.58 -2.00 3.48 3.44 0.00 -1.26 -4.71 105.19 103.57 1va9 n GLY 7 Ca -0.06 -1.00 -0.38 0.00 0.00 0.00 0.00 46.02 44.59 1va9 n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1va9 s ILE 8 N -2.62 4.68 -0.30 -0.61 1.01 -1.26 -5.02 121.20 117.08 1va9 s ILE 8 Ca 0.00 -0.15 -0.19 0.00 0.00 0.00 0.00 60.65 60.31 1va9 s ILE 8 Cb 0.00 -3.26 0.18 0.00 0.01 0.00 0.00 42.46 39.39 1va9 s ILE 8 CO 0.00 0.23 1.28 -0.94 0.00 0.00 0.00 174.94 175.51 1va9 s SER 9 N 1.66 -0.04 -0.02 3.58 1.04 -1.26 -5.01 113.70 113.64 1va9 s SER 9 Ca 0.06 0.04 0.09 0.00 0.48 0.00 0.00 55.95 56.62 1va9 s SER 9 Cb -0.16 1.04 0.30 0.00 0.10 0.00 0.00 66.02 67.30 1va9 s SER 9 CO 0.06 -0.01 1.20 0.41 0.98 0.00 0.00 173.24 175.88 1va9 n THR 10 N 5.05 0.58 -3.53 2.02 -1.04 -1.26 -4.79 114.28 111.31 1va9 n THR 10 Ca -0.08 -0.46 0.03 0.00 -2.04 0.00 0.00 64.05 61.50 1va9 n THR 10 Cb 0.55 0.09 -0.06 0.00 -1.82 0.00 0.00 70.33 69.10 1va9 n THR 10 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 1va9 s GLU 11 N -1.61 0.02 0.35 -2.82 -1.05 -1.26 -5.18 118.70 107.15 1va9 s GLU 11 Ca 0.22 0.04 0.05 0.00 -0.15 0.00 0.00 54.97 55.12 1va9 s GLU 11 Cb 0.13 0.01 0.05 0.00 -0.44 0.00 0.00 34.13 33.87 1va9 s GLU 11 CO 0.13 -0.00 0.39 0.39 0.95 0.00 0.00 175.26 177.12 1va9 n GLU 12 N 3.39 0.86 -3.68 -4.83 1.02 -1.26 -5.06 120.64 111.09 1va9 n GLU 12 Ca -0.14 -2.03 -0.14 0.00 -0.02 0.00 0.00 57.16 54.82 1va9 n GLU 12 Cb 0.56 0.02 -0.08 0.00 -0.02 0.00 0.00 31.44 31.92 1va9 n GLU 12 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1va9 s ALA 13 N -2.46 -1.25 0.69 0.62 0.00 -1.25 -4.85 121.76 113.26 1va9 s ALA 13 Ca 0.30 1.13 -0.17 0.00 0.00 0.00 0.00 51.96 53.22 1va9 s ALA 13 Cb -0.02 -0.43 -0.11 0.00 0.00 0.00 0.00 23.12 22.56 1va9 s ALA 13 CO 0.19 -0.27 0.02 0.00 0.00 0.00 0.00 175.76 175.69 1va9 n ALA 14 N 2.01 -2.88 -1.78 0.00 0.00 -1.26 -4.67 120.51 111.93 1va9 n ALA 14 Ca -0.17 -0.24 -0.34 0.00 0.00 0.00 0.00 53.44 52.69 1va9 n ALA 14 Cb 0.56 -1.54 -0.03 0.00 0.00 0.00 0.00 19.45 18.45 1va9 n ALA 14 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1va9 s PRO 15 N -1.91 3.73 -0.57 0.00 0.04 -1.26 -4.79 135.00 130.24 1va9 s PRO 15 Ca 0.57 1.32 0.05 0.00 0.04 0.00 0.00 61.00 62.98 1va9 s PRO 15 Cb -0.38 -2.09 0.34 0.00 0.04 0.00 0.00 34.50 32.42 1va9 s PRO 15 CO 0.66 -0.49 0.96 -0.25 0.04 0.00 0.00 177.00 177.92 1va9 n ASP 16 N -1.16 4.46 0.00 6.66 8.00 -1.26 -4.23 116.55 129.02 1va9 n ASP 16 Ca 0.09 -3.68 0.00 0.00 0.71 0.00 0.00 54.79 51.91 1va9 n ASP 16 Cb 0.53 -0.56 0.00 0.00 -0.02 0.00 0.00 41.12 41.07 1va9 n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1va9 n GLY 17 N -0.26 3.01 3.80 0.44 0.00 -1.26 -4.75 105.19 106.17 1va9 n GLY 17 Ca 0.31 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1va9 n GLY 17 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1va9 s PRO 18 N -1.20 1.84 0.90 1.61 0.04 -1.26 -4.66 135.00 132.28 1va9 s PRO 18 Ca 0.00 0.55 -0.12 0.00 0.04 0.00 0.00 61.00 61.47 1va9 s PRO 18 Cb 0.00 -1.90 0.13 0.00 0.04 0.00 0.00 34.50 32.77 1va9 s PRO 18 CO 0.00 -1.77 1.13 -1.25 0.04 0.00 0.00 177.00 175.15 1va9 s PRO 19 N -5.19 1.22 0.52 0.56 0.04 -1.26 -4.36 135.00 126.53 1va9 s PRO 19 Ca 0.62 0.32 0.07 0.00 0.04 0.00 0.00 61.00 62.05 1va9 s PRO 19 Cb -0.14 -1.85 0.04 0.00 0.04 0.00 0.00 34.50 32.59 1va9 s PRO 19 CO 0.54 -2.15 0.48 -1.64 0.04 0.00 0.00 177.00 174.27 1va9 s MET 20 N -5.27 2.33 -1.00 4.56 -1.94 0.81 -4.51 119.30 114.29 1va9 s MET 20 Ca 0.64 -1.83 0.00 0.00 -1.71 0.00 0.00 55.69 52.79 1va9 s MET 20 Cb -0.15 -2.28 0.00 0.00 2.01 0.00 0.00 34.83 34.41 1va9 s MET 20 CO 0.53 -0.57 0.00 -3.47 -0.01 0.00 0.00 175.02 171.50 1va9 n ASP 21 N -1.82 -3.29 -4.59 3.03 2.03 -1.26 0.20 116.55 110.85 1va9 n ASP 21 Ca 0.03 0.25 -0.42 0.00 0.52 0.00 0.00 54.79 55.17 1va9 n ASP 21 Cb 0.63 -2.92 -0.03 0.00 -0.72 0.00 0.00 41.12 38.08 1va9 n ASP 21 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1va9 s VAL 22 N -2.32 3.65 0.18 5.18 1.01 -1.25 -3.29 120.40 123.58 1va9 s VAL 22 Ca 0.00 0.61 -0.14 0.00 0.00 0.00 0.00 61.98 62.44 1va9 s VAL 22 Cb 0.00 -4.04 0.01 0.00 0.00 0.00 0.00 36.38 32.35 1va9 s VAL 22 CO 0.00 -0.77 0.44 0.28 0.00 0.00 0.00 175.10 175.04 1va9 s THR 23 N 6.64 0.04 0.31 3.92 -1.32 -0.77 -5.03 115.64 119.43 1va9 s THR 23 Ca 0.66 -1.