#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 -0.22 -0.21 1.61 1.04 -1.26 -5.18 113.70 109.48 1va9 s SER 2 Ca 0.00 0.40 -0.34 0.00 0.48 0.00 0.00 55.95 56.49 1va9 s SER 2 Cb 0.00 0.57 0.15 0.00 0.10 0.00 0.00 66.02 66.83 1va9 s SER 2 CO 0.00 -0.07 1.23 -0.55 0.98 0.00 0.00 173.24 174.83 1va9 s SER 3 N 0.35 -0.13 0.00 7.02 0.15 -1.26 -5.12 113.70 114.72 1va9 s SER 3 Ca 0.02 0.04 0.00 0.00 0.70 0.00 0.00 55.95 56.72 1va9 s SER 3 Cb -0.04 0.13 0.00 0.00 -1.71 0.00 0.00 66.02 64.39 1va9 s SER 3 CO -0.12 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 174.74 1va9 n GLY 4 N 0.10 -1.90 3.05 9.45 0.00 -1.26 -5.12 105.19 109.51 1va9 n GLY 4 Ca -0.00 0.87 -0.05 0.00 0.00 0.00 0.00 46.02 46.84 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 -0.77 0.20 1.61 0.15 -1.26 -5.15 113.70 108.49 1va9 s SER 5 Ca 0.00 -1.10 -0.05 0.00 0.70 0.00 0.00 55.95 55.50 1va9 s SER 5 Cb 0.00 1.55 -0.03 0.00 -1.71 0.00 0.00 66.02 65.83 1va9 s SER 5 CO 0.00 -0.18 0.23 -0.44 1.20 0.00 0.00 173.24 174.05 1va9 s SER 6 N 1.64 0.09 -0.45 5.45 0.01 -1.26 -5.03 113.70 114.15 1va9 s SER 6 Ca 0.17 -1.20 0.09 0.00 1.31 0.00 0.00 55.95 56.32 1va9 s SER 6 Cb -0.07 0.43 0.32 0.00 0.21 0.00 0.00 66.02 66.92 1va9 s SER 6 CO -0.06 -0.92 0.75 0.61 0.41 0.00 0.00 173.24 174.04 1va9 n GLY 7 N -0.28 4.08 3.49 3.44 0.00 -1.26 -5.01 105.19 109.64 1va9 n GLY 7 Ca -0.00 -2.03 -0.39 0.00 0.00 0.00 0.00 46.02 43.59 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 -2.74 4.96 -0.50 -0.61 1.01 -1.26 -3.12 121.20 118.94 1va9 s ILE 8 Ca 0.41 -0.32 0.07 0.00 0.00 0.00 0.00 60.65 60.82 1va9 s ILE 8 Cb 0.29 -3.54 0.25 0.00 0.01 0.00 0.00 42.46 39.46 1va9 s ILE 8 CO -0.09 0.03 0.61 -1.20 0.00 0.00 0.00 174.94 174.28 1va9 n SER 9 N 5.05 1.73 -1.72 3.58 7.64 -1.26 -5.06 113.62 123.58 1va9 n SER 9 Ca -0.13 -3.01 0.00 0.00 1.01 0.00 0.00 58.87 56.74 1va9 n SER 9 Cb 0.49 -0.65 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 1va9 n SER 9 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1va9 n THR 10 N 1.21 -5.52 -3.13 0.44 -1.04 -1.26 -4.84 114.28 100.13 1va9 n THR 10 Ca 0.25 2.52 -0.00 0.00 -2.04 0.00 0.00 64.05 64.78 1va9 n THR 10 Cb 0.48 -3.39 -0.00 0.00 -1.82 0.00 0.00 70.33 65.60 1va9 n THR 10 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1va9 n GLU 11 N -0.18 -0.73 -0.63 -2.82 1.02 -1.26 -4.92 120.64 111.12 1va9 n GLU 11 Ca 0.00 1.02 -0.27 0.00 -0.02 0.00 0.00 57.16 57.89 1va9 n GLU 11 Cb 0.00 -1.24 0.25 0.00 -0.02 0.00 0.00 31.44 30.42 1va9 n GLU 11 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1va9 n GLU 12 N 1.54 -3.67 -3.74 3.49 4.71 -1.26 -5.08 120.64 116.63 1va9 n GLU 12 Ca -0.01 -1.48 -0.14 0.00 -0.01 0.00 0.00 57.16 55.53 1va9 n GLU 12 Cb 0.37 -1.59 -0.09 0.00 -1.01 0.00 0.00 31.44 29.12 1va9 n GLU 12 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1va9 s ALA 13 N -2.63 -0.91 0.98 0.62 0.00 -1.21 -4.93 121.76 113.67 1va9 s ALA 13 Ca 0.63 0.66 -0.14 0.00 0.00 0.00 0.00 51.96 53.11 1va9 s ALA 13 Cb -0.08 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.86 1va9 s ALA 13 CO 0.50 -0.24 0.08 0.00 0.00 0.00 0.00 175.76 176.10 1va9 n ALA 14 N 1.81 -3.41 -1.82 0.00 0.00 -1.25 -4.60 120.51 111.25 1va9 n ALA 14 Ca -0.18 -0.71 -0.40 0.00 0.00 0.00 0.00 53.44 52.14 1va9 n ALA 14 Cb 0.57 -1.62 -0.04 0.00 0.00 0.00 0.00 19.45 18.36 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 -3.25 4.65 -0.58 0.00 0.04 -1.26 -4.73 135.00 129.87 1va9 s PRO 15 Ca 0.53 1.76 0.02 0.00 0.04 0.00 0.00 61.00 63.35 1va9 s PRO 15 Cb -0.19 -3.21 0.41 0.00 0.04 0.00 0.00 34.50 31.55 1va9 s PRO 15 CO 0.70 0.21 1.60 -0.25 0.04 0.00 0.00 177.00 179.31 1va9 n ASP 16 N 1.45 6.26 0.00 6.66 8.00 -0.50 -3.82 116.55 134.59 1va9 n ASP 16 Ca -0.00 -3.78 0.00 0.00 0.71 0.00 0.00 54.79 51.72 1va9 n ASP 16 Cb 0.45 -0.73 0.00 0.00 -0.02 0.00 0.00 41.12 40.82 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 -0.64 1.36 3.78 0.44 0.00 -1.26 -4.86 105.19 