#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1va9 n SER 2 N 0.00 -5.84 -3.62 1.61 7.64 -1.26 -5.08 113.62 107.06 1va9 n SER 2 Ca 0.00 1.16 -0.01 0.00 1.01 0.00 0.00 58.87 61.03 1va9 n SER 2 Cb 0.00 -3.58 -0.01 0.00 -1.01 0.00 0.00 64.21 59.61 1va9 n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1va9 s SER 3 N -5.93 -0.09 0.00 6.43 1.04 -1.26 -5.17 113.70 108.72 1va9 s SER 3 Ca 0.00 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.32 1va9 s SER 3 Cb 0.00 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.30 1va9 s SER 3 CO 0.00 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 174.50 1va9 n GLY 4 N -0.37 2.95 3.57 7.32 0.00 -1.26 -4.91 105.19 112.49 1va9 n GLY 4 Ca -0.06 -1.42 -0.34 0.00 0.00 0.00 0.00 46.02 44.20 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 0.00 5.74 0.07 1.61 0.15 -1.26 -4.82 113.70 115.20 1va9 s SER 5 Ca 0.00 -1.69 -0.27 0.00 0.70 0.00 0.00 55.95 54.69 1va9 s SER 5 Cb 0.00 -2.58 0.08 0.00 -1.71 0.00 0.00 66.02 61.81 1va9 s SER 5 CO 0.00 -2.29 0.88 -0.44 1.20 0.00 0.00 173.24 172.59 1va9 s SER 6 N 5.94 -0.31 0.99 5.45 0.01 -1.26 -5.17 113.70 119.35 1va9 s SER 6 Ca 0.62 -0.16 -0.11 0.00 1.31 0.00 0.00 55.95 57.61 1va9 s SER 6 Cb -0.00 0.45 0.19 0.00 0.21 0.00 0.00 66.02 66.86 1va9 s SER 6 CO 0.06 -0.77 1.09 -0.83 0.41 0.00 0.00 173.24 173.21 1va9 s GLY 7 N -2.68 1.63 -0.44 3.44 0.00 -1.26 -4.89 107.32 103.11 1va9 s GLY 7 Ca 0.07 0.23 -0.01 0.00 0.00 0.00 0.00 44.72 45.02 1va9 s GLY 7 CO -0.05 0.76 1.95 0.29 0.00 0.00 0.00 173.10 176.05 1va9 n ILE 8 N -4.40 3.03 -2.58 0.90 -5.35 -1.26 -4.76 119.36 104.94 1va9 n ILE 8 Ca 0.08 -2.04 -0.16 0.00 -0.27 0.00 0.00 62.75 60.36 1va9 n ILE 8 Cb 0.53 -1.13 0.01 0.00 -1.74 0.00 0.00 39.64 37.31 1va9 n ILE 8 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 1va9 n SER 9 N -0.30 -4.86 0.00 7.28 2.88 -1.26 -4.98 113.62 112.39 1va9 n SER 9 Ca 0.44 -0.12 0.00 0.00 -1.33 0.00 0.00 58.87 57.86 1va9 n SER 9 Cb 0.76 -3.84 0.00 0.00 -0.75 0.00 0.00 64.21 60.38 1va9 n SER 9 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1va9 n THR 10 N -4.11 0.00 -3.13 2.46 5.66 -1.26 -5.00 114.28 108.90 1va9 n THR 10 Ca -0.13 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.81 1va9 n THR 10 Cb 0.61 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.40 1va9 n THR 10 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1va9 n GLU 11 N 0.00 -1.17 -2.87 1.09 1.02 -1.26 -4.99 120.64 112.46 1va9 n GLU 11 Ca 0.00 1.29 -0.21 0.00 -0.02 0.00 0.00 57.16 58.22 1va9 n GLU 11 Cb 0.00 -2.13 0.08 0.00 -0.02 0.00 0.00 31.44 29.37 1va9 n GLU 11 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1va9 s GLU 12 N -1.36 2.06 0.10 3.49 8.01 -1.26 -5.13 118.70 124.61 1va9 s GLU 12 Ca 0.06 -1.46 0.07 0.00 0.01 0.00 0.00 54.97 53.65 1va9 s GLU 12 Cb -0.01 -2.53 -0.03 0.00 -4.31 0.00 0.00 34.13 27.25 1va9 s GLU 12 CO 0.29 -1.09 -0.19 0.00 0.01 0.00 0.00 175.26 174.28 1va9 s ALA 13 N -2.85 1.67 0.95 5.21 0.00 -1.26 -4.61 121.76 120.87 1va9 s ALA 13 Ca 0.64 -1.22 -0.12 0.00 0.00 0.00 0.00 51.96 51.25 1va9 s ALA 13 Cb -0.05 -0.19 0.06 0.00 0.00 0.00 0.00 23.12 22.93 1va9 s ALA 13 CO 0.41 0.29 0.51 0.00 0.00 0.00 0.00 175.76 176.97 1va9 n ALA 14 N 1.00 -2.38 -1.78 0.00 0.00 -1.26 -4.72 120.51 111.38 1va9 n ALA 14 Ca -0.19 -0.63 -0.34 0.00 0.00 0.00 0.00 53.44 52.28 1va9 n ALA 14 Cb 0.54 -1.85 -0.03 0.00 0.00 0.00 0.00 19.45 18.11 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 -3.80 3.73 -0.32 0.00 0.04 -1.26 -4.80 135.00 128.59 1va9 s PRO 15 Ca 0.58 1.32 0.08 0.00 0.04 0.00 0.00 61.00 63.03 1va9 s PRO 15 Cb -0.21 -2.09 0.46 0.00 0.04 0.00 0.00 34.50 32.70 1va9 s PRO 15 CO 0.66 -0.49 1.16 -0.25 0.04 0.00 0.00 177.00 178.12 1va9 n ASP 16 N -1.17 4.45 -3.65 6.66 9.92 -1.26 -4.30 116.55 127.21 1va9 n ASP 16 Ca 0.09 -3.55 -0.00 0.00 -0.53 0.00 0.00 54.79 50.80 1va9 n ASP 16 Cb 0.53 -0.39 -0.07 0.00 -0.64 0.00 0.00 41.12 40.55 1va9 n ASP 16 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1va9 