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.24 1va9 s THR 23 Cb -0.15 -1.67 -0.05 0.00 -1.51 0.00 0.00 72.50 69.11 1va9 s THR 23 CO 0.29 -0.19 -0.09 -0.76 -2.21 0.00 0.00 174.62 171.67 1va9 s LEU 24 N -2.91 2.83 -0.30 9.08 1.43 -1.26 -2.41 118.68 125.14 1va9 s LEU 24 Ca 0.12 -0.98 -0.12 0.00 -1.03 0.00 0.00 54.13 52.12 1va9 s LEU 24 Cb 0.01 -1.26 0.16 0.00 0.03 0.00 0.00 46.19 45.13 1va9 s LEU 24 CO -0.02 -0.09 0.88 -1.58 0.23 0.00 0.00 176.35 175.77 1va9 s GLN 25 N -3.61 0.38 -0.17 1.70 0.74 -0.51 -4.95 119.66 113.22 1va9 s GLN 25 Ca 0.32 0.88 -0.29 0.00 0.05 0.00 0.00 55.36 56.32 1va9 s GLN 25 Cb -0.03 0.53 -0.01 0.00 1.10 0.00 0.00 33.01 34.60 1va9 s GLN 25 CO 0.17 -0.19 1.28 -1.25 -0.55 0.00 0.00 175.29 174.75 1va9 s PRO 26 N 2.66 4.20 -0.20 1.67 0.04 -1.26 0.20 135.00 142.31 1va9 s PRO 26 Ca -0.01 1.64 0.11 0.00 0.04 0.00 0.00 61.00 62.79 1va9 s PRO 26 Cb -0.09 -3.78 -0.20 0.00 0.04 0.00 0.00 34.50 30.47 1va9 s PRO 26 CO -0.17 -0.75 -0.03 1.33 0.04 0.00 0.00 177.00 177.42 1va9 n VAL 27 N 5.46 1.27 -2.07 -0.36 0.24 -1.19 -4.87 118.33 116.82 1va9 n VAL 27 Ca 0.14 -0.68 0.00 0.00 -2.04 0.00 0.00 64.34 61.76 1va9 n VAL 27 Cb 0.45 -0.79 0.00 0.00 -1.47 0.00 0.00 33.84 32.03 1va9 n VAL 27 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1va9 n THR 28 N -2.84 0.00 -0.02 3.34 -2.24 -1.06 -5.05 114.28 106.42 1va9 n THR 28 Ca -0.33 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.48 1va9 n THR 28 Cb 1.04 -0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 69.17 1va9 n THR 28 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1va9 n SER 29 N 0.00 2.32 -0.75 3.42 3.41 -1.26 -3.57 113.62 117.18 1va9 n SER 29 Ca 0.00 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.65 1va9 n SER 29 Cb 0.00 1.36 0.08 0.00 -0.26 0.00 0.00 64.21 65.39 1va9 n SER 29 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1va9 n GLN 30 N -2.02 0.58 -3.70 4.33 6.02 -1.26 -3.97 117.38 117.35 1va9 n GLN 30 Ca -0.06 -2.10 -0.14 0.00 -0.01 0.00 0.00 57.00 54.70 1va9 n GLN 30 Cb 0.43 -0.77 -0.09 0.00 1.02 0.00 0.00 30.24 30.83 1va9 n GLN 30 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1va9 s SER 31 N -2.14 -0.43 0.21 1.08 0.01 -1.26 -0.80 113.70 110.38 1va9 s SER 31 Ca 0.25 0.69 0.08 0.00 1.31 0.00 0.00 55.95 58.28 1va9 s SER 31 Cb 0.25 0.73 -0.05 0.00 0.21 0.00 0.00 66.02 67.17 1va9 s SER 31 CO -0.06 -0.29 -0.14 -0.63 0.41 0.00 0.00 173.24 172.53 1va9 s ILE 32 N -0.32 1.76 -0.30 1.44 1.01 0.37 -2.55 121.20 122.60 1va9 s ILE 32 Ca -0.05 -2.22 -0.06 0.00 0.00 0.00 0.00 60.65 58.32 1va9 s ILE 32 Cb -0.03 -2.09 0.02 0.00 0.01 0.00 0.00 42.46 40.36 1va9 s ILE 32 CO 0.03 -0.56 0.08 -1.58 0.00 0.00 0.00 174.94 172.90 1va9 s GLN 33 N -3.65 2.96 -0.36 2.79 0.74 0.53 -1.24 119.66 121.43 1va9 s GLN 33 Ca 0.23 -0.94 -0.12 0.00 0.05 0.00 0.00 55.36 54.58 1va9 s GLN 33 Cb -0.01 -3.38 0.01 0.00 1.10 0.00 0.00 33.01 30.74 1va9 s GLN 33 CO 0.08 -0.50 0.23 0.08 -0.55 0.00 0.00 175.29 174.62 1va9 s VAL 34 N 1.47 4.89 0.00 1.34 1.01 -0.63 -1.42 120.40 127.05 1va9 s VAL 34 Ca 0.01 -0.60 0.06 0.00 0.00 0.00 0.00 61.98 61.45 1va9 s VAL 34 Cb -0.18 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 1va9 s VAL 34 CO 0.02 -0.15 -0.16 0.42 0.00 0.00 0.00 175.10 175.23 1va9 s THR 35 N 1.63 2.92 0.20 3.92 -4.23 -1.01 -0.72 115.64 118.34 1va9 s THR 35 Ca 0.04 -0.98 -0.18 0.00 -1.18 0.00 0.00 61.69 59.39 1va9 s THR 35 Cb -0.18 -2.19 0.03 0.00 1.34 0.00 0.00 72.50 