104.00 1va9 n GLY 17 Ca 0.50 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 46.21 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 -1.23 0.37 0.87 1.61 0.04 -1.24 -4.59 135.00 130.84 1va9 s PRO 18 Ca 0.00 0.00 -0.12 0.00 0.04 0.00 0.00 61.00 60.92 1va9 s PRO 18 Cb 0.00 -1.78 0.12 0.00 0.04 0.00 0.00 34.50 32.88 1va9 s PRO 18 CO 0.00 -2.66 1.12 -1.25 0.04 0.00 0.00 177.00 174.25 1va9 s PRO 19 N -5.48 1.45 0.30 0.56 0.04 -1.26 -4.29 135.00 126.33 1va9 s PRO 19 Ca 0.68 0.40 0.08 0.00 0.04 0.00 0.00 61.00 62.20 1va9 s PRO 19 Cb -0.10 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.54 1va9 s PRO 19 CO 0.54 -2.01 0.21 -1.64 0.04 0.00 0.00 177.00 174.14 1va9 s MET 20 N -5.24 2.70 -1.26 4.56 -1.94 -0.88 -4.63 119.30 112.61 1va9 s MET 20 Ca 0.63 -1.27 -0.01 0.00 -1.71 0.00 0.00 55.69 53.33 1va9 s MET 20 Cb -0.15 -2.43 -0.00 0.00 2.01 0.00 0.00 34.83 34.26 1va9 s MET 20 CO 0.54 0.22 0.81 -3.47 -0.01 0.00 0.00 175.02 173.11 1va9 n ASP 21 N -1.23 -1.75 -4.50 3.03 2.03 -1.26 -0.25 116.55 112.61 1va9 n ASP 21 Ca -0.04 -0.75 -0.43 0.00 0.52 0.00 0.00 54.79 54.08 1va9 n ASP 21 Cb 0.59 -4.44 -0.05 0.00 -0.72 0.00 0.00 41.12 36.50 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 -3.55 4.54 0.01 5.18 1.01 -1.26 -3.58 120.40 122.76 1va9 s VAL 22 Ca 0.03 0.09 -0.09 0.00 0.00 0.00 0.00 61.98 62.01 1va9 s VAL 22 Cb -0.01 -4.45 0.01 0.00 0.00 0.00 0.00 36.38 31.93 1va9 s VAL 22 CO 0.78 -0.99 0.19 0.28 0.00 0.00 0.00 175.10 175.36 1va9 s THR 23 N 3.53 0.09 0.33 3.92 -1.32 -1.16 -4.95 115.64 116.08 1va9 s THR 23 Ca 0.26 -0.72 0.07 0.00 -1.21 0.00 0.00 61.69 60.10 1va9 s THR 23 Cb -0.14 -0.62 -0.02 0.00 -1.51 0.00 0.00 72.50 70.21 1va9 s THR 23 CO 0.18 -0.39 0.35 -0.76 -2.21 0.00 0.00 174.62 171.78 1va9 s LEU 24 N -1.59 3.76 -0.30 9.08 2.01 -1.26 -2.49 118.68 127.89 1va9 s LEU 24 Ca -0.12 -0.36 -0.07 0.00 0.01 0.00 0.00 54.13 53.60 1va9 s LEU 24 Cb -0.05 -2.42 0.16 0.00 0.01 0.00 0.00 46.19 43.88 1va9 s LEU 24 CO 0.00 -0.36 0.66 -1.58 1.01 0.00 0.00 176.35 176.09 1va9 s GLN 25 N -4.05 0.55 -0.50 1.70 0.74 0.12 -4.94 119.66 113.28 1va9 s GLN 25 Ca 0.42 1.20 -0.28 0.00 0.05 0.00 0.00 55.36 56.74 1va9 s GLN 25 Cb -0.07 0.70 0.01 0.00 1.10 0.00 0.00 33.01 34.75 1va9 s GLN 25 CO 0.28 -0.37 1.46 -1.25 -0.55 0.00 0.00 175.29 174.86 1va9 s PRO 26 N 2.86 3.36 -0.05 1.67 0.04 -1.26 0.20 135.00 141.81 1va9 s PRO 26 Ca 0.06 0.69 -0.00 0.00 0.04 0.00 0.00 61.00 61.78 1va9 s PRO 26 Cb -0.13 -4.11 -0.26 0.00 0.04 0.00 0.00 34.50 30.04 1va9 s PRO 26 CO -0.20 -1.85 0.62 -0.39 0.04 0.00 0.00 177.00 175.23 1va9 h VAL 27 N 6.47 0.87 -0.87 -0.36 -1.51 -1.92 -3.45 116.25 115.48 1va9 h VAL 27 Ca -0.27 -2.60 0.00 0.00 -1.23 0.00 0.00 66.70 62.60 1va9 h VAL 27 Cb 1.11 2.57 0.00 0.00 -2.13 0.00 0.00 31.29 32.84 1va9 h VAL 27 CO 1.14 0.76 0.00 0.35 -1.23 0.00 0.00 177.57 178.59 1va9 n THR 28 N -3.35 0.00 -0.02 7.19 -2.24 -1.26 -5.02 114.28 109.58 1va9 n THR 28 Ca -0.22 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.58 1va9 n THR 28 Cb 1.05 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 69.21 1va9 n THR 28 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1va9 n SER 29 N 0.00 2.85 -2.30 3.42 2.88 -1.26 -3.34 113.62 115.87 1va9 n SER 29 Ca 0.00 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.38 1va9 n SER 29 Cb 0.00 1.20 0.03 0.00 -0.75 0.00 0.00 64.21 64.69 1va9 n SER 29 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1va9 n GLN 30 N -1.99 2.98 -3.73 -1.46 6.02 -1.26 -3.86 117.38 114.08 1va9 n GLN 30 Ca -0.06 -3.96 -0.05 0.00 -0.01 0.00 0.00 57.00 52.92 1va9 n GLN 30 Cb 0.42 -2.05 -0.02 0.00 1.02 0.00 0.00 30.24 29.61 1va9 n GLN 30 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1va9 s SER 31 N -3.66 -0.23 -0.18 1.08 0.15 -1.26 -1.23 113.70 108.37 1va9 s SER 31 Ca 0.43 -0.38 -0.15 0.00 0.70 0.00 0.00 55.95 56.54 1va9 s SER 31 Cb 0.38 0.53 0.05 0.00 -1.71 0.00 0.00 66.02 65.28 1va9 s SER 31 CO 0.01 -0.97 