s GLY 17 N -3.59 0.54 0.94 0.44 0.00 -1.26 -4.88 107.32 99.50 1va9 s GLY 17 Ca 0.47 3.75 -0.13 0.00 0.00 0.00 0.00 44.72 48.81 1va9 s GLY 17 CO -0.02 2.31 1.15 2.56 0.00 0.00 0.00 173.10 179.11 1va9 s PRO 18 N 0.44 0.92 0.78 2.90 0.04 -1.26 -4.69 135.00 134.13 1va9 s PRO 18 Ca 0.01 0.20 -0.11 0.00 0.04 0.00 0.00 61.00 61.14 1va9 s PRO 18 Cb -0.04 -1.82 0.06 0.00 0.04 0.00 0.00 34.50 32.74 1va9 s PRO 18 CO -0.13 -2.33 1.09 -1.25 0.04 0.00 0.00 177.00 174.41 1va9 s PRO 19 N -5.34 2.21 0.45 0.56 0.04 -1.26 -4.08 135.00 127.58 1va9 s PRO 19 Ca 0.65 0.68 0.07 0.00 0.04 0.00 0.00 61.00 62.44 1va9 s PRO 19 Cb -0.13 -1.93 -0.00 0.00 0.04 0.00 0.00 34.50 32.47 1va9 s PRO 19 CO 0.53 -1.54 0.40 -1.64 0.04 0.00 0.00 177.00 174.80 1va9 s MET 20 N -5.14 2.45 -1.44 4.56 -1.94 -0.24 -4.57 119.30 112.98 1va9 s MET 20 Ca 0.60 -1.66 -0.08 0.00 -1.71 0.00 0.00 55.69 52.85 1va9 s MET 20 Cb -0.14 -2.32 0.04 0.00 2.01 0.00 0.00 34.83 34.42 1va9 s MET 20 CO 0.54 -0.32 0.65 -3.47 -0.01 0.00 0.00 175.02 172.41 1va9 n ASP 21 N -1.63 -5.01 -4.61 3.03 -0.08 -1.26 0.20 116.55 107.19 1va9 n ASP 21 Ca 0.03 -0.41 -0.43 0.00 -1.51 0.00 0.00 54.79 52.47 1va9 n ASP 21 Cb 0.62 -4.06 -0.02 0.00 2.34 0.00 0.00 41.12 40.00 1va9 n ASP 21 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1va9 s VAL 22 N -3.10 4.32 0.10 5.18 1.01 -1.25 -3.38 120.40 123.27 1va9 s VAL 22 Ca 0.41 1.32 -0.15 0.00 0.00 0.00 0.00 61.98 63.56 1va9 s VAL 22 Cb -0.20 -4.53 0.03 0.00 0.00 0.00 0.00 36.38 31.67 1va9 s VAL 22 CO 0.50 -0.84 0.35 0.28 0.00 0.00 0.00 175.10 175.40 1va9 s THR 23 N 4.16 0.08 0.34 3.92 -1.32 -0.95 -5.03 115.64 116.84 1va9 s THR 23 Ca 0.46 -0.67 0.08 0.00 -1.21 0.00 0.00 61.69 60.35 1va9 s THR 23 Cb -0.09 -1.13 -0.03 0.00 -1.51 0.00 0.00 72.50 69.74 1va9 s THR 23 CO 0.27 -0.37 0.23 -0.76 -2.21 0.00 0.00 174.62 171.78 1va9 s LEU 24 N -2.59 3.44 -0.30 9.08 1.43 -1.26 -2.33 118.68 126.15 1va9 s LEU 24 Ca 0.01 -0.64 -0.13 0.00 -1.03 0.00 0.00 54.13 52.35 1va9 s LEU 24 Cb 0.02 -1.99 0.16 0.00 0.03 0.00 0.00 46.19 44.40 1va9 s LEU 24 CO -0.09 -0.35 0.88 -1.58 0.23 0.00 0.00 176.35 175.44 1va9 s GLN 25 N -3.94 0.37 -0.27 1.70 0.74 0.87 -4.94 119.66 114.18 1va9 s GLN 25 Ca 0.40 0.89 -0.29 0.00 0.05 0.00 0.00 55.36 56.41 1va9 s GLN 25 Cb -0.04 0.53 -0.00 0.00 1.10 0.00 0.00 33.01 34.59 1va9 s GLN 25 CO 0.25 -0.17 1.34 -1.25 -0.55 0.00 0.00 175.29 174.90 1va9 s PRO 26 N 2.63 3.94 -0.20 1.67 0.04 -1.26 0.18 135.00 142.01 1va9 s PRO 26 Ca -0.01 1.35 0.15 0.00 0.04 0.00 0.00 61.00 62.53 1va9 s PRO 26 Cb -0.09 -3.88 -0.23 0.00 0.04 0.00 0.00 34.50 30.34 1va9 s PRO 26 CO -0.18 -1.09 0.02 1.33 0.04 0.00 0.00 177.00 177.13 1va9 n VAL 27 N 6.13 1.35 -3.38 -0.36 0.24 -1.18 -4.89 118.33 116.24 1va9 n VAL 27 Ca 0.15 -0.79 0.00 0.00 -2.04 0.00 0.00 64.34 61.67 1va9 n VAL 27 Cb 0.46 -0.62 0.00 0.00 -1.47 0.00 0.00 33.84 32.22 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 -2.80 0.00 0.01 3.34 -2.24 -1.08 -5.05 114.28 106.47 1va9 n THR 28 Ca -0.34 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.49 1va9 n THR 28 Cb 1.11 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 69.23 1va9 n THR 28 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1va9 n SER 29 N -0.60 0.39 -2.57 3.42 7.64 -1.26 -4.31 113.62 116.32 1va9 n SER 29 Ca 0.00 0.16 -0.07 0.00 1.01 0.00 0.00 58.87 59.97 1va9 n SER 29 Cb 0.00 1.06 0.04 0.00 -1.01 0.00 0.00 64.21 64.30 1va9 n SER 29 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1va9 n GLN 30 N -2.58 2.29 -3.64 1.43 6.02 -1.26 -4.11 117.38 115.54 1va9 n GLN 30 Ca -0.09 -3.70 -0.10 0.00 -0.01 0.00 0.00 57.00 53.10 1va9 n GLN 30 Cb 0.73 -1.80 -0.07 0.00 1.02 0.00 0.00 30.24 30.12 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 -3.73 -0.61 0.06 1.08 0.01 -1.26 -1.28 113.70 107.98 1va9 s SER 31 Ca 0.34 1.12 0.08 0.00 1.31 0.00 0.00 55.95 58.80 1va9 s SER 31 Cb 0.35 1.17 -0.03 0.00 0.21 0.00 0.00 66.02 67.72 1va9 s SER 31 CO -0.02 -0.19 -0.21 -0.63 0.41 0.00 0.00 173.24 172.60 1va9 s ILE 32 N 0.56 1.69 -0.15 1.44 1.01 -0.53 -2.62 121.20 122.60 1va9 s ILE 32 Ca -0.01 -1.32 -0.10 0.00 0.00 0.00 0.00 60.65 59.23 1va9 s ILE 32 Cb -0.05 -1.49 -0.05 0.00 0.01 0.00 0.00 42.46 40.88 1va9 s ILE 32 CO -0.06 0.12 0.19 -1.58 0.00 0.00 0.00 174.94 173.60 1va9 s GLN 33 N -1.42 3.90 -0.21 2.79 0.74 0.49 -0.57 119.66 125.37 1va9 s GLN 33 Ca 0.07 -0.08 0.01 0.00 0.05 0.00 0.00 55.36 55.41 1va9 s GLN 33 Cb -0.09 -3.32 0.05 0.00 1.10 0.00 0.00 33.01 30.75 1va9 s GLN 33 CO 0.03 0.50 -0.10 0.08 -0.55 0.00 0.00 175.29 175.25 1va9 s VAL 34 N -0.26 1.67 -0.02 1.34 1.01 0.72 -0.09 120.40 124.76 1va9 s VAL 34 Ca 0.13 -1.09 0.05 0.00 0.00 0.00 0.00 61.98 61.07 1va9 s VAL 34 Cb -0.12 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.46 1va9 s VAL 34 CO 0.03 0.11 -0.16 0.42 0.00 0.00 0.00 175.10 175.50 1va9 s THR 35 N 1.37 2.94 0.10 3.92 -4.23 -0.98 -0.87 115.64 117.88 1va9 s THR 35 Ca -0.03 -0.86 -0.15 0.00 -1.18 0.00 0.00 61.69 59.47 1va9 s THR 35 Cb -0.17 -2.17 0.03 0.00 1.34 0.00 0.00 72.50 71.53 1va9 s THR 35 CO -0.08 0.52 0.36 -1.66 -0.54 0.00 0.00 174.62 173.23 1va9 s TRP 36 N -0.78 -0.15 0.25 3.99 -2.14 -0.75 -2.25 118.94 117.11 1va9 s TRP 36 Ca 0.12 -0.13 0.10 0.00 2.66 0.00 0.00 56.10 58.85 1va9 s TRP 36 Cb -0.11 0.19 -0.04 0.00 -3.10 0.00 0.00 33.47 30.41 1va9 s TRP 36 CO 0.02 -0.64 -0.05 0.15 -2.66 0.00 0.00 176.95 173.77 1va9 s LYS 37 N -3.50 2.15 0.25 3.25 1.02 0.52 -1.81 119.74 121.62 1va9 s LYS 37 Ca 0.01 -1.43 -0.26 0.00 0.02 0.00 0.00 55.97 54.31 1va9 s LYS 37 Cb 0.02 -2.11 -0.17 0.00 -0.52 0.00 0.00 37.83 35.06 1va9 s LYS 37 CO -0.10 0.38 0.41 0.00 -0.92 0.00 0.00 175.35 175.13 1va9 n ALA 38 N -0.63 -2.90 -1.54 5.17 0.00 0.50 -1.07 120.51 120.04 1va9 n ALA 38 Ca -0.07 0.36 -0.29 0.00 0.00 0.00 0.00 53.44 53.44 1va9 n ALA 38 Cb 0.58 -1.57 0.15 0.00 0.00 0.00 0.00 19.45 18.61 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 -1.00 0.85 0.04 0.00 0.04 -1.26 -3.93 135.00 129.74 1va9 s PRO 39 Ca 0.63 0.17 -0.33 0.00 0.04 0.00 0.00 61.00 61.50 1va9 s PRO 39 Cb -0.86 -1.82 -0.17 0.00 0.04 0.00 0.00 34.50 31.69 1va9 s PRO 39 CO 0.57 -2.37 0.85 1.63 0.04 0.00 0.00 177.00 177.72 1va9 n LYS 40 N -3.87 0.00 0.25 4.56 4.01 -1.26 -4.81 118.16 117.05 1va9 n LYS 40 Ca 0.08 0.00 -0.16 0.00 -0.51 0.00 0.00 58.31 57.73 1va9 n LYS 40 Cb 0.59 -1.24 -0.08 0.00 -0.51 0.00 0.00 35.03 33.79 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 2.27 -0.55 0.00 1.97 1.63 -1.99 -1.47 116.57 118.44 1va9 h LYS 41 Ca -0.41 0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.43 1va9 h LYS 41 Cb 1.29 0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 33.04 1va9 h LYS 41 CO 0.57 -0.35 -0.01 1.05 -3.45 0.00 0.00 179.45 177.26 1va9 h GLU 42 N -0.61 0.00 -1.80 1.90 4.11 -2.03 -2.18 114.58 113.97 1va9 h GLU 42 Ca -0.06 0.00 -0.68 0.00 0.07 0.00 0.00 59.36 58.70 1va9 h GLU 42 Cb 0.46 0.00 -0.35 0.00 0.50 0.00 0.00 28.75 29.36 1va9 h GLU 42 CO 0.10 0.01 0.11 1.28 0.07 0.00 0.00 179.01 180.58 1va9 n LEU 43 N -3.23 6.01 -0.08 3.06 4.77 -0.60 -4.62 117.00 122.31 1va9 n LEU 43 Ca -0.02 -5.10 -0.16 0.00 -0.03 0.00 0.00 56.01 50.70 1va9 n LEU 43 Cb 0.13 -0.76 -0.05 0.00 -2.33 0.00 0.00 43.42 40.41 1va9 n LEU 43 CO 0.23 2.04 -0.94 0.00 -1.33 0.00 0.00 177.39 177.39 1va9 n GLN 44 N -0.47 0.39 -2.37 3.23 6.02 -0.82 -4.07 117.38 119.29 1va9 n GLN 44 Ca 0.45 0.17 -0.07 0.00 -0.01 0.00 0.00 57.00 57.54 1va9 n GLN 44 Cb 0.44 -1.16 0.03 0.00 1.02 0.00 0.00 30.24 30.58 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 -3.95 -4.03 -0.34 1.08 4.13 -1.26 -4.39 115.26 106.50 1va9 n ASN 45 Ca -0.29 -0.34 0.04 0.00 1.68 0.00 0.00 54.58 55.68 1va9 n ASN 45 Cb 0.64 -2.76 -0.02 0.00 -1.54 0.00 0.00 39.78 36.10 1va9 n ASN 45 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1va9 n GLY 46 N -1.34 -2.70 3.09 7.41 0.00 -1.26 -4.38 105.19 106.01 1va9 n GLY 46 Ca -0.04 -1.36 -0.36 0.00 0.00 0.00 0.00 46.02 44.26 