71.49 1va9 s THR 35 CO 0.08 0.45 0.53 -1.66 -0.54 0.00 0.00 174.62 173.48 1va9 s TRP 36 N -0.85 -0.13 0.14 3.99 -2.14 -0.71 -1.86 118.94 117.39 1va9 s TRP 36 Ca 0.14 -0.21 0.08 0.00 2.66 0.00 0.00 56.10 58.77 1va9 s TRP 36 Cb -0.11 0.40 -0.04 0.00 -3.10 0.00 0.00 33.47 30.63 1va9 s TRP 36 CO 0.03 -0.92 -0.19 0.15 -2.66 0.00 0.00 176.95 173.37 1va9 s LYS 37 N -3.87 1.21 0.27 3.25 1.02 0.52 -1.79 119.74 120.35 1va9 s LYS 37 Ca 0.09 -1.32 -0.26 0.00 0.02 0.00 0.00 55.97 54.50 1va9 s LYS 37 Cb -0.01 -1.33 -0.16 0.00 -0.52 0.00 0.00 37.83 35.81 1va9 s LYS 37 CO -0.03 0.28 0.38 0.00 -0.92 0.00 0.00 175.35 175.06 1va9 n ALA 38 N 0.55 -2.87 -1.55 5.17 0.00 0.37 -0.13 120.51 122.05 1va9 n ALA 38 Ca -0.15 0.32 -0.29 0.00 0.00 0.00 0.00 53.44 53.32 1va9 n ALA 38 Cb 0.56 -1.57 0.12 0.00 0.00 0.00 0.00 19.45 18.56 1va9 n ALA 38 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1va9 s PRO 39 N -1.01 1.41 0.03 0.00 0.04 -1.26 -3.99 135.00 130.21 1va9 s PRO 39 Ca 0.62 0.38 -0.38 0.00 0.04 0.00 0.00 61.00 61.66 1va9 s PRO 39 Cb -0.82 -1.86 -0.19 0.00 0.04 0.00 0.00 34.50 31.66 1va9 s PRO 39 CO 0.58 -2.03 1.03 1.63 0.04 0.00 0.00 177.00 178.25 1va9 n LYS 40 N -3.67 0.08 -0.20 4.56 4.01 -1.26 -4.77 118.16 116.91 1va9 n LYS 40 Ca 0.07 0.03 0.01 0.00 -0.51 0.00 0.00 58.31 57.90 1va9 n LYS 40 Cb 0.58 -1.48 0.10 0.00 -0.51 0.00 0.00 35.03 33.72 1va9 n LYS 40 CO 0.00 0.00 0.00 -0.22 -1.11 0.00 0.00 177.40 176.07 1va9 h LYS 41 N 2.88 0.19 0.00 1.97 3.64 -2.00 0.80 116.57 124.05 1va9 h LYS 41 Ca -0.48 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 58.87 1va9 h LYS 41 Cb 1.42 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 33.20 1va9 h LYS 41 CO 0.65 0.13 -0.08 1.05 -2.27 0.00 0.00 179.45 178.93 1va9 h GLU 42 N 0.20 0.00 -1.95 1.90 4.11 -2.01 -2.81 114.58 114.02 1va9 h GLU 42 Ca 0.31 0.00 -0.72 0.00 0.07 0.00 0.00 59.36 59.03 1va9 h GLU 42 Cb 0.49 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 29.42 1va9 h GLU 42 CO -0.45 0.08 0.47 1.28 0.07 0.00 0.00 179.01 180.46 1va9 n LEU 43 N -3.36 6.54 0.00 3.06 4.77 0.27 -4.47 117.00 123.81 1va9 n LEU 43 Ca -0.01 -5.10 0.00 0.00 -0.03 0.00 0.00 56.01 50.87 1va9 n LEU 43 Cb 0.25 -0.89 0.00 0.00 -2.33 0.00 0.00 43.42 40.45 1va9 n LEU 43 CO 0.28 1.98 -0.46 0.00 -1.33 0.00 0.00 177.39 177.86 1va9 n GLN 44 N -0.42 0.00 -3.16 3.23 6.02 -1.01 -4.29 117.38 117.76 1va9 n GLN 44 Ca 0.47 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 57.35 1va9 n GLN 44 Cb 0.36 -0.58 0.05 0.00 1.02 0.00 0.00 30.24 31.09 1va9 n GLN 44 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1va9 n ASN 45 N -2.82 -6.79 0.00 1.08 3.02 -1.26 -4.26 115.26 104.22 1va9 n ASN 45 Ca 0.00 -0.54 0.00 0.00 -0.03 0.00 0.00 54.58 54.01 1va9 n ASN 45 Cb 0.46 -5.11 0.00 0.00 -0.61 0.00 0.00 39.78 34.52 1va9 n ASN 45 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1va9 n GLY 46 N -1.36 -1.14 3.34 7.41 0.00 -1.26 -3.90 105.19 108.28 1va9 n GLY 46 Ca -0.05 -1.62 -0.33 0.00 0.00 0.00 0.00 46.02 44.02 1va9 n GLY 46 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1va9 n VAL 47 N -1.25 0.00 -4.89 1.61 0.31 -1.26 -4.99 118.33 107.85 1va9 n VAL 47 Ca 0.00 -0.25 -0.33 0.00 -0.01 0.00 0.00 64.34 63.75 1va9 n VAL 47 Cb 0.00 -0.61 -0.14 0.00 -0.91 0.00 0.00 33.84 32.17 1va9 n VAL 47 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1va9 s ILE 48 N -2.31 2.89 0.09 2.52 -1.09 -1.26 -4.90 121.20 117.14 1va9 s ILE 48 Ca 0.56 -0.74 0.07 0.00 -2.23 0.00 0.00 60.65 58.31 1va9 s ILE 48 Cb -0.16 -2.17 -0.22 0.00 -1.58 0.00 0.00 42.46 38.33 1va9 s ILE 48 CO 0.67 0.55 1.17 0.03 -1.23 0.00 0.00 174.94 176.13 1va9 h ARG 49 N 6.25 0.01 0.00 2.79 2.47 -1.91 -3.43 114.38 120.57 1va9 h ARG 49 Ca -0.32 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.38 1va9 h ARG 49 Cb 1.19 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 1va9 h ARG 49 CO 