0.48 -0.63 1.20 0.00 0.00 173.24 173.33 1va9 s ILE 32 N -3.42 -0.01 -0.14 6.45 1.01 -0.95 -4.11 121.20 120.02 1va9 s ILE 32 Ca 0.11 0.02 -0.17 0.00 0.00 0.00 0.00 60.65 60.61 1va9 s ILE 32 Cb -0.02 -0.68 -0.04 0.00 0.01 0.00 0.00 42.46 41.73 1va9 s ILE 32 CO 0.01 0.01 0.42 -1.58 0.00 0.00 0.00 174.94 173.80 1va9 s GLN 33 N 0.56 4.29 -0.25 2.79 0.74 0.53 -1.31 119.66 127.01 1va9 s GLN 33 Ca -0.02 0.32 -0.01 0.00 0.05 0.00 0.00 55.36 55.70 1va9 s GLN 33 Cb -0.04 -3.45 0.04 0.00 1.10 0.00 0.00 33.01 30.65 1va9 s GLN 33 CO -0.03 0.14 -0.07 0.08 -0.55 0.00 0.00 175.29 174.86 1va9 s VAL 34 N 0.72 2.70 -0.10 1.34 1.01 -0.44 0.13 120.40 125.76 1va9 s VAL 34 Ca 0.22 -1.19 0.01 0.00 0.00 0.00 0.00 61.98 61.03 1va9 s VAL 34 Cb -0.14 -2.42 -0.02 0.00 0.00 0.00 0.00 36.38 33.79 1va9 s VAL 34 CO 0.08 0.14 -0.13 0.42 0.00 0.00 0.00 175.10 175.61 1va9 s THR 35 N 1.27 3.11 0.32 3.92 -4.23 -1.04 -1.60 115.64 117.39 1va9 s THR 35 Ca -0.02 -0.67 -0.02 0.00 -1.18 0.00 0.00 61.69 59.80 1va9 s THR 35 Cb -0.17 -2.27 -0.01 0.00 1.34 0.00 0.00 72.50 71.39 1va9 s THR 35 CO -0.05 0.55 0.42 -1.66 -0.54 0.00 0.00 174.62 173.35 1va9 s TRP 36 N -0.13 1.08 0.14 3.99 -2.14 -1.00 -2.98 118.94 117.90 1va9 s TRP 36 Ca -0.01 -1.29 0.02 0.00 2.66 0.00 0.00 56.10 57.48 1va9 s TRP 36 Cb -0.14 -0.17 -0.04 0.00 -3.10 0.00 0.00 33.47 30.02 1va9 s TRP 36 CO 0.03 -1.05 -0.03 0.15 -2.66 0.00 0.00 176.95 173.39 1va9 s LYS 37 N -3.29 0.98 0.25 3.25 1.02 0.65 -3.17 119.74 119.42 1va9 s LYS 37 Ca 0.32 -1.44 -0.28 0.00 0.02 0.00 0.00 55.97 54.59 1va9 s LYS 37 Cb 0.01 -0.26 -0.16 0.00 -0.52 0.00 0.00 37.83 36.90 1va9 s LYS 37 CO 0.19 -0.07 0.69 0.00 -0.92 0.00 0.00 175.35 175.25 1va9 n ALA 38 N -0.15 -1.84 -1.53 5.17 0.00 0.75 -2.07 120.51 120.84 1va9 n ALA 38 Ca -0.09 0.40 -0.29 0.00 0.00 0.00 0.00 53.44 53.46 1va9 n ALA 38 Cb 0.62 -1.77 0.15 0.00 0.00 0.00 0.00 19.45 18.45 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 -1.23 0.85 0.89 0.00 0.04 -1.26 -4.13 135.00 130.16 1va9 s PRO 39 Ca 0.62 0.18 -0.17 0.00 0.04 0.00 0.00 61.00 61.67 1va9 s PRO 39 Cb -0.83 -1.82 -0.15 0.00 0.04 0.00 0.00 34.50 31.75 1va9 s PRO 39 CO 0.58 -2.37 -0.66 1.63 0.04 0.00 0.00 177.00 176.21 1va9 n LYS 40 N -3.87 0.00 -0.08 4.56 4.01 -1.26 -4.68 118.16 116.84 1va9 n LYS 40 Ca 0.08 0.00 -0.15 0.00 -0.51 0.00 0.00 58.31 57.73 1va9 n LYS 40 Cb 0.59 -0.99 -0.11 0.00 -0.51 0.00 0.00 35.03 34.01 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 -0.79 0.00 0.00 1.97 1.63 -1.98 -0.64 116.57 116.76 1va9 h LYS 41 Ca -0.43 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.37 1va9 h LYS 41 Cb 1.32 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.95 1va9 h LYS 41 CO 0.27 0.87 0.00 -0.85 -3.45 0.00 0.00 179.45 176.29 1va9 n GLU 42 N -4.56 0.04 -0.01 1.90 0.28 -1.26 -0.96 120.64 116.07 1va9 n GLU 42 Ca -0.17 0.41 0.07 0.00 -0.16 0.00 0.00 57.16 57.32 1va9 n GLU 42 Cb 0.50 -1.60 -0.12 0.00 1.43 0.00 0.00 31.44 31.65 1va9 n GLU 42 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1va9 n LEU 43 N -1.68 0.00 -0.21 -1.84 4.77 -1.24 -4.50 117.00 112.30 1va9 n LEU 43 Ca 0.01 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.01 1va9 n LEU 43 Cb 0.10 0.01 0.12 0.00 -2.33 0.00 0.00 43.42 41.32 1va9 n LEU 43 CO 0.09 0.01 0.89 1.56 -1.33 0.00 0.00 177.39 178.61 1va9 h GLN 44 N 0.00 0.20 -5.81 3.23 4.20 0.60 -1.33 115.11 116.20 1va9 h GLN 44 Ca -0.01 -0.01 -0.38 0.00 0.06 0.00 0.00 58.65 58.30 1va9 h GLN 44 Cb 0.73 -0.05 0.14 0.00 0.30 0.00 0.00 27.48 28.61 1va9 h GLN 44 CO 0.00 0.13 -0.70 0.09 -0.67 0.00 0.00 178.83 177.68 1va9 n ASN 45 N -5.19 -5.24 0.00 1.46 3.02 -1.24 -4.12 115.26 103.95 1va9 n ASN 45 Ca 0.10 -0.57 0.00 0.00 -0.03 0.00 0.00 54.58 54.08 1va9 n ASN 45 Cb 0.36 -5.04 0.00 0.00 -0.61 0.00 0.00 39.78 34.49 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 -1.78 0.23 3.96 7.41 0.00 -1.18 -3.32 105.19 110.50 1va9 n GLY 46 Ca -0.07 -2.23 -0.23 0.00 0.00 0.00 0.00 