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 -2.60 0.00 -4.24 1.61 0.31 -1.26 -4.94 118.33 107.20 1va9 n VAL 47 Ca -0.02 -0.37 -0.34 0.00 -0.01 0.00 0.00 64.34 63.59 1va9 n VAL 47 Cb 0.16 -0.15 -0.10 0.00 -0.91 0.00 0.00 33.84 32.84 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 -2.09 4.35 -0.02 2.52 -1.09 -1.26 -4.91 121.20 118.69 1va9 s ILE 48 Ca 0.44 -0.20 0.12 0.00 -2.23 0.00 0.00 60.65 58.77 1va9 s ILE 48 Cb -0.15 -2.91 -0.12 0.00 -1.58 0.00 0.00 42.46 37.71 1va9 s ILE 48 CO 0.77 0.51 1.19 0.03 -1.23 0.00 0.00 174.94 176.21 1va9 h ARG 49 N 6.28 0.00 0.00 2.79 2.47 -1.92 -3.44 114.38 120.56 1va9 h ARG 49 Ca -0.38 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.34 1va9 h ARG 49 Cb 1.18 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.50 1va9 h ARG 49 CO 0.63 0.68 0.00 0.41 0.56 0.00 0.00 179.97 182.26 1va9 n GLY 50 N 1.35 -1.43 3.15 0.04 0.00 -0.82 -3.45 105.19 104.03 1va9 n GLY 50 Ca -0.03 -1.00 -0.08 0.00 0.00 0.00 0.00 46.02 44.91 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 -2.64 0.57 0.10 1.61 1.51 -1.23 -0.58 117.35 116.69 1va9 s TYR 51 Ca 0.00 -1.03 0.07 0.00 -1.01 0.00 0.00 57.07 55.10 1va9 s TYR 51 Cb 0.00 -0.34 -0.04 0.00 -0.11 0.00 0.00 41.96 41.47 1va9 s TYR 51 CO 0.00 -0.48 -0.09 -0.65 -1.11 0.00 0.00 175.55 173.22 1va9 s GLN 52 N -3.96 2.18 -0.36 -0.62 -0.21 0.46 -2.54 119.66 114.60 1va9 s GLN 52 Ca 0.13 -1.00 0.01 0.00 0.02 0.00 0.00 55.36 54.52 1va9 s GLN 52 Cb 0.07 -2.34 0.12 0.00 1.00 0.00 0.00 33.01 31.86 1va9 s GLN 52 CO -0.05 0.51 0.15 0.42 -2.12 0.00 0.00 175.29 174.20 1va9 s ILE 53 N -1.23 1.12 -0.35 1.08 1.09 -1.01 -2.09 121.20 119.80 1va9 s ILE 53 Ca 0.22 -1.91 -0.21 0.00 -1.10 0.00 0.00 60.65 57.64 1va9 s ILE 53 Cb -0.11 -1.82 0.00 0.00 -1.06 0.00 0.00 42.46 39.47 1va9 s ILE 53 CO 0.14 -0.77 0.69 -0.83 -0.10 0.00 0.00 174.94 174.07 1va9 s GLY 54 N 1.06 1.72 0.01 6.18 0.00 -0.93 -3.21 107.32 112.16 1va9 s GLY 54 Ca 0.13 -0.74 0.04 0.00 0.00 0.00 0.00 44.72 44.16 1va9 s GLY 54 CO -0.13 1.59 -0.14 -2.52 0.00 0.00 0.00 173.10 171.90 1va9 s TYR 55 N 2.84 1.20 -0.06 1.90 1.13 -0.77 0.26 117.35 123.86 1va9 s TYR 55 Ca 0.27 -0.28 -0.26 0.00 -1.41 0.00 0.00 57.07 55.39 1va9 s TYR 55 Cb -0.14 -0.75 0.06 0.00 -1.10 0.00 0.00 41.96 40.03 1va9 s TYR 55 CO 0.15 0.00 0.58 -0.98 -2.51 0.00 0.00 175.55 172.79 1va9 s ARG 56 N -0.67 0.92 -0.10 -3.49 1.70 -1.05 -1.04 118.95 115.22 1va9 s ARG 56 Ca 0.04 0.22 -0.33 0.00 -0.47 0.00 0.00 55.73 55.19 1va9 s ARG 56 Cb -0.06 0.43 -0.10 0.00 -0.57 0.00 0.00 34.95 34.64 1va9 s ARG 56 CO 0.00 -0.26 1.96 -1.91 -1.08 0.00 0.00 175.30 174.01 1va9 n GLU 57 N 1.22 2.21 -1.36 3.89 2.13 -1.26 -2.90 120.64 124.57 1va9 n GLU 57 Ca -0.19 0.78 -0.29 0.00 0.66 0.00 0.00 57.16 58.13 1va9 n GLU 57 Cb 0.57 -2.77 0.02 0.00 0.27 0.00 0.00 31.44 29.53 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 7.64 7.00 -4.90 4.31 2.85 -0.86 -4.72 115.26 126.58 1va9 n ASN 58 Ca 0.24 -3.44 -0.29 0.00 -0.11 0.00 0.00 54.58 50.98 1va9 n ASN 58 Cb 0.33 -1.09 0.06 0.00 1.24 0.00 0.00 39.78 40.32 1va9 n ASN 58 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1va9 s SER 59 N -0.53 5.06 -1.02 1.20 0.01 -1.26 -4.77 113.70 112.39 1va9 s SER 59 Ca 0.51 0.91 -0.23 0.00 1.31 0.00 0.00 55.95 58.45 1va9 s SER 59 Cb 0.39 -1.60 0.00 0.00 0.21 0.00 0.00 66.02 65.02 1va9 s SER 59 CO -0.14 -1.54 1.72 -2.16 0.41 0.00 0.00 173.24 171.52 1va9 s PRO 60 N -5.40 3.12 0.00 12.44 0.04 -1.26 -2.84 135.00 141.10 1va9 s PRO 60 Ca 0.59 -0.89 0.00 0.00 0.04 0.00 0.00 61.00 60.74 1va9 s PRO 60 Cb -0.11 -5.25 0.00 0.00 0.04 0.00 0.00 34.50 29.18 1va9 s PRO 60 CO 0.50 -2.85 0.00 0.41 0.04 0.00 0.00 177.00 175.10 1va9 n GLY 61 N 6.62 0.99 3.94 0.56 0.00 -1.26 -5.14 105.19 110.90 1va9 n GLY 61 Ca 0.39 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.82 5.92 -0.02 1.61 1.04 -1.13 -5.00 113.70 114.31 1va9 s SER 62 Ca 0.00 0.50 0.01 0.00 0.48 0.00 0.00 55.95 56.94 1va9 s SER 62 Cb 0.00 -1.75 0.02 0.00 0.10 0.00 