0.53 0.93 0.00 0.41 0.56 0.00 0.00 179.97 182.40 1va9 n GLY 50 N 1.39 -0.88 3.02 0.04 0.00 -0.44 -2.79 105.19 105.53 1va9 n GLY 50 Ca -0.03 -1.12 -0.20 0.00 0.00 0.00 0.00 46.02 44.67 1va9 n GLY 50 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1va9 s TYR 51 N -2.00 0.94 0.23 1.61 1.51 -1.26 0.12 117.35 118.50 1va9 s TYR 51 Ca 0.00 -0.21 -0.21 0.00 -1.01 0.00 0.00 57.07 55.65 1va9 s TYR 51 Cb 0.00 -0.64 -0.08 0.00 -0.11 0.00 0.00 41.96 41.13 1va9 s TYR 51 CO 0.00 -0.06 0.75 -0.65 -1.11 0.00 0.00 175.55 174.48 1va9 s GLN 52 N -0.03 4.31 -0.39 -0.62 -0.21 -0.07 -4.13 119.66 118.51 1va9 s GLN 52 Ca 0.00 0.94 0.02 0.00 0.02 0.00 0.00 55.36 56.34 1va9 s GLN 52 Cb -0.06 -2.90 0.12 0.00 1.00 0.00 0.00 33.01 31.17 1va9 s GLN 52 CO 0.00 0.39 0.16 0.42 -2.12 0.00 0.00 175.29 174.14 1va9 s ILE 53 N -1.51 1.67 -0.23 1.08 1.09 -1.18 -2.20 121.20 119.93 1va9 s ILE 53 Ca 0.43 -2.31 -0.17 0.00 -1.10 0.00 0.00 60.65 57.50 1va9 s ILE 53 Cb -0.17 -2.20 -0.03 0.00 -1.06 0.00 0.00 42.46 38.99 1va9 s ILE 53 CO 0.22 -0.75 0.48 -0.83 -0.10 0.00 0.00 174.94 173.96 1va9 s GLY 54 N 0.73 1.98 0.01 6.18 0.00 -0.41 -3.26 107.32 112.55 1va9 s GLY 54 Ca 0.14 -0.54 0.04 0.00 0.00 0.00 0.00 44.72 44.36 1va9 s GLY 54 CO -0.09 1.06 -0.11 -2.52 0.00 0.00 0.00 173.10 171.44 1va9 s TYR 55 N 1.83 1.01 -0.10 1.90 1.13 -1.04 0.75 117.35 122.84 1va9 s TYR 55 Ca 0.21 -0.25 -0.24 0.00 -1.41 0.00 0.00 57.07 55.38 1va9 s TYR 55 Cb -0.15 -0.63 0.06 0.00 -1.10 0.00 0.00 41.96 40.13 1va9 s TYR 55 CO 0.09 -0.01 0.57 -0.98 -2.51 0.00 0.00 175.55 172.71 1va9 s ARG 56 N -0.58 0.86 0.09 -3.49 1.70 -1.06 -1.72 118.95 114.75 1va9 s ARG 56 Ca 0.03 0.33 -0.37 0.00 -0.47 0.00 0.00 55.73 55.25 1va9 s ARG 56 Cb -0.06 0.40 -0.17 0.00 -0.57 0.00 0.00 34.95 34.56 1va9 s ARG 56 CO 0.00 -0.22 1.33 -1.91 -1.08 0.00 0.00 175.30 173.42 1va9 n GLU 57 N 1.57 1.14 -1.25 3.89 2.13 -1.26 -2.35 120.64 124.51 1va9 n GLU 57 Ca -0.18 0.41 -0.25 0.00 0.66 0.00 0.00 57.16 57.80 1va9 n GLU 57 Cb 0.56 -2.05 0.01 0.00 0.27 0.00 0.00 31.44 30.24 1va9 n GLU 57 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1va9 n ASN 58 N 2.49 6.76 -4.88 4.31 2.85 -0.53 -4.75 115.26 121.52 1va9 n ASN 58 Ca 0.18 -3.29 -0.30 0.00 -0.11 0.00 0.00 54.58 51.06 1va9 n ASN 58 Cb 0.19 -1.11 -0.02 0.00 1.24 0.00 0.00 39.78 40.08 1va9 n ASN 58 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1va9 s SER 59 N -0.18 6.47 -0.70 1.20 1.04 -1.26 -4.82 113.70 115.45 1va9 s SER 59 Ca 0.48 1.17 -0.27 0.00 0.48 0.00 0.00 55.95 57.82 1va9 s SER 59 Cb 0.35 -2.34 0.01 0.00 0.10 0.00 0.00 66.02 64.13 1va9 s SER 59 CO -0.11 -0.49 1.57 -2.16 0.98 0.00 0.00 173.24 173.03 1va9 s PRO 60 N -4.12 2.93 0.00 4.02 0.04 -1.26 -3.00 135.00 133.61 1va9 s PRO 60 Ca 0.52 0.12 0.00 0.00 0.04 0.00 0.00 61.00 61.68 1va9 s PRO 60 Cb -0.10 -4.34 0.00 0.00 0.04 0.00 0.00 34.50 30.10 1va9 s PRO 60 CO 0.35 -2.45 0.00 0.41 0.04 0.00 0.00 177.00 175.35 1va9 n GLY 61 N 5.62 0.76 3.83 0.56 0.00 -1.26 -5.09 105.19 109.60 1va9 n GLY 61 Ca 0.13 -0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1va9 n GLY 61 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1va9 s SER 62 N -1.74 6.94 -0.48 1.61 1.04 -1.16 -5.03 113.70 114.88 1va9 s SER 62 Ca 0.00 1.22 0.07 0.00 0.48 0.00 0.00 55.95 57.72 1va9 s SER 62 Cb 0.00 -2.34 0.24 0.00 0.10 0.00 0.00 66.02 64.02 1va9 s SER 62 CO 0.00 0.12 0.57 0.59 0.98 0.00 0.00 173.24 175.50 1va9 n ASN 63 N 0.96 1.27 -3.48 7.02 3.02 -1.26 -5.02 115.26 117.77 1va9 n ASN 63 Ca -0.05 -2.91 -0.25 0.00 -0.03 0.00 0.00 54.58 51.34 1va9 n ASN 63 Cb 0.51 -0.65 -0.13 0.00 -0.61 0.00 0.00 39.78 38.91 1va9 n ASN 63 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1va9 s GLY 64 N -1.48 0.31 -0.06 7.41 0.00 -1.26 -5.11 107.32 107.12 1va9 s GLY 64 Ca 0.36 -0.93 -0.36 0.00 0.00 0.00 0.00 44.72 43.79 1va9 s GLY 64 CO -0.09 2.28 1.02 -1.06 0.00 0.00 0.00 