46.02 43.50 1va9 n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1va9 s VAL 47 N 0.00 2.59 0.11 1.61 0.11 -1.26 -4.45 120.40 119.11 1va9 s VAL 47 Ca 0.00 -0.52 0.08 0.00 -2.93 0.00 0.00 61.98 58.61 1va9 s VAL 47 Cb 0.00 -3.02 -0.04 0.00 -1.53 0.00 0.00 36.38 31.79 1va9 s VAL 47 CO 0.00 -0.02 -0.12 -0.63 -3.33 0.00 0.00 175.10 171.00 1va9 s ILE 48 N -2.92 3.24 -0.05 7.04 -1.09 -1.26 -4.79 121.20 121.36 1va9 s ILE 48 Ca 0.58 -1.34 0.03 0.00 -2.23 0.00 0.00 60.65 57.69 1va9 s ILE 48 Cb -0.10 -2.51 -0.05 0.00 -1.58 0.00 0.00 42.46 38.21 1va9 s ILE 48 CO 0.41 0.10 -0.01 0.54 -1.23 0.00 0.00 174.94 174.74 1va9 n ARG 49 N 0.70 1.91 -3.70 2.79 5.12 -1.18 -4.99 116.66 117.31 1va9 n ARG 49 Ca -0.14 0.01 0.01 0.00 -1.93 0.00 0.00 57.85 55.81 1va9 n ARG 49 Cb 0.52 -1.12 -0.00 0.00 -1.16 0.00 0.00 32.46 30.70 1va9 n ARG 49 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1va9 s GLY 50 N -4.01 -0.33 0.08 -0.13 0.00 -0.63 -3.14 107.32 99.16 1va9 s GLY 50 Ca -0.05 0.49 0.05 0.00 0.00 0.00 0.00 44.72 45.21 1va9 s GLY 50 CO 0.17 1.14 -0.13 -0.19 0.00 0.00 0.00 173.10 174.09 1va9 s TYR 51 N -2.41 1.16 -0.14 1.90 1.51 -1.12 0.13 117.35 118.38 1va9 s TYR 51 Ca 0.17 -0.52 -0.05 0.00 -1.01 0.00 0.00 57.07 55.66 1va9 s TYR 51 Cb 0.03 -0.65 -0.04 0.00 -0.11 0.00 0.00 41.96 41.20 1va9 s TYR 51 CO -0.02 0.05 0.04 -0.65 -1.11 0.00 0.00 175.55 173.85 1va9 s GLN 52 N -2.08 3.53 -0.36 -0.62 -0.21 0.34 -3.39 119.66 116.87 1va9 s GLN 52 Ca 0.00 -0.36 -0.04 0.00 0.02 0.00 0.00 55.36 54.98 1va9 s GLN 52 Cb -0.08 -3.02 0.07 0.00 1.00 0.00 0.00 33.01 30.98 1va9 s GLN 52 CO 0.02 0.48 0.13 0.42 -2.12 0.00 0.00 175.29 174.22 1va9 s ILE 53 N -0.23 3.46 -0.46 1.08 1.09 -1.10 -1.00 121.20 124.04 1va9 s ILE 53 Ca 0.07 -1.55 -0.17 0.00 -1.10 0.00 0.00 60.65 57.89 1va9 s ILE 53 Cb -0.12 -3.13 0.05 0.00 -1.06 0.00 0.00 42.46 38.20 1va9 s ILE 53 CO 0.02 -0.38 0.47 -0.83 -0.10 0.00 0.00 174.94 174.12 1va9 s GLY 54 N 1.62 1.90 0.02 6.18 0.00 0.85 -2.32 107.32 115.57 1va9 s GLY 54 Ca 0.01 -1.75 0.07 0.00 0.00 0.00 0.00 44.72 43.05 1va9 s GLY 54 CO -0.01 1.21 -0.20 -2.52 0.00 0.00 0.00 173.10 171.58 1va9 s TYR 55 N 2.13 1.79 -0.12 1.90 1.13 0.24 0.13 117.35 124.55 1va9 s TYR 55 Ca 0.10 -0.36 -0.23 0.00 -1.41 0.00 0.00 57.07 55.18 1va9 s TYR 55 Cb -0.20 -1.10 0.05 0.00 -1.10 0.00 0.00 41.96 39.62 1va9 s TYR 55 CO 0.11 0.04 0.56 -0.98 -2.51 0.00 0.00 175.55 172.77 1va9 s ARG 56 N -0.88 0.81 0.35 -3.49 1.70 -1.25 0.36 118.95 116.55 1va9 s ARG 56 Ca 0.07 0.42 -0.29 0.00 -0.47 0.00 0.00 55.73 55.47 1va9 s ARG 56 Cb -0.08 0.38 -0.11 0.00 -0.57 0.00 0.00 34.95 34.57 1va9 s ARG 56 CO 0.01 -0.19 1.51 -2.00 -1.08 0.00 0.00 175.30 173.55 1va9 s GLU 57 N -0.53 4.11 -0.51 3.89 2.12 -1.26 -3.52 118.70 123.00 1va9 s GLU 57 Ca -0.06 2.57 -0.01 0.00 0.36 0.00 0.00 54.97 57.83 1va9 s GLU 57 Cb -0.03 -2.98 0.38 0.00 0.26 0.00 0.00 34.13 31.76 1va9 s GLU 57 CO 0.05 -0.56 1.99 -1.71 -0.54 0.00 0.00 175.26 174.49 1va9 n ASN 58 N 0.91 6.79 -4.25 -1.70 2.85 -1.05 -4.78 115.26 114.04 1va9 n ASN 58 Ca 0.03 -3.48 -0.14 0.00 -0.11 0.00 0.00 54.58 50.88 1va9 n ASN 58 Cb 0.39 -0.98 -0.10 0.00 1.24 0.00 0.00 39.78 40.33 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 -1.03 0.77 -0.51 1.20 0.01 -1.26 -4.94 113.70 107.94 1va9 s SER 59 Ca 0.51 -1.33 -0.28 0.00 1.31 0.00 0.00 55.95 56.16 1va9 s SER 59 Cb 0.40 0.24 0.01 0.00 0.21 0.00 0.00 66.02 66.88 1va9 s SER 59 CO 0.00 -0.74 1.47 -2.16 0.41 0.00 0.00 173.24 172.23 1va9 s PRO 60 N -4.05 3.32 0.00 12.44 0.04 -1.26 -3.66 135.00 141.83 1va9 s PRO 60 Ca 0.34 0.65 0.00 0.00 0.04 0.00 0.00 61.00 62.03 1va9 s PRO 60 Cb 0.07 -4.12 0.00 0.00 0.04 0.00 0.00 34.50 30.49 1va9 s PRO 60 CO 0.10 -1.89 0.00 0.41 0.04 0.00 0.00 177.00 175.65 1va9 n GLY 61 N 5.26 1.17 3.64 0.56 0.00 -1.26 -5.13 105.19 109.43 1va9 n GLY 61 Ca 0.15 -0.02 -0.45 0.00 0.00 0.00 0.00 46.02 45.70 1va9 n GLY 61 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1va9 