0.00 66.02 64.39 1va9 s SER 62 CO 0.00 -0.70 0.45 -3.20 0.98 0.00 0.00 173.24 170.77 1va9 n ASN 63 N -2.17 -0.09 -1.99 7.02 2.85 -1.26 -4.99 115.26 114.63 1va9 n ASN 63 Ca 0.01 -0.85 -0.01 0.00 -0.11 0.00 0.00 54.58 53.62 1va9 n ASN 63 Cb 0.57 0.04 0.35 0.00 1.24 0.00 0.00 39.78 41.98 1va9 n ASN 63 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1va9 n GLY 64 N -0.08 3.38 1.08 8.20 0.00 -1.26 -5.05 105.19 111.46 1va9 n GLY 64 Ca -0.01 -0.97 0.12 0.00 0.00 0.00 0.00 46.02 45.16 1va9 n GLY 64 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1va9 n GLN 65 N 0.17 -1.96 -3.12 1.61 0.00 -1.26 -4.62 117.38 108.20 1va9 n GLN 65 Ca 0.36 1.45 -0.41 0.00 -0.00 0.00 0.00 57.00 58.40 1va9 n GLN 65 Cb 1.33 -2.51 -0.07 0.00 0.00 0.00 0.00 30.24 28.99 1va9 n GLN 65 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.06 177.77 1va9 s TYR 66 N -3.02 3.23 -0.46 3.69 1.51 -1.26 -4.63 117.35 116.40 1va9 s TYR 66 Ca 0.00 0.63 -0.28 0.00 -1.01 0.00 0.00 57.07 56.41 1va9 s TYR 66 Cb 0.00 -2.95 -0.01 0.00 -0.11 0.00 0.00 41.96 38.89 1va9 s TYR 66 CO 0.00 -0.44 1.67 -1.12 -1.11 0.00 0.00 175.55 174.55 1va9 s SER 67 N 1.61 5.86 0.27 2.29 0.01 -0.21 -4.73 113.70 118.81 1va9 s SER 67 Ca 0.25 0.76 -0.23 0.00 1.31 0.00 0.00 55.95 58.05 1va9 s SER 67 Cb -0.15 -2.53 -0.09 0.00 0.21 0.00 0.00 66.02 63.46 1va9 s SER 67 CO 0.11 -1.83 0.83 -0.63 0.41 0.00 0.00 173.24 172.13 1va9 s ILE 68 N 7.02 4.40 -0.17 1.44 -1.09 -1.26 -1.84 121.20 129.70 1va9 s ILE 68 Ca 0.68 1.53 -0.04 0.00 -2.23 0.00 0.00 60.65 60.59 1va9 s ILE 68 Cb -0.16 -3.92 0.07 0.00 -1.58 0.00 0.00 42.46 36.88 1va9 s ILE 68 CO 0.28 0.16 0.18 0.68 -1.23 0.00 0.00 174.94 175.01 1va9 s VAL 69 N -1.58 -0.26 0.13 2.92 -7.23 -1.20 -4.95 120.40 108.24 1va9 s VAL 69 Ca 0.47 -0.01 -0.25 0.00 -1.81 0.00 0.00 61.98 60.38 1va9 s VAL 69 Cb -0.17 -0.56 -0.07 0.00 0.56 0.00 0.00 36.38 36.14 1va9 s VAL 69 CO 0.22 -0.13 0.78 -0.70 -0.31 0.00 0.00 175.10 174.95 1va9 s GLU 70 N 2.28 4.55 0.27 4.82 2.12 -1.26 -2.42 118.70 129.06 1va9 s GLU 70 Ca 0.05 1.14 0.05 0.00 0.36 0.00 0.00 54.97 56.56 1va9 s GLU 70 Cb -0.15 -3.29 -0.02 0.00 0.26 0.00 0.00 34.13 30.93 1va9 s GLU 70 CO -0.10 0.49 0.26 0.00 -0.54 0.00 0.00 175.26 175.37 1va9 n MET 71 N 1.95 0.38 -3.62 4.30 0.00 -1.05 -5.04 117.12 114.04 1va9 n MET 71 Ca -0.05 -2.59 -0.27 0.00 0.00 0.00 0.00 57.70 54.79 1va9 n MET 71 Cb 0.49 2.20 -0.03 0.00 0.00 0.00 0.00 33.22 35.88 1va9 n MET 71 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1va9 s LYS 72 N -3.00 3.54 -0.72 3.17 1.02 -1.26 -3.54 119.74 118.95 1va9 s LYS 72 Ca 0.30 -0.28 -0.21 0.00 0.02 0.00 0.00 55.97 55.81 1va9 s LYS 72 Cb 0.01 -2.80 0.10 0.00 -0.52 0.00 0.00 37.83 34.62 1va9 s LYS 72 CO 0.22 0.36 0.94 0.00 -0.92 0.00 0.00 175.35 175.94 1va9 s ALA 73 N -1.93 3.27 0.38 5.17 0.00 -1.22 -4.69 121.76 122.74 1va9 s ALA 73 Ca 0.40 -2.20 0.17 0.00 0.00 0.00 0.00 51.96 50.32 1va9 s ALA 73 Cb -0.11 -3.82 1.07 0.00 0.00 0.00 0.00 23.12 20.26 1va9 s ALA 73 CO 0.29 -2.72 1.74 1.79 0.00 0.00 0.00 175.76 176.86 1va9 h THR 74 N 5.90 0.47 0.00 0.00 1.35 -1.95 -3.47 112.91 115.22 1va9 h THR 74 Ca -0.17 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.55 1va9 h THR 74 Cb 1.06 0.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.51 1va9 h THR 74 CO 1.14 0.08 0.00 0.61 -0.25 0.00 0.00 175.52 177.09 1va9 n GLY 75 N -1.42 -0.61 0.28 5.82 0.00 -1.26 -4.95 105.19 103.05 1va9 n GLY 75 Ca 0.27 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.24 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 0.81 -4.25 1.61 3.32 -1.98 -3.43 116.42 112.49 1va9 h ASP 76 Ca 0.00 -0.23 -0.69 0.00 0.02 0.00 0.00 57.03 56.13 1va9 h ASP 76 Cb 0.00 -0.22 -0.26 0.00 0.22 0.00 0.00 39.33 39.08 1va9 h ASP 76 CO 0.00 0.91 -0.88 -0.94 -1.72 0.00 0.00 179.24 176.61 1va9 s SER 77 N -6.67 3.16 0.12 6.45 1.04 -1.26 0.19 113.70 116.73 1va9 s SER 77 Ca -0.10 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 55.77 1va9 s SER 77 Cb 0.14 -0.27 -0.04 0.00 0.10 0.00 0.00 66.02 65.95 1va9 s SER 77 CO 0.82 0.24 -0.11 -1.61 0.98 0.00 0.00 173.24 173.57 1va9 s GLU 78 N -1.35 0.95 -0.03 4.02 8.01 -0.75 -4.48 118.70 125.07 1va9 s GLU 78 Ca 0.12 -1.26 -0.09 0.00 0.01 0.00 0.00 54.97 53.75 1va9 s GLU 78 Cb -0.10 -0.64 0.01 0.00 -4.31 0.00 0.00 34.13 29.09 1va9 s GLU 78 CO 0.03 0.10 0.20 0.54 0.01 0.00 0.00 175.26 176.13 1va9 s VAL 79 N -2.64 0.05 -0.09 2.63 0.11 -1.26 -1.81 120.40 117.39 1va9 s VAL 79 Ca 0.10 -0.40 -0.08 0.00 -2.93 0.00 0.00 61.98 58.66 1va9 s VAL 79 Cb -0.02 -0.42 0.03 0.00 -1.53 0.00 0.00 36.38 34.44 1va9 s VAL 79 CO 0.01 -0.22 0.24 -0.47 -3.33 0.00 0.00 175.10 171.32 1va9 s TYR 80 N -0.83 -0.27 -0.39 1.54 6.14 -0.05 -4.98 117.35 118.50 1va9 s TYR 80 Ca -0.09 0.66 -0.08 0.00 0.64 0.00 0.00 57.07 58.20 1va9 s TYR 80 Cb -0.05 0.08 0.07 0.00 0.42 0.00 0.00 41.96 42.48 1va9 s TYR 80 CO 0.02 -0.14 0.20 0.99 0.64 0.00 0.00 175.55 177.25 1va9 s THR 81 N 0.33 4.03 -0.56 4.34 2.01 -1.26 -0.20 115.64 124.33 1va9 s THR 81 Ca -0.02 -1.33 -0.28 0.00 0.31 0.00 0.00 61.69 60.37 1va9 s THR 81 Cb -0.03 -3.42 0.02 0.00 0.01 0.00 0.00 72.50 69.09 1va9 s THR 81 CO -0.01 -0.40 1.26 -0.76 -0.69 0.00 0.00 174.62 174.02 1va9 s LEU 82 N 1.40 3.45 0.00 4.42 2.01 0.26 -4.83 118.68 125.39 1va9 s LEU 82 Ca 0.02 0.20 -0.01 0.00 0.01 0.00 0.00 54.13 54.35 1va9 s LEU 82 Cb -0.22 -3.17 0.10 0.00 0.01 0.00 0.00 46.19 42.91 1va9 s LEU 82 CO 0.02 -1.54 0.66 -0.90 1.01 0.00 0.00 176.35 175.61 1va9 n ASP 83 N 8.75 0.78 -3.28 2.29 5.68 -1.26 -1.46 116.55 128.05 1va9 n ASP 83 Ca 0.10 -1.68 -0.18 0.00 -0.50 0.00 0.00 54.79 52.53 1va9 n ASP 83 Cb 0.49 -0.44 0.08 0.00 -1.14 0.00 0.00 41.12 40.11 1va9 n ASP 83 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1va9 n ASN 84 N -3.01 -3.53 -4.83 -1.12 3.02 -0.40 -4.87 115.26 100.52 1va9 n ASN 84 Ca 0.11 -0.54 -0.22 0.00 -0.03 0.00 0.00 54.58 53.90 1va9 n ASN 84 Cb 0.38 -4.73 -0.04 0.00 -0.61 0.00 0.00 39.78 34.77 1va9 n ASN 84 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1va9 s LEU 85 N -6.31 3.42 0.00 3.41 1.43 -0.76 -5.01 118.68 114.86 1va9 s LEU 85 Ca 0.20 -0.68 -0.00 0.00 -1.03 0.00 0.00 54.13 52.62 1va9 s LEU 85 Cb -0.09 -2.00 0.00 0.00 0.03 0.00 0.00 46.19 44.13 1va9 s LEU 85 CO 0.67 -0.45 0.02 1.17 0.23 0.00 0.00 176.35 177.99 1va9 n LYS 86 N -1.37 -0.22 -5.20 1.70 4.81 -1.26 -4.44 118.16 112.17 1va9 n LYS 86 Ca -0.00 -0.03 -0.30 0.00 -0.87 0.00 0.00 58.31 57.11 1va9 n LYS 86 Cb 0.61 -0.02 -0.16 0.00 0.02 0.00 0.00 35.03 35.48 1va9 n LYS 86 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1va9 s LYS 87 N -3.04 2.15 -1.32 1.64 1.02 -1.26 -4.27 119.74 114.66 1va9 s LYS 87 Ca 0.01 -0.86 -0.13 0.00 0.02 0.00 0.00 55.97 55.01 1va9 s LYS 87 Cb -0.00 -1.96 0.12 0.00 -0.52 0.00 0.00 37.83 35.46 1va9 s LYS 87 CO 0.01 0.46 0.51 0.34 -0.92 0.00 0.00 175.35 175.74 1va9 n PHE 88 N 2.68 -1.67 -4.84 3.18 7.35 -0.17 -4.92 117.46 119.07 1va9 n PHE 88 Ca -0.16 0.52 -0.28 0.00 -0.76 0.00 0.00 57.45 56.76 1va9 n PHE 88 Cb 0.52 -2.44 -0.15 0.00 0.35 0.00 0.00 39.48 37.76 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 -2.94 2.01 0.13 3.13 0.00 -1.26 -4.85 121.76 117.98 1va9 s ALA 89 Ca 0.51 -1.15 -0.30 0.00 0.00 0.00 0.00 51.96 51.02 1va9 s ALA 89 Cb -0.28 -0.42 -0.07 0.00 0.00 0.00 0.00 23.12 22.35 1va9 s ALA 89 CO 0.62 0.47 1.15 -1.14 0.00 0.00 0.00 175.76 176.86 1va9 s GLN 90 N -1.11 4.51 -0.05 0.00 0.74 -1.26 -2.35 119.66 120.14 1va9 s GLN 90 Ca 0.10 1.76 0.01 0.00 0.05 0.00 0.00 55.36 57.27 1va9 s GLN 90 Cb -0.09 -3.30 0.02 0.00 1.10 0.00 0.00 33.01 30.74 1va9 s GLN 90 CO 0.02 -0.08 -0.06 0.71 -0.55 0.00 0.00 175.29 175.33 1va9 s TYR 91 N 0.29 0.92 -0.19 1.67 2.02 -1.26 -2.02 117.35 118.78 1va9 s TYR 91 Ca 0.53 -0.30 -0.04 0.00 -0.37 0.00 0.00 57.07 56.90 1va9 s TYR 91 Cb -0.30 -0.79 -0.02 0.00 -0.40 0.00 0.00 41.96 40.46 1va9 s TYR 91 CO 0.33 -0.24 -0.04 0.20 -1.57 0.00 0.00 175.55 174.23 1va9 s GLY 92 N 0.99 1.65 0.15 0.71 0.00 -1.14 -2.26 