173.10 175.25 1va9 n GLN 65 N 5.10 0.00 -1.68 2.90 3.00 -1.26 -4.63 117.38 120.81 1va9 n GLN 65 Ca -0.02 0.00 -0.58 0.00 -0.01 0.00 0.00 57.00 56.39 1va9 n GLN 65 Cb 0.43 -1.33 -0.08 0.00 0.00 0.00 0.00 30.24 29.26 1va9 n GLN 65 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1va9 n TYR 66 N 1.65 1.97 -1.95 1.08 4.02 -1.26 -4.80 117.16 117.87 1va9 n TYR 66 Ca 0.19 0.57 -0.41 0.00 -0.01 0.00 0.00 57.90 58.25 1va9 n TYR 66 Cb 0.05 -2.44 -0.03 0.00 -0.02 0.00 0.00 39.34 36.90 1va9 n TYR 66 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1va9 s SER 67 N 3.90 5.53 0.21 7.72 0.01 -0.70 -4.71 113.70 125.66 1va9 s SER 67 Ca 1.01 1.00 -0.23 0.00 1.31 0.00 0.00 55.95 59.03 1va9 s SER 67 Cb -1.11 -2.52 -0.08 0.00 0.21 0.00 0.00 66.02 62.51 1va9 s SER 67 CO 0.66 -2.05 0.79 -0.63 0.41 0.00 0.00 173.24 172.42 1va9 s ILE 68 N 8.19 4.41 -0.13 1.44 -1.09 -1.26 -2.48 121.20 130.28 1va9 s ILE 68 Ca 0.78 1.57 -0.02 0.00 -2.23 0.00 0.00 60.65 60.76 1va9 s ILE 68 Cb -0.19 -4.02 0.04 0.00 -1.58 0.00 0.00 42.46 36.72 1va9 s ILE 68 CO 0.29 0.34 0.02 0.68 -1.23 0.00 0.00 174.94 175.04 1va9 s VAL 69 N -1.37 0.43 0.22 2.92 -7.23 -1.20 -4.96 120.40 109.22 1va9 s VAL 69 Ca 0.41 -0.20 -0.30 0.00 -1.81 0.00 0.00 61.98 60.08 1va9 s VAL 69 Cb -0.20 -0.77 -0.09 0.00 0.56 0.00 0.00 36.38 35.89 1va9 s VAL 69 CO 0.24 0.03 0.93 -0.70 -0.31 0.00 0.00 175.10 175.29 1va9 s GLU 70 N 1.93 4.82 0.36 4.82 2.12 -1.26 -3.08 118.70 128.41 1va9 s GLU 70 Ca 0.02 1.46 0.01 0.00 0.36 0.00 0.00 54.97 56.82 1va9 s GLU 70 Cb -0.15 -3.29 -0.00 0.00 0.26 0.00 0.00 34.13 30.96 1va9 s GLU 70 CO -0.07 0.50 0.45 0.00 -0.54 0.00 0.00 175.26 175.60 1va9 s MET 71 N -1.09 1.95 0.16 4.30 0.23 -1.26 -5.06 119.30 118.53 1va9 s MET 71 Ca 0.41 -1.87 0.09 0.00 -1.03 0.00 0.00 55.69 53.29 1va9 s MET 71 Cb -0.26 0.42 -0.04 0.00 -1.53 0.00 0.00 34.83 33.43 1va9 s MET 71 CO 0.31 -0.80 -0.14 -1.59 -2.03 0.00 0.00 175.02 170.77 1va9 s LYS 72 N -2.99 1.89 -0.21 3.16 -2.85 -1.26 -4.17 119.74 113.31 1va9 s LYS 72 Ca 0.33 -1.26 -0.27 0.00 -1.00 0.00 0.00 55.97 53.77 1va9 s LYS 72 Cb -0.00 -2.11 -0.00 0.00 -2.06 0.00 0.00 37.83 33.66 1va9 s LYS 72 CO 0.24 0.45 0.93 0.00 0.10 0.00 0.00 175.35 177.07 1va9 s ALA 73 N -1.49 3.62 -1.14 0.59 0.00 -1.12 -4.84 121.76 117.39 1va9 s ALA 73 Ca 0.22 0.07 0.16 0.00 0.00 0.00 0.00 51.96 52.41 1va9 s ALA 73 Cb -0.09 -3.40 0.67 0.00 0.00 0.00 0.00 23.12 20.30 1va9 s ALA 73 CO 0.13 -0.90 1.56 0.25 0.00 0.00 0.00 175.76 176.80 1va9 n THR 74 N 5.12 1.72 -0.68 0.00 -2.24 -1.26 -5.01 114.28 111.94 1va9 n THR 74 Ca 0.08 -1.09 0.00 0.00 -2.27 0.00 0.00 64.05 60.78 1va9 n THR 74 Cb 0.47 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 1va9 n THR 74 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1va9 n GLY 75 N 1.05 0.72 0.17 3.38 0.00 -1.26 -4.85 105.19 104.39 1va9 n GLY 75 Ca 0.24 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.52 1va9 n GLY 75 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1va9 h ASP 76 N 0.00 0.04 -3.56 1.61 3.32 -1.98 -3.43 116.42 112.43 1va9 h ASP 76 Ca 0.00 -0.02 -0.68 0.00 0.02 0.00 0.00 57.03 56.35 1va9 h ASP 76 Cb 0.00 -0.01 -0.19 0.00 0.22 0.00 0.00 39.33 39.35 1va9 h ASP 76 CO 0.00 0.51 -0.68 -0.94 -1.72 0.00 0.00 179.24 176.41 1va9 s SER 77 N -6.89 4.71 0.09 6.45 1.04 -1.26 0.14 113.70 117.97 1va9 s SER 77 Ca -0.02 -0.03 0.02 0.00 0.48 0.00 0.00 55.95 56.39 1va9 s SER 77 Cb 0.14 -1.31 -0.04 0.00 0.10 0.00 0.00 66.02 64.90 1va9 s SER 77 CO 0.75 0.33 -0.07 -1.61 0.98 0.00 0.00 173.24 173.61 1va9 s GLU 78 N -0.59 0.76 0.02 4.02 8.01 -0.74 -4.53 118.70 125.65 1va9 s GLU 78 Ca 0.09 -1.18 -0.15 0.00 0.01 0.00 0.00 54.97 53.74 1va9 s GLU 78 Cb -0.12 -0.26 0.02 0.00 -4.31 0.00 0.00 34.13 29.47 1va9 s GLU 78 CO 0.02 0.01 0.32 0.54 0.01 0.00 0.00 175.26 176.16 1va9 s VAL 79 N -2.98 0.07 -0.10 2.63 0.11 -1.26 -1.74 120.40 117.13 1va9 