n SER 62 N 0.00 2.22 -0.41 1.61 2.88 -1.24 -4.78 113.62 113.90 1va9 n SER 62 Ca 0.00 1.16 0.37 0.00 -1.33 0.00 0.00 58.87 59.07 1va9 n SER 62 Cb 0.00 -1.37 0.71 0.00 -0.75 0.00 0.00 64.21 62.80 1va9 n SER 62 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1va9 h ASN 63 N 3.34 0.11 0.00 -3.46 -1.07 -1.96 -3.45 115.58 109.09 1va9 h ASN 63 Ca -0.44 0.03 0.00 0.00 0.07 0.00 0.00 56.30 55.96 1va9 h ASN 63 Cb 1.30 0.02 0.00 0.00 -2.07 0.00 0.00 38.32 37.57 1va9 h ASN 63 CO 0.69 -0.01 0.00 0.61 0.07 0.00 0.00 177.43 178.79 1va9 n GLY 64 N -1.72 3.30 3.68 9.14 0.00 -1.26 -5.06 105.19 113.27 1va9 n GLY 64 Ca 0.31 -0.92 -0.46 0.00 0.00 0.00 0.00 46.02 44.94 1va9 n GLY 64 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1va9 n GLN 65 N 0.00 2.38 -1.66 1.61 6.02 -1.26 -4.84 117.38 119.62 1va9 n GLN 65 Ca 0.00 0.87 -0.46 0.00 -0.01 0.00 0.00 57.00 57.40 1va9 n GLN 65 Cb 0.00 -2.73 -0.04 0.00 1.02 0.00 0.00 30.24 28.49 1va9 n GLN 65 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1va9 n TYR 66 N 6.11 2.36 -1.73 1.08 4.02 -1.26 -4.84 117.16 122.89 1va9 n TYR 66 Ca 0.21 -0.16 -0.41 0.00 -0.01 0.00 0.00 57.90 57.53 1va9 n TYR 66 Cb 0.32 -2.72 -0.03 0.00 -0.02 0.00 0.00 39.34 36.89 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 4.62 5.34 0.23 7.72 0.01 0.16 -4.65 113.70 127.12 1va9 s SER 67 Ca 0.92 1.47 -0.12 0.00 1.31 0.00 0.00 55.95 59.53 1va9 s SER 67 Cb -0.57 -2.51 -0.07 0.00 0.21 0.00 0.00 66.02 63.07 1va9 s SER 67 CO 0.47 -2.12 0.59 -0.63 0.41 0.00 0.00 173.24 171.96 1va9 s ILE 68 N 8.82 4.86 -0.17 1.44 -1.09 -1.26 -0.59 121.20 133.21 1va9 s ILE 68 Ca 0.92 0.67 -0.04 0.00 -2.23 0.00 0.00 60.65 59.97 1va9 s ILE 68 Cb -0.26 -3.65 0.08 0.00 -1.58 0.00 0.00 42.46 37.05 1va9 s ILE 68 CO 0.32 -0.01 0.19 0.68 -1.23 0.00 0.00 174.94 174.90 1va9 s VAL 69 N -1.75 -0.29 0.13 2.92 -7.23 -0.98 -4.94 120.40 108.26 1va9 s VAL 69 Ca 0.46 0.01 -0.29 0.00 -1.81 0.00 0.00 61.98 60.36 1va9 s VAL 69 Cb -0.12 -0.56 -0.07 0.00 0.56 0.00 0.00 36.38 36.19 1va9 s VAL 69 CO 0.20 -0.11 0.90 -0.70 -0.31 0.00 0.00 175.10 175.08 1va9 s GLU 70 N 2.30 4.68 0.01 4.82 2.12 -1.26 -2.70 118.70 128.67 1va9 s GLU 70 Ca 0.05 1.36 -0.19 0.00 0.36 0.00 0.00 54.97 56.55 1va9 s GLU 70 Cb -0.15 -3.34 0.04 0.00 0.26 0.00 0.00 34.13 30.94 1va9 s GLU 70 CO -0.10 0.34 0.42 0.00 -0.54 0.00 0.00 175.26 175.37 1va9 s MET 71 N -0.41 0.86 0.35 4.30 0.23 -1.22 -5.06 119.30 118.36 1va9 s MET 71 Ca 0.43 -0.21 -0.17 0.00 -1.03 0.00 0.00 55.69 54.71 1va9 s MET 71 Cb -0.23 0.39 -0.10 0.00 -1.53 0.00 0.00 34.83 33.36 1va9 s MET 71 CO 0.29 -0.27 0.80 -1.59 -2.03 0.00 0.00 175.02 172.21 1va9 s LYS 72 N -1.90 4.09 0.12 3.16 -2.85 -1.26 -2.78 119.74 118.32 1va9 s LYS 72 Ca -0.09 0.82 -0.26 0.00 -1.00 0.00 0.00 55.97 55.44 1va9 s LYS 72 Cb -0.02 -2.39 -0.07 0.00 -2.06 0.00 0.00 37.83 33.29 1va9 s LYS 72 CO 0.02 0.12 0.81 0.00 0.10 0.00 0.00 175.35 176.40 1va9 s ALA 73 N -2.01 3.38 -0.32 0.59 0.00 -1.19 -4.88 121.76 117.34 1va9 s ALA 73 Ca 0.56 0.39 0.03 0.00 0.00 0.00 0.00 51.96 52.94 1va9 s ALA 73 Cb -0.10 -3.04 0.41 0.00 0.00 0.00 0.00 23.12 20.38 1va9 s ALA 73 CO 0.16 0.16 1.48 0.25 0.00 0.00 0.00 175.76 177.81 1va9 n THR 74 N 2.19 2.16 0.00 0.00 -2.24 -1.21 -4.98 114.28 110.21 1va9 n THR 74 Ca -0.03 -1.06 0.00 0.00 -2.27 0.00 0.00 64.05 60.69 1va9 n THR 74 Cb 0.49 -0.63 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 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 -0.30 0.13 0.23 3.38 0.00 -1.26 -4.65 105.19 102.71 1va9 n GLY 75 Ca 0.31 -1.71 0.11 0.00 0.00 0.00 0.00 46.02 44.73 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 0.00 -3.33 1.61 3.32 -2.00 -3.44 116.42 112.59 1va9 h ASP 76 Ca 0.00 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.39 1va9 h ASP 76 Cb 0.00 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 39.36 1va9 h ASP 76 CO 0.00 0.17 -0.82 -0.94 -1.72 0.00 0.00 179.24 175.93 1va9 s SER 77 N -6.10 3.50 0.06 6.45 1.04 -1.26 -0.18 113.70 117.21 1va9 s SER 77 Ca 0.02 -0.81 -0.10 0.00 0.48 0.00 0.00 55.95 55.54 1va9 s SER 77 Cb 0.09 -0.30 0.00 0.00 0.10 0.00 0.00 66.02 65.92 1va9 s SER 77 CO 0.63 0.13 0.20 -1.61 0.98 0.00 0.00 173.24 173.57 1va9 s GLU 78 N -2.55 0.75 -0.03 4.02 8.01 -1.19 -3.28 118.70 124.42 1va9 s GLU 78 Ca 0.20 -0.72 -0.17 0.00 0.01 0.00 0.00 54.97 54.29 1va9 s GLU 78 Cb -0.08 0.31 0.03 0.00 -4.31 0.00 0.00 34.13 30.08 1va9 s GLU 78 CO 0.10 -0.23 0.37 0.54 0.01 0.00 0.00 175.26 176.05 1va9 s VAL 79 N -2.97 0.04 -0.10 2.63 0.11 -1.26 -2.37 120.40 116.48 1va9 s VAL 79 Ca -0.02 -0.36 -0.06 0.00 -2.93 0.00 0.00 61.98 58.61 1va9 s VAL 79 Cb 0.01 -0.66 0.04 0.00 -1.53 0.00 0.00 36.38 34.24 1va9 s VAL 79 CO -0.06 -0.20 0.24 -0.47 -3.33 0.00 0.00 175.10 171.28 1va9 s TYR 80 N -1.14 -0.30 -0.40 1.54 5.04 -0.63 -4.98 117.35 116.48 1va9 s TYR 80 Ca -0.12 0.72 -0.13 0.00 -2.44 0.00 0.00 57.07 55.11 1va9 s TYR 80 Cb -0.04 0.06 0.03 0.00 0.35 0.00 0.00 41.96 42.36 1va9 s TYR 80 CO 0.05 -0.19 0.26 0.99 -1.34 0.00 0.00 175.55 175.31 1va9 s THR 81 N 0.83 4.84 -0.55 4.34 2.01 -1.26 -1.32 115.64 124.53 1va9 s THR 81 Ca -0.06 -0.85 -0.28 0.00 0.31 0.00 0.00 61.69 60.81 1va9 s THR 81 Cb -0.07 -3.74 0.02 0.00 0.01 0.00 0.00 72.50 68.73 1va9 s THR 81 CO -0.05 -0.31 1.26 -0.76 -0.69 0.00 0.00 174.62 174.06 1va9 s LEU 82 N 1.59 3.47 0.36 4.42 2.01 -0.43 -4.84 118.68 125.27 1va9 s LEU 82 Ca 0.03 0.25 0.00 0.00 0.01 0.00 0.00 54.13 54.43 1va9 s LEU 82 Cb -0.20 -3.22 -0.03 0.00 0.01 0.00 0.00 46.19 42.75 1va9 s LEU 82 CO 0.08 -1.51 0.57 1.51 1.01 0.00 0.00 176.35 178.01 1va9 s ASP 83 N 3.33 6.28 0.00 2.29 -4.77 -1.26 -2.25 116.67 120.29 1va9 s ASP 83 Ca 0.47 0.48 0.00 0.00 -3.30 0.00 0.00 52.55 50.20 1va9 s ASP 83 Cb -0.09 -2.03 0.00 0.00 -1.09 0.00 0.00 42.92 39.71 1va9 s ASP 83 CO 0.27 -0.33 0.00 0.59 0.70 0.00 0.00 175.17 176.40 1va9 n ASN 84 N -1.83 -1.90 -4.68 2.11 3.02 -0.36 -4.96 115.26 106.66 1va9 n ASN 84 Ca -0.04 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.22 1va9 n ASN 84 Cb 0.56 -0.47 -0.09 0.00 -0.61 0.00 0.00 39.78 39.16 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 -2.41 2.75 0.44 3.41 1.43 -1.05 -5.00 118.68 118.25 1va9 s LEU 85 Ca 0.00 -1.40 -0.07 0.00 -1.03 0.00 0.00 54.13 51.62 1va9 s LEU 85 Cb 0.00 -0.94 -0.05 0.00 0.03 0.00 0.00 46.19 45.24 1va9 s LEU 85 CO 0.00 -0.59 0.77 -0.75 0.23 0.00 0.00 176.35 176.01 1va9 s LYS 86 N -3.80 3.63 -0.14 1.70 2.20 -1.26 -4.55 119.74 117.52 1va9 s LYS 86 Ca 0.28 0.30 -0.19 0.00 -0.36 0.00 0.00 55.97 55.99 1va9 s LYS 86 Cb 0.07 -2.39 -0.04 0.00 -1.51 0.00 0.00 37.83 33.96 1va9 s LYS 86 CO 0.15 -0.12 0.54 0.15 -0.36 0.00 0.00 175.35 175.70 1va9 s LYS 87 N -4.35 4.30 -1.34 4.03 1.02 -1.25 -4.05 119.74 118.10 1va9 s LYS 87 Ca 0.49 0.53 -0.06 0.00 0.02 0.00 0.00 55.97 56.94 1va9 s LYS 87 Cb -0.10 -3.49 0.02 0.00 -0.52 0.00 0.00 37.83 33.74 1va9 s LYS 87 CO 0.39 0.01 1.02 0.34 -0.92 0.00 0.00 175.35 176.19 1va9 n PHE 88 N 4.18 -2.43 -4.72 3.18 7.35 -1.19 -4.95 117.46 118.87 1va9 n PHE 88 Ca -0.05 0.95 -0.25 0.00 -0.76 0.00 0.00 57.45 57.34 1va9 n PHE 88 Cb 0.51 -4.75 -0.15 0.00 0.35 0.00 0.00 39.48 35.45 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 -3.38 1.59 0.13 3.13 0.00 -1.26 -4.84 121.76 117.14 1va9 s ALA 89 Ca 0.35 -0.92 -0.30 0.00 0.00 0.00 0.00 51.96 51.09 1va9 s ALA 89 Cb -0.16 -0.35 -0.07 0.00 0.00 0.00 0.00 23.12 22.54 1va9 s ALA 89 CO 0.76 0.37 1.14 -1.14 0.00 0.00 0.00 175.76 176.89 1va9 s GLN 90 N -0.84 4.53 -0.04 0.00 0.74 -1.26 -2.75 119.66 120.03 1va9 s GLN 90 Ca 0.07 1.74 0.00 0.00 0.05 0.00 0.00 55.36 57.22 1va9 s GLN 90 Cb -0.08 -3.30 0.02 0.00 1.10 0.00 0.00 33.01 30.75 1va9 s GLN 90 CO 0.01 -0.06 -0.02 0.71 -0.55 0.00 0.00 175.29 175.38 1va9 s TYR 91 N 0.26 0.56 -0.41 1.67 2.02 -1.26 -2.52 117.35 117.68 1va9 s TYR 91 Ca 0.53 -0.12 -0.03 0.00 -0.37 0.00 0.00 57.07 57.08 1va9 s TYR 91 Cb -0.29 -0.59 0.11 0.00 -0.40 0.00 0.00 41.96 