107.32 107.42 1va9 s GLY 92 Ca -0.10 -1.02 0.04 0.00 0.00 0.00 0.00 44.72 43.64 1va9 s GLY 92 CO -0.00 0.19 -0.07 0.54 0.00 0.00 0.00 173.10 173.76 1va9 s VAL 93 N 0.98 1.01 0.34 1.40 0.11 -1.24 -2.53 120.40 120.47 1va9 s VAL 93 Ca 0.00 -2.03 0.03 0.00 -2.93 0.00 0.00 61.98 57.06 1va9 s VAL 93 Cb -0.15 -1.91 -0.04 0.00 -1.53 0.00 0.00 36.38 32.75 1va9 s VAL 93 CO 0.01 -0.69 0.11 0.68 -3.33 0.00 0.00 175.10 171.88 1va9 s VAL 94 N -3.43 0.73 -0.06 2.04 -7.23 0.14 -3.58 120.40 109.01 1va9 s VAL 94 Ca 0.18 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.30 1va9 s VAL 94 Cb 0.04 -2.57 0.01 0.00 0.56 0.00 0.00 36.38 34.42 1va9 s VAL 94 CO 0.01 0.00 0.15 -0.69 -0.31 0.00 0.00 175.10 174.26 1va9 s VAL 95 N -3.41 0.00 -0.01 1.32 1.01 -1.26 -2.18 120.40 115.88 1va9 s VAL 95 Ca 0.33 -0.03 -0.10 0.00 0.00 0.00 0.00 61.98 62.17 1va9 s VAL 95 Cb 0.06 -0.23 0.01 0.00 0.00 0.00 0.00 36.38 36.22 1va9 s VAL 95 CO 0.15 -0.02 0.21 0.00 0.00 0.00 0.00 175.10 175.45 1va9 s GLN 96 N 0.02 0.56 -0.12 2.72 -2.07 -0.89 -1.84 119.66 118.04 1va9 s GLN 96 Ca -0.01 -0.29 -0.19 0.00 -1.82 0.00 0.00 55.36 53.05 1va9 s GLN 96 Cb -0.01 0.24 -0.04 0.00 -1.09 0.00 0.00 33.01 32.11 1va9 s GLN 96 CO 0.00 -0.14 0.51 0.00 -1.32 0.00 0.00 175.29 174.35 1va9 s ALA 97 N -1.32 3.46 -0.06 2.60 0.00 -1.26 -0.40 121.76 124.77 1va9 s ALA 97 Ca -0.14 -0.15 0.04 0.00 0.00 0.00 0.00 51.96 51.71 1va9 s ALA 97 Cb -0.06 -2.71 0.00 0.00 0.00 0.00 0.00 23.12 20.35 1va9 s ALA 97 CO 0.03 -0.04 -0.17 -0.59 0.00 0.00 0.00 175.76 174.98 1va9 s PHE 98 N 0.71 1.86 0.45 0.00 -0.12 0.25 -1.70 117.98 119.44 1va9 s PHE 98 Ca 0.28 -0.65 0.03 0.00 -0.05 0.00 0.00 56.93 56.54 1va9 s PHE 98 Cb -0.16 -1.28 -0.03 0.00 -0.63 0.00 0.00 43.02 40.93 1va9 s PHE 98 CO 0.11 -0.27 0.06 0.54 -0.05 0.00 0.00 175.22 175.61 1va9 s ASN 99 N 0.31 3.48 0.62 1.98 2.20 0.32 -1.95 114.94 121.90 1va9 s ASN 99 Ca -0.11 -1.62 0.34 0.00 -0.94 0.00 0.00 52.86 50.53 1va9 s ASN 99 Cb -0.15 0.40 1.96 0.00 -2.00 0.00 0.00 41.25 41.47 1va9 s ASN 99 CO 0.04 -0.84 2.22 0.03 -2.94 0.00 0.00 177.10 175.62 1va9 h ARG 100 N 1.60 0.00 0.00 3.55 2.47 -1.95 0.45 114.38 120.51 1va9 h ARG 100 Ca -0.40 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.25 1va9 h ARG 100 Cb 1.29 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.60 1va9 h ARG 100 CO 0.68 0.00 -0.31 0.00 0.56 0.00 0.00 179.97 180.90 1va9 h ALA 101 N 1.87 0.93 0.00 0.04 0.00 -1.86 -3.49 119.26 116.75 1va9 h ALA 101 Ca 0.02 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1va9 h ALA 101 Cb 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1va9 h ALA 101 CO -0.00 0.38 0.00 0.41 0.00 0.00 0.00 179.25 180.04 1va9 n GLY 102 N 0.46 0.47 3.42 0.00 0.00 0.16 -4.18 105.19 105.52 1va9 n GLY 102 Ca 0.01 -1.51 -0.28 0.00 0.00 0.00 0.00 46.02 44.24 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 -3.48 2.36 0.15 2.61 2.01 -1.26 0.12 115.64 118.15 1va9 s THR 103 Ca 0.00 -1.92 0.03 0.00 0.31 0.00 0.00 61.69 60.10 1va9 s THR 103 Cb 0.00 -2.10 0.03 0.00 0.01 0.00 0.00 72.50 70.43 1va9 s THR 103 CO 0.00 -0.04 0.21 0.61 -0.69 0.00 0.00 174.62 174.70 1va9 n GLY 104 N 0.48 1.97 3.82 4.40 0.00 -0.69 -4.56 105.19 110.62 1va9 n GLY 104 Ca -0.14 -2.16 -0.31 0.00 0.00 0.00 0.00 46.02 43.41 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 -2.69 2.94 0.88 1.61 0.04 -1.26 -4.80 135.00 131.72 1va9 s PRO 105 Ca 0.16 0.95 -0.12 0.00 0.04 0.00 0.00 61.00 62.03 1va9 s PRO 105 Cb -0.01 -1.99 0.12 0.00 0.04 0.00 0.00 34.50 32.66 1va9 s PRO 105 CO 0.10 -1.10 1.14 -1.54 0.04 0.00 0.00 177.00 175.64 1va9 s SER 106 N -3.80 3.81 0.24 6.66 1.04 -1.26 -4.32 113.70 116.07 1va9 s SER 106 Ca 0.58 0.96 0.06 0.00 0.48 0.00 0.00 55.95 58.02 1va9 s SER 106 Cb -0.14 -1.53 -0.03 0.00 0.10 0.00 0.00 66.02 64.41 1va9 s SER 106 CO 0.55 -2.36 0.29 -0.94 0.98 0.00 0.00 173.24 171.76 1va9 s SER 107 N -4.13 6.00 -0.43 7.02 1.04 -0.77 -4.65 113.70 117.78 1va9 s SER 107 Ca 0.63 -0.05 -0.44 0.00 0.48 0.00 0.00 55.95 