s VAL 79 Ca 0.06 -0.56 -0.04 0.00 -2.93 0.00 0.00 61.98 58.51 1va9 s VAL 79 Cb 0.01 -0.81 0.05 0.00 -1.53 0.00 0.00 36.38 34.11 1va9 s VAL 79 CO -0.03 -0.31 0.21 -0.47 -3.33 0.00 0.00 175.10 171.17 1va9 s TYR 80 N -2.00 -0.29 -0.85 1.54 6.14 0.10 -4.99 117.35 117.00 1va9 s TYR 80 Ca -0.09 0.75 -0.21 0.00 0.64 0.00 0.00 57.07 58.16 1va9 s TYR 80 Cb -0.03 -0.11 0.10 0.00 0.42 0.00 0.00 41.96 42.34 1va9 s TYR 80 CO 0.00 -0.28 1.12 0.99 0.64 0.00 0.00 175.55 178.02 1va9 s THR 81 N 2.03 4.46 -0.50 4.34 2.01 -1.26 -1.60 115.64 125.11 1va9 s THR 81 Ca -0.01 -1.02 -0.28 0.00 0.31 0.00 0.00 61.69 60.69 1va9 s THR 81 Cb -0.12 -4.79 0.01 0.00 0.01 0.00 0.00 72.50 67.62 1va9 s THR 81 CO -0.07 -1.56 1.43 -0.76 -0.69 0.00 0.00 174.62 172.97 1va9 s LEU 82 N 3.52 3.47 0.00 4.42 1.43 -0.37 -4.84 118.68 126.31 1va9 s LEU 82 Ca 0.31 0.51 0.01 0.00 -1.03 0.00 0.00 54.13 53.92 1va9 s LEU 82 Cb -0.08 -3.24 0.01 0.00 0.03 0.00 0.00 46.19 42.91 1va9 s LEU 82 CO -0.02 -1.62 0.04 -0.67 0.23 0.00 0.00 176.35 174.31 1va9 n ASP 83 N 9.39 0.45 -3.13 2.29 -0.08 -1.26 -0.48 116.55 123.73 1va9 n ASP 83 Ca 0.14 -1.11 -0.15 0.00 -1.51 0.00 0.00 54.79 52.17 1va9 n ASP 83 Cb 0.49 -0.02 0.07 0.00 2.34 0.00 0.00 41.12 44.00 1va9 n ASP 83 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1va9 n ASN 84 N -2.65 -3.27 -1.92 1.67 3.02 -0.31 -4.88 115.26 106.92 1va9 n ASN 84 Ca 0.01 -0.58 0.00 0.00 -0.03 0.00 0.00 54.58 53.98 1va9 n ASN 84 Cb 0.04 -4.65 0.00 0.00 -0.61 0.00 0.00 39.78 34.56 1va9 n ASN 84 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1va9 n LEU 85 N -3.56 0.00 -5.01 3.41 4.77 0.02 -5.03 117.00 111.60 1va9 n LEU 85 Ca -0.20 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.60 1va9 n LEU 85 Cb 0.64 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.76 1va9 n LEU 85 CO 0.54 -0.10 0.25 -0.54 -1.33 0.00 0.00 177.39 176.20 1va9 s LYS 86 N -1.87 2.61 -0.25 3.23 -0.14 -1.26 -4.73 119.74 117.33 1va9 s LYS 86 Ca 0.00 -1.25 -0.09 0.00 -1.36 0.00 0.00 55.97 53.27 1va9 s LYS 86 Cb 0.00 -2.67 -0.04 0.00 -1.68 0.00 0.00 37.83 33.44 1va9 s LYS 86 CO 0.00 -0.53 0.12 0.15 -0.76 0.00 0.00 175.35 174.34 1va9 s LYS 87 N -4.52 3.88 -1.00 1.68 1.02 -1.26 -4.31 119.74 115.24 1va9 s LYS 87 Ca 0.57 -0.36 -0.07 0.00 0.02 0.00 0.00 55.97 56.13 1va9 s LYS 87 Cb -0.09 -3.45 -0.04 0.00 -0.52 0.00 0.00 37.83 33.72 1va9 s LYS 87 CO 0.36 -0.06 0.85 0.34 -0.92 0.00 0.00 175.35 175.92 1va9 n PHE 88 N 4.61 -2.47 -3.76 3.18 7.35 -0.97 -4.99 117.46 120.41 1va9 n PHE 88 Ca -0.15 0.85 -0.13 0.00 -0.76 0.00 0.00 57.45 57.25 1va9 n PHE 88 Cb 0.52 -3.98 -0.10 0.00 0.35 0.00 0.00 39.48 36.26 1va9 n PHE 88 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1va9 s ALA 89 N -3.32 -0.79 0.27 3.13 0.00 -1.26 -4.92 121.76 114.89 1va9 s ALA 89 Ca 0.36 0.72 -0.29 0.00 0.00 0.00 0.00 51.96 52.75 1va9 s ALA 89 Cb -0.06 -0.34 -0.09 0.00 0.00 0.00 0.00 23.12 22.62 1va9 s ALA 89 CO 0.77 -0.19 1.03 -1.14 0.00 0.00 0.00 175.76 176.23 1va9 s GLN 90 N -0.31 4.69 -0.01 0.00 0.74 -1.26 -1.96 119.66 121.55 1va9 s GLN 90 Ca -0.04 1.65 0.00 0.00 0.05 0.00 0.00 55.36 57.02 1va9 s GLN 90 Cb -0.03 -3.17 0.02 0.00 1.10 0.00 0.00 33.01 30.92 1va9 s GLN 90 CO 0.02 0.31 0.01 0.71 -0.55 0.00 0.00 175.29 175.79 1va9 s TYR 91 N -1.22 0.05 -0.23 1.67 1.51 -1.26 -1.45 117.35 116.43 1va9 s TYR 91 Ca 0.44 0.06 -0.04 0.00 -1.01 0.00 0.00 57.07 56.52 1va9 s TYR 91 Cb -0.29 -0.16 -0.01 0.00 -0.11 0.00 0.00 41.96 41.40 1va9 s TYR 91 CO 0.36 -0.06 -0.03 0.20 -1.11 0.00 0.00 175.55 174.92 1va9 s GLY 92 N 0.62 1.63 0.20 0.71 0.00 -0.99 -2.90 107.32 106.58 1va9 s GLY 92 Ca -0.05 -1.19 0.09 0.00 0.00 0.00 0.00 44.72 43.57 1va9 s GLY 92 CO -0.02 0.45 -0.19 0.54 0.00 0.00 0.00 173.10 173.89 1va9 s VAL 93 N 1.48 2.01 0.12 1.40 0.11 -1.26 -2.55 120.40 121.71 1va9 s VAL 93 Ca 0.05 -2.08 0.07 0.00 -2.93 0.00 0.00 61.98 57.09 1va9 s VAL 