40.78 1va9 s TYR 91 CO 0.33 -0.19 0.20 0.20 -1.57 0.00 0.00 175.55 174.52 1va9 s GLY 92 N 1.15 1.99 0.30 0.71 0.00 -1.23 -2.67 107.32 107.57 1va9 s GLY 92 Ca -0.08 -2.52 0.06 0.00 0.00 0.00 0.00 44.72 42.19 1va9 s GLY 92 CO -0.01 1.02 0.41 -1.34 0.00 0.00 0.00 173.10 173.18 1va9 s VAL 93 N 1.14 4.41 -0.04 1.40 -7.23 -1.26 -3.96 120.40 114.88 1va9 s VAL 93 Ca 0.08 -1.04 0.00 0.00 -1.81 0.00 0.00 61.98 59.21 1va9 s VAL 93 Cb -0.23 -3.53 0.03 0.00 0.56 0.00 0.00 36.38 33.21 1va9 s VAL 93 CO -0.04 -0.22 -0.00 0.68 -0.31 0.00 0.00 175.10 175.21 1va9 s VAL 94 N -2.12 0.22 0.06 1.32 -7.23 0.35 -3.69 120.40 109.30 1va9 s VAL 94 Ca 0.41 0.08 -0.03 0.00 -1.81 0.00 0.00 61.98 60.63 1va9 s VAL 94 Cb -0.09 -0.32 -0.05 0.00 0.56 0.00 0.00 36.38 36.48 1va9 s VAL 94 CO 0.30 0.17 0.26 -0.69 -0.31 0.00 0.00 175.10 174.82 1va9 s VAL 95 N 1.15 5.33 -0.18 1.32 1.01 -1.26 -0.10 120.40 127.66 1va9 s VAL 95 Ca -0.08 -0.13 -0.17 0.00 0.00 0.00 0.00 61.98 61.61 1va9 s VAL 95 Cb -0.13 -3.60 0.05 0.00 0.00 0.00 0.00 36.38 32.69 1va9 s VAL 95 CO -0.02 0.20 0.48 0.00 0.00 0.00 0.00 175.10 175.76 1va9 s GLN 96 N -2.28 0.56 -0.06 2.72 -2.07 -0.17 -2.08 119.66 116.28 1va9 s GLN 96 Ca 0.33 0.67 -0.18 0.00 -1.82 0.00 0.00 55.36 54.36 1va9 s GLN 96 Cb -0.13 0.27 -0.05 0.00 -1.09 0.00 0.00 33.01 32.01 1va9 s GLN 96 CO 0.23 -0.07 0.50 0.00 -1.32 0.00 0.00 175.29 174.63 1va9 s ALA 97 N 0.27 3.52 -0.03 2.60 0.00 -1.26 0.13 121.76 126.99 1va9 s ALA 97 Ca -0.00 -0.13 0.04 0.00 0.00 0.00 0.00 51.96 51.87 1va9 s ALA 97 Cb -0.03 -2.62 -0.00 0.00 0.00 0.00 0.00 23.12 20.46 1va9 s ALA 97 CO 0.00 0.15 -0.13 -0.59 0.00 0.00 0.00 175.76 175.19 1va9 s PHE 98 N 0.03 1.30 0.47 0.00 -0.12 0.34 -1.63 117.98 118.36 1va9 s PHE 98 Ca 0.27 -0.31 0.02 0.00 -0.05 0.00 0.00 56.93 56.86 1va9 s PHE 98 Cb -0.16 -0.87 -0.02 0.00 -0.63 0.00 0.00 43.02 41.33 1va9 s PHE 98 CO 0.13 -0.09 0.06 0.54 -0.05 0.00 0.00 175.22 175.81 1va9 s ASN 99 N -0.05 3.58 0.20 1.98 2.20 0.22 -1.61 114.94 121.46 1va9 s ASN 99 Ca -0.00 -1.67 0.17 0.00 -0.94 0.00 0.00 52.86 50.42 1va9 s ASN 99 Cb -0.08 0.52 0.81 0.00 -2.00 0.00 0.00 41.25 40.50 1va9 s ASN 99 CO 0.01 -0.89 1.52 0.54 -2.94 0.00 0.00 177.10 175.34 1va9 n ARG 100 N -1.12 0.11 0.13 3.55 1.74 -1.26 -0.32 116.66 119.48 1va9 n ARG 100 Ca -0.14 0.49 0.12 0.00 -0.77 0.00 0.00 57.85 57.56 1va9 n ARG 100 Cb 0.66 -1.78 0.11 0.00 -1.02 0.00 0.00 32.46 30.43 1va9 n ARG 100 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1va9 h ALA 101 N 2.15 0.68 0.00 7.54 0.00 -1.92 -3.50 119.26 124.22 1va9 h ALA 101 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1va9 h ALA 101 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1va9 h ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1va9 n GLY 102 N 1.20 0.83 3.73 0.00 0.00 0.56 -3.76 105.19 107.76 1va9 n GLY 102 Ca 0.02 -1.86 -0.27 0.00 0.00 0.00 0.00 46.02 43.91 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 -2.11 4.13 0.35 2.61 2.01 -1.26 0.71 115.64 122.07 1va9 s THR 103 Ca 0.00 -1.17 0.05 0.00 0.31 0.00 0.00 61.69 60.89 1va9 s THR 103 Cb 0.00 -3.06 0.05 0.00 0.01 0.00 0.00 72.50 69.50 1va9 s THR 103 CO 0.00 -0.05 0.44 0.61 -0.69 0.00 0.00 174.62 174.92 1va9 n GLY 104 N -0.04 2.14 3.81 4.40 0.00 -0.65 -4.47 105.19 110.38 1va9 n GLY 104 Ca -0.09 -2.20 -0.32 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 -3.54 3.18 0.58 1.61 0.04 -1.26 -4.77 135.00 130.84 1va9 s PRO 105 Ca 0.33 1.06 -0.09 0.00 0.04 0.00 0.00 61.00 62.34 1va9 s PRO 105 Cb -0.03 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 1va9 s PRO 105 CO 0.21 -0.91 0.96 -1.54 0.04 0.00 0.00 177.00 175.75 1va9 s SER 106 N -3.31 6.20 0.73 6.66 1.04 -1.26 -3.60 113.70 120.17 1va9 s SER 106 Ca 0.60 1.25 -0.02 0.00 0.48 0.00 0.00 55.95 58.26 1va9 s SER 106 Cb -0.15 -2.37 0.12 0.00 0.10 0.00 0.00 66.02 63.72 1va9 s SER 106 CO 0.45 -0.80 1.01 -0.94 0.98 0.00 0.00 173.24 173.95 1va9 s SER 107 N -4.17 4.32 -0.01 7.02 1.04 -0.88 -4.65 113.70 116.37 1va9 s SER 107 Ca 0.53 -0.23 -0.30 0.00 0.48 0.00 0.00 55.95 56.43 1va9 s SER 107 Cb -0.11 -0.17 -0.08 0.00 0.10 0.00 0.00 66.02 65.77 1va9 s SER 107 CO 0.51 -1.88 1.98 -0.94 0.98 0.00 0.00 173.24 173.89 1va9 s SER 108 N -4.72 6.30 -0.02 7.02 1.04 -1.26 -4.74 113.70 117.32 1va9 s SER 108 Ca 0.66 2.50 -0.30 0.00 0.48 0.00 0.00 55.95 59.29 1va9 s SER 108 Cb -0.06 -2.53 -0.07 0.00 0.10 0.00 0.00 66.02 63.47 1va9 s SER 108 CO 0.45 -1.20 1.74 -0.70 0.98 0.00 0.00 173.24 174.51 1va9 s GLU 109 N 4.75 4.17 0.00 4.02 2.12 -1.26 -4.95 118.70 127.55 1va9 s GLU 109 Ca 0.89 2.31 0.00 0.00 0.36 0.00 0.00 54.97 58.53 1va9 s GLU 109 Cb -0.40 -4.01 0.00 0.00 0.26 0.00 0.00 34.13 29.98 1va9 s GLU 109 CO 0.40 -0.87 0.00 -0.89 -0.54 0.00 0.00 175.26 173.36 1va9 n ILE 110 N 5.45 0.00 -3.72 -3.70 -0.00 -1.24 -4.97 119.36 111.17 1va9 n ILE 110 Ca 0.18 0.00 -0.13 0.00 -0.00 0.00 0.00 62.75 62.80 1va9 n ILE 110 Cb 0.42 -1.01 -0.10 0.00 -0.00 0.00 0.00 39.64 38.95 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 -1.00 -0.46 -0.29 4.38 4.22 -1.26 -4.02 114.94 116.51 1va9 s ASN 111 Ca 0.00 0.86 0.02 0.00 -2.14 0.00 0.00 52.86 51.60 1va9 s ASN 111 Cb 0.00 0.85 0.16 0.00 1.28 0.00 0.00 41.25 43.54 1va9 s ASN 111 CO 0.00 -0.16 0.41 0.00 -2.04 0.00 0.00 177.10 175.31 1va9 s ALA 112 N 0.45 -1.20 0.08 3.54 0.00 -1.09 -4.91 121.76 118.63 1va9 s ALA 112 Ca -0.02 0.21 -0.31 0.00 0.00 0.00 0.00 51.96 51.84 1va9 s ALA 112 Cb -0.04 -2.08 -0.07 0.00 0.00 0.00 0.00 23.12 20.92 1va9 s ALA 112 CO -0.02 -1.76 1.44 0.99 0.00 0.00 0.00 175.76 176.41 1va9 s THR 113 N 2.54 3.34 1.03 0.00 2.01 -1.26 -4.10 115.64 119.20 1va9 s THR 113 Ca 0.10 0.88 -0.16 0.00 0.31 0.00 0.00 61.69 62.81 1va9 s THR 113 Cb -0.12 -3.57 0.04 0.00 0.01 0.00 0.00 72.50 68.86 1va9 s THR 113 CO -0.30 0.04 0.03 0.35 -0.69 0.00 0.00 174.62 174.05 1va9 n THR 114 N 4.26 0.00 -1.71 -0.82 -2.24 -1.11 -4.81 114.28 107.85 1va9 n THR 114 Ca 0.13 -0.25 -0.41 0.00 -2.27 0.00 0.00 64.05 61.25 1va9 n THR 114 Cb 0.42 -0.53 0.01 0.00 -2.10 0.00 0.00 70.33 68.13 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 -0.86 4.18 -4.30 3.22 4.77 -1.21 -3.64 117.00 119.16 1va9 n LEU 115 Ca 0.03 1.10 -0.43 0.00 -0.03 0.00 0.00 56.01 56.68 1va9 n LEU 115 Cb 0.59 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 1va9 n LEU 115 CO 0.51 -0.61 1.79 -0.62 -1.33 0.00 0.00 177.39 177.14 1va9 n GLU 116 N -0.02 3.32 -2.37 3.23 1.02 -1.26 -3.17 120.64 121.38 1va9 n GLU 116 Ca 0.07 -3.51 -0.00 0.00 -0.02 0.00 0.00 57.16 53.69 1va9 n GLU 116 Cb 0.40 -3.17 -0.00 0.00 -0.02 0.00 0.00 31.44 28.65 1va9 n GLU 116 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1va9 n SER 117 N 6.08 -5.77 -0.70 1.62 7.64 -1.26 -4.74 113.62 116.49 1va9 n SER 117 Ca 0.42 1.04 0.06 0.00 1.01 0.00 0.00 58.87 61.40 1va9 n SER 117 Cb 0.42 -4.14 -0.02 0.00 -1.01 0.00 0.00 64.21 59.46 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 0.59 -0.82 3.61 0.23 0.00 -1.26 -4.40 105.19 103.13 1va9 n GLY 118 Ca -0.03 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 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 -0.98 3.62 0.20 1.61 0.04 -1.26 -4.65 135.00 133.58 1va9 s PRO 119 Ca 0.00 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.03 1va9 s PRO 119 Cb 0.00 -4.01 0.00 0.00 0.04 0.00 0.00 34.50 30.53 1va9 s PRO 119 CO 0.00 -1.50 0.00 0.45 0.04 0.00 0.00 177.00 175.99 1va9 n SER 120 N 8.65 -0.37 -4.60 6.66 2.88 -1.26 -5.10 113.62 120.47 1va9 n SER 120 Ca 0.16 0.34 -0.39 0.00 -1.33 0.00 0.00 58.87 57.66 1va9 n SER 120 Cb 0.48 0.50 0.04 0.00 -0.75 0.00 0.00 64.21 64.48 1va9 n SER 120 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1va9 n SER 121 N -3.12 0.78 -0.29 -3.46 2.88 -1.26 -5.16 113.62 104.00 1va9 n SER 121 Ca 0.00 0.87 0.04 0.00 -1.33 0.00 0.00 58.87 58.44 1va9 n SER 121 Cb 0.00 -1.36 0.03 0.00 -0.75 0.00 0.00 64.21 62.13 1va9 n SER 121 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42