56.57 1va9 s SER 107 Cb -0.14 -1.68 -0.18 0.00 0.10 0.00 0.00 66.02 64.12 1va9 s SER 107 CO 0.53 -0.05 1.77 -1.20 0.98 0.00 0.00 173.24 175.27 1va9 n SER 108 N -1.26 1.51 -4.73 7.02 7.64 -1.26 -4.61 113.62 117.93 1va9 n SER 108 Ca -0.08 1.02 -0.39 0.00 1.01 0.00 0.00 58.87 60.42 1va9 n SER 108 Cb 0.57 -0.98 0.03 0.00 -1.01 0.00 0.00 64.21 62.83 1va9 n SER 108 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1va9 n GLU 109 N 5.28 1.76 -2.97 1.43 2.13 -1.26 -4.94 120.64 122.07 1va9 n GLU 109 Ca 0.35 0.64 -0.09 0.00 0.66 0.00 0.00 57.16 58.71 1va9 n GLU 109 Cb 0.01 -2.50 -0.03 0.00 0.27 0.00 0.00 31.44 29.19 1va9 n GLU 109 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 1va9 n ILE 110 N -0.79 0.00 -3.68 6.31 -5.35 -1.23 -5.04 119.36 109.57 1va9 n ILE 110 Ca 0.09 -1.00 -0.14 0.00 -0.27 0.00 0.00 62.75 61.43 1va9 n ILE 110 Cb 0.43 0.42 -0.08 0.00 -1.74 0.00 0.00 39.64 38.67 1va9 n ILE 110 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1va9 s ASN 111 N -2.01 -0.40 -0.41 7.28 0.01 -1.26 -3.68 114.94 114.47 1va9 s ASN 111 Ca 0.12 0.52 0.05 0.00 -0.71 0.00 0.00 52.86 52.84 1va9 s ASN 111 Cb 0.01 0.58 0.17 0.00 0.41 0.00 0.00 41.25 42.41 1va9 s ASN 111 CO 0.09 -0.40 0.48 0.00 -1.51 0.00 0.00 177.10 175.76 1va9 s ALA 112 N -0.80 -0.94 -0.36 0.60 0.00 -0.96 -4.86 121.76 114.43 1va9 s ALA 112 Ca -0.09 -0.78 -0.28 0.00 0.00 0.00 0.00 51.96 50.82 1va9 s ALA 112 Cb -0.03 -2.27 -0.07 0.00 0.00 0.00 0.00 23.12 20.75 1va9 s ALA 112 CO 0.05 -2.16 2.32 2.41 0.00 0.00 0.00 175.76 178.37 1va9 n THR 113 N 3.95 0.15 -1.11 0.00 -1.04 -1.26 -4.16 114.28 110.80 1va9 n THR 113 Ca 0.14 -0.58 -0.37 0.00 -2.04 0.00 0.00 64.05 61.20 1va9 n THR 113 Cb 0.50 -2.57 0.03 0.00 -1.82 0.00 0.00 70.33 66.47 1va9 n THR 113 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1va9 n THR 114 N 7.83 0.13 -0.68 12.58 -2.24 -0.99 -4.79 114.28 126.11 1va9 n THR 114 Ca 0.34 -0.48 -0.26 0.00 -2.27 0.00 0.00 64.05 61.39 1va9 n THR 114 Cb 0.47 -0.07 0.12 0.00 -2.10 0.00 0.00 70.33 68.75 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 2.69 -2.05 -0.52 3.22 7.99 -1.26 -3.45 117.00 123.61 1va9 n LEU 115 Ca 0.03 -0.20 0.13 0.00 -0.01 0.00 0.00 56.01 55.95 1va9 n LEU 115 Cb 0.52 -0.76 0.27 0.00 -0.11 0.00 0.00 43.42 43.34 1va9 n LEU 115 CO 0.53 -2.96 0.63 1.21 -1.51 0.00 0.00 177.39 175.29 1va9 n GLU 116 N -0.82 1.47 -2.82 3.23 2.13 -1.26 -1.00 120.64 121.56 1va9 n GLU 116 Ca 0.02 -1.05 -0.02 0.00 0.66 0.00 0.00 57.16 56.77 1va9 n GLU 116 Cb 0.50 -1.48 -0.02 0.00 0.27 0.00 0.00 31.44 30.71 1va9 n GLU 116 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1va9 n SER 117 N 0.16 -4.74 -0.55 4.31 7.64 -1.26 -4.80 113.62 114.37 1va9 n SER 117 Ca 0.14 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.17 1va9 n SER 117 Cb 0.43 -3.93 0.00 0.00 -1.01 0.00 0.00 64.21 59.70 1va9 n SER 117 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1va9 n GLY 118 N 1.60 5.67 2.64 0.23 0.00 -1.26 -5.02 105.19 109.05 1va9 n GLY 118 Ca -0.17 -1.81 -0.34 0.00 0.00 0.00 0.00 46.02 43.70 1va9 n GLY 118 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1va9 n PRO 119 N 0.00 2.56 -3.11 1.61 -0.04 -1.26 -4.66 135.00 130.10 1va9 n PRO 119 Ca 0.00 -1.93 0.00 0.00 -0.04 0.00 0.00 63.50 61.53 1va9 n PRO 119 Cb 0.00 -2.78 0.00 0.00 -0.04 0.00 0.00 33.50 30.68 1va9 n PRO 119 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1va9 n SER 120 N 4.96 -6.39 -4.57 3.54 2.88 -1.26 -4.86 113.62 107.93 1va9 n SER 120 Ca 0.56 0.40 -0.41 0.00 -1.33 0.00 0.00 58.87 58.09 1va9 n SER 120 Cb 0.25 -1.53 -0.08 0.00 -0.75 0.00 0.00 64.21 62.11 1va9 n SER 120 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1va9 s SER 121 N -0.96 6.34 0.00 -3.46 0.01 -1.26 -5.26 113.70 109.11 1va9 s SER 121 Ca 0.00 0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.33 1va9 s SER 121 Cb 0.00 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 63.96 1va9 s SER 121 CO 0.00 -0.45 0.00 0.61 0.41 0.00 0.00 173.24 173.81