93 Cb -0.15 -2.01 -0.04 0.00 -1.53 0.00 0.00 36.38 32.66 1va9 s VAL 93 CO -0.03 -0.35 -0.17 0.68 -3.33 0.00 0.00 175.10 171.91 1va9 s VAL 94 N -2.24 1.49 0.03 2.04 -7.23 0.23 -3.78 120.40 110.93 1va9 s VAL 94 Ca 0.20 -1.65 0.05 0.00 -1.81 0.00 0.00 61.98 58.78 1va9 s VAL 94 Cb -0.05 -1.53 -0.02 0.00 0.56 0.00 0.00 36.38 35.34 1va9 s VAL 94 CO 0.09 -0.28 -0.16 -0.69 -0.31 0.00 0.00 175.10 173.75 1va9 s VAL 95 N -1.75 1.27 0.04 1.32 1.01 -1.26 -1.28 120.40 119.75 1va9 s VAL 95 Ca 0.08 -0.99 -0.19 0.00 0.00 0.00 0.00 61.98 60.88 1va9 s VAL 95 Cb -0.07 -1.12 0.04 0.00 0.00 0.00 0.00 36.38 35.23 1va9 s VAL 95 CO 0.04 0.11 0.42 0.00 0.00 0.00 0.00 175.10 175.67 1va9 s GLN 96 N -1.02 0.93 -0.26 2.72 -2.07 -0.93 -1.17 119.66 117.85 1va9 s GLN 96 Ca 0.04 -0.34 -0.19 0.00 -1.82 0.00 0.00 55.36 53.05 1va9 s GLN 96 Cb -0.08 0.41 -0.02 0.00 -1.09 0.00 0.00 33.01 32.23 1va9 s GLN 96 CO 0.01 -0.32 0.57 0.00 -1.32 0.00 0.00 175.29 174.23 1va9 s ALA 97 N -2.43 3.60 -0.11 2.60 0.00 -1.26 -0.89 121.76 123.27 1va9 s ALA 97 Ca -0.06 -0.52 0.02 0.00 0.00 0.00 0.00 51.96 51.40 1va9 s ALA 97 Cb -0.01 -2.96 -0.01 0.00 0.00 0.00 0.00 23.12 20.15 1va9 s ALA 97 CO -0.02 -0.77 -0.18 -0.59 0.00 0.00 0.00 175.76 174.21 1va9 s PHE 98 N 2.39 2.70 0.47 0.00 -0.12 0.33 -1.91 117.98 121.83 1va9 s PHE 98 Ca 0.24 -0.77 0.02 0.00 -0.05 0.00 0.00 56.93 56.37 1va9 s PHE 98 Cb -0.16 -1.77 -0.02 0.00 -0.63 0.00 0.00 43.02 40.44 1va9 s PHE 98 CO 0.09 -0.27 0.06 0.54 -0.05 0.00 0.00 175.22 175.59 1va9 s ASN 99 N 0.27 3.55 0.41 1.98 2.20 0.23 -1.33 114.94 122.25 1va9 s ASN 99 Ca -0.13 -1.67 0.29 0.00 -0.94 0.00 0.00 52.86 50.41 1va9 s ASN 99 Cb -0.16 0.52 1.44 0.00 -2.00 0.00 0.00 41.25 41.04 1va9 s ASN 99 CO 0.07 -0.89 1.87 0.03 -2.94 0.00 0.00 177.10 175.24 1va9 h ARG 100 N 1.54 0.00 0.00 3.55 2.47 -1.97 0.75 114.38 120.72 1va9 h ARG 100 Ca -0.40 0.00 -0.14 0.00 -1.26 0.00 0.00 59.98 58.18 1va9 h ARG 100 Cb 1.30 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.60 1va9 h ARG 100 CO 0.66 0.00 -0.78 0.00 0.56 0.00 0.00 179.97 180.41 1va9 h ALA 101 N 2.06 0.62 0.00 0.04 0.00 -1.88 -3.50 119.26 116.60 1va9 h ALA 101 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1va9 h ALA 101 Cb 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1va9 h ALA 101 CO 0.00 0.80 0.00 0.41 0.00 0.00 0.00 179.25 180.46 1va9 n GLY 102 N 1.28 0.10 3.51 0.00 0.00 0.26 -4.12 105.19 106.21 1va9 n GLY 102 Ca -0.01 -1.60 -0.31 0.00 0.00 0.00 0.00 46.02 44.10 1va9 n GLY 102 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1va9 s THR 103 N -2.59 3.09 0.01 2.61 2.01 -1.26 0.78 115.64 120.28 1va9 s THR 103 Ca 0.00 -1.07 -0.00 0.00 0.31 0.00 0.00 61.69 60.93 1va9 s THR 103 Cb 0.00 -2.33 0.00 0.00 0.01 0.00 0.00 72.50 70.18 1va9 s THR 103 CO 0.00 0.33 0.01 0.61 -0.69 0.00 0.00 174.62 174.88 1va9 n GLY 104 N 1.47 0.59 3.81 4.40 0.00 -0.80 -4.63 105.19 110.02 1va9 n GLY 104 Ca -0.16 -1.93 -0.33 0.00 0.00 0.00 0.00 46.02 43.60 1va9 n GLY 104 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1va9 s PRO 105 N -2.46 3.52 0.55 1.61 0.04 -1.26 -4.80 135.00 132.20 1va9 s PRO 105 Ca 0.01 1.22 -0.15 0.00 0.04 0.00 0.00 61.00 62.12 1va9 s PRO 105 Cb -0.00 -2.06 -0.07 0.00 0.04 0.00 0.00 34.50 32.41 1va9 s PRO 105 CO 0.00 -0.65 1.00 -1.12 0.04 0.00 0.00 177.00 176.28 1va9 s SER 106 N -2.58 6.48 0.38 6.66 0.01 -1.26 -4.24 113.70 119.15 1va9 s SER 106 Ca 0.64 1.54 -0.11 0.00 1.31 0.00 0.00 55.95 59.33 1va9 s SER 106 Cb -0.15 -2.50 -0.07 0.00 0.21 0.00 0.00 66.02 63.51 1va9 s SER 106 CO 0.31 -0.69 0.75 -0.94 0.41 0.00 0.00 173.24 173.08 1va9 s SER 107 N -3.37 6.57 -0.45 2.44 1.04 -0.32 -4.79 113.70 114.82 1va9 s SER 107 Ca 0.58 1.13 -0.46 0.00 0.48 0.00 0.00 55.95 57.68 1va9 s SER 107 Cb -0.10 -2.32 -0.20 0.00 0.10 0.00 0.00 66.02 63.50 1va9 s SER 107 CO 0.38 -0.34 1.57 -1.20 0.98 0.00 0.00 173.24 174.62 1va9 n SER 108 N -1.07 1.19 -4.69 7.02 7.64 -1.26 -4.52 113.62 117.93 1va9 n SER 108 Ca 0.02 1.18 -0.42 0.00 1.01 0.00 0.00 58.87 60.66 1va9 n SER 108 Cb 0.54 -0.90 -0.03 0.00 -1.01 0.00 0.00 64.21 62.81 1va9 n SER 108 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1va9 s GLU 109 N 2.80 4.19 0.00 1.43 2.12 -1.26 -4.95 118.70 123.03 1va9 s GLU 109 Ca 1.03 2.37 0.00 0.00 0.36 0.00 0.00 54.97 58.74 1va9 s GLU 109 Cb -1.45 -3.58 0.00 0.00 0.26 0.00 0.00 34.13 29.36 1va9 s GLU 109 CO 0.79 -0.75 0.00 -0.89 -0.54 0.00 0.00 175.26 173.87 1va9 n ILE 110 N 4.70 0.00 -3.73 -3.70 5.41 -1.25 -5.00 119.36 115.78 1va9 n ILE 110 Ca 0.16 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.79 1va9 n ILE 110 Cb 0.40 -0.63 -0.07 0.00 -0.71 0.00 0.00 39.64 38.63 1va9 n ILE 110 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1va9 s ASN 111 N -0.52 -0.17 -0.35 4.38 4.22 -1.26 -4.12 114.94 117.12 1va9 s ASN 111 Ca 0.00 -0.13 0.02 0.00 -2.14 0.00 0.00 52.86 50.61 1va9 s ASN 111 Cb 0.00 0.37 0.19 0.00 1.28 0.00 0.00 41.25 43.09 1va9 s ASN 111 CO 0.00 -0.61 0.76 0.00 -2.04 0.00 0.00 177.10 175.20 1va9 s ALA 112 N -2.44 -3.02 -0.09 3.54 0.00 -1.14 -4.81 121.76 113.80 1va9 s ALA 112 Ca -0.06 0.76 -0.29 0.00 0.00 0.00 0.00 51.96 52.37 1va9 s ALA 112 Cb -0.01 -2.77 -0.06 0.00 0.00 0.00 0.00 23.12 20.28 1va9 s ALA 112 CO -0.02 -2.18 1.90 0.99 0.00 0.00 0.00 175.76 176.45 1va9 s THR 113 N 2.21 3.25 0.46 0.00 2.01 -1.26 -4.05 115.64 118.26 1va9 s THR 113 Ca 0.16 0.29 -0.23 0.00 0.31 0.00 0.00 61.69 62.21 1va9 s THR 113 Cb -0.04 -3.23 -0.09 0.00 0.01 0.00 0.00 72.50 69.15 1va9 s THR 113 CO -0.15 -0.08 1.00 0.35 -0.69 0.00 0.00 174.62 175.06 1va9 n THR 114 N 6.25 2.70 -1.33 -0.82 -2.24 -0.83 -4.82 114.28 113.19 1va9 n THR 114 Ca 0.22 -0.50 -0.43 0.00 -2.27 0.00 0.00 64.05 61.07 1va9 n THR 114 Cb 0.43 -1.17 -0.01 0.00 -2.10 0.00 0.00 70.33 67.48 1va9 n THR 114 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1va9 n LEU 115 N 0.22 -2.34 0.00 3.22 4.77 -1.23 -3.19 117.00 118.45 1va9 n LEU 115 Ca 0.10 0.88 0.12 0.00 -0.03 0.00 0.00 56.01 57.08 1va9 n LEU 115 Cb 0.41 -0.91 0.66 0.00 -2.33 0.00 0.00 43.42 41.25 1va9 n LEU 115 CO 0.55 -3.86 0.88 -1.84 -1.33 0.00 0.00 177.39 171.79 1va9 n GLU 116 N 1.22 0.60 -1.83 3.23 0.00 -1.26 -2.28 120.64 120.31 1va9 n GLU 116 Ca 0.13 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.31 1va9 n GLU 116 Cb 0.37 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.31 1va9 n GLU 116 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1va9 n SER 117 N -1.10 -7.86 0.00 -1.84 2.88 -1.26 -4.72 113.62 99.72 1va9 n SER 117 Ca 0.15 1.18 0.00 0.00 -1.33 0.00 0.00 58.87 58.87 1va9 n SER 117 Cb 0.11 -4.42 0.00 0.00 -0.75 0.00 0.00 64.21 59.16 1va9 n SER 117 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1va9 n GLY 118 N 1.60 -0.69 3.80 0.46 0.00 -1.26 -5.10 105.19 104.00 1va9 n GLY 118 Ca 0.00 -1.00 -0.33 0.00 0.00 0.00 0.00 46.02 44.69 1va9 n GLY 118 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1va9 s PRO 119 N -2.00 3.62 -0.13 1.61 0.04 -1.26 -5.06 135.00 131.82 1va9 s PRO 119 Ca 0.00 1.28 -0.04 0.00 0.04 0.00 0.00 61.00 62.27 1va9 s PRO 119 Cb 0.00 -2.07 0.05 0.00 0.04 0.00 0.00 34.50 32.52 1va9 s PRO 119 CO 0.00 -0.57 0.08 -1.12 0.04 0.00 0.00 177.00 175.43 1va9 s SER 120 N -2.36 1.94 0.00 6.66 0.01 -1.26 -5.12 113.70 113.57 1va9 s SER 120 Ca 0.65 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 57.53 1va9 s SER 120 Cb -0.16 -0.19 0.00 0.00 0.21 0.00 0.00 66.02 65.88 1va9 s SER 120 CO 0.27 -0.32 0.00 -1.54 0.41 0.00 0.00 173.24 172.06 1va9 n SER 121 N 5.29 0.00 0.00 2.44 3.41 -1.26 -5.35 113.62 118.15 1va9 n SER 121 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 1va9 n SER 121 Cb 0.49 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 1va9 n SER 121 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49