#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 0.41 -4.41 1.61 7.64 -1.26 -5.08 113.62 112.54 1va9 n SER 2 Ca 0.00 0.24 -0.33 0.00 1.01 0.00 0.00 58.87 59.80 1va9 n SER 2 Cb 0.00 0.01 -0.14 0.00 -1.01 0.00 0.00 64.21 63.07 1va9 n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1va9 s SER 3 N -5.43 3.83 0.00 6.43 0.15 -1.26 -5.12 113.70 112.30 1va9 s SER 3 Ca 0.00 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.36 1va9 s SER 3 Cb 0.00 -1.01 0.00 0.00 -1.71 0.00 0.00 66.02 63.30 1va9 s SER 3 CO 0.00 0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.33 1va9 n GLY 4 N 2.72 1.01 3.56 9.45 0.00 -1.26 -5.12 105.19 115.54 1va9 n GLY 4 Ca -0.17 -0.85 -0.01 0.00 0.00 0.00 0.00 46.02 44.99 1va9 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1va9 s SER 5 N -1.00 -0.73 -0.13 1.61 1.04 -1.26 -5.15 113.70 108.08 1va9 s SER 5 Ca 0.00 1.06 -0.04 0.00 0.48 0.00 0.00 55.95 57.45 1va9 s SER 5 Cb 0.00 1.63 0.07 0.00 0.10 0.00 0.00 66.02 67.81 1va9 s SER 5 CO 0.00 -0.16 0.21 -0.94 0.98 0.00 0.00 173.24 173.33 1va9 s SER 6 N 2.11 0.85 0.00 7.02 1.04 -1.26 -5.02 113.70 118.44 1va9 s SER 6 Ca -0.06 0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.59 1va9 s SER 6 Cb -0.06 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1va9 s SER 6 CO -0.17 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.39 1va9 n GLY 7 N 5.33 -1.91 3.85 7.32 0.00 -1.26 -5.01 105.19 113.50 1va9 n GLY 7 Ca -0.05 0.95 -0.30 0.00 0.00 0.00 0.00 46.02 46.61 1va9 n GLY 7 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1va9 n ILE 8 N 0.00 -3.45 -3.15 -0.61 5.41 -1.26 -4.94 119.36 111.36 1va9 n ILE 8 Ca 0.00 -0.21 0.06 0.00 1.00 0.00 0.00 62.75 63.60 1va9 n ILE 8 Cb 0.00 -2.92 -0.00 0.00 -0.71 0.00 0.00 39.64 36.00 1va9 n ILE 8 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1va9 s SER 9 N -3.15 -0.23 -0.00 4.38 1.04 -1.26 -5.01 113.70 109.47 1va9 s SER 9 Ca 0.15 0.04 0.08 0.00 0.48 0.00 0.00 55.95 56.70 1va9 s SER 9 Cb -0.08 1.15 0.24 0.00 0.10 0.00 0.00 66.02 67.43 1va9 s SER 9 CO 0.91 -0.04 1.19 0.41 0.98 0.00 0.00 173.24 176.69 1va9 n THR 10 N 5.10 0.39 -3.47 2.02 -1.04 -1.26 -4.77 114.28 111.25 1va9 n THR 10 Ca 0.09 -0.37 0.03 0.00 -2.04 0.00 0.00 64.05 61.75 1va9 n THR 10 Cb 0.58 0.16 -0.05 0.00 -1.82 0.00 0.00 70.33 69.20 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 -1.63 0.03 0.78 -2.82 -1.05 -1.26 -5.18 118.70 107.57 1va9 s GLU 11 Ca 0.18 0.06 -0.07 0.00 -0.15 0.00 0.00 54.97 55.00 1va9 s GLU 11 Cb 0.10 0.02 0.13 0.00 -0.44 0.00 0.00 34.13 33.94 1va9 s GLU 11 CO 0.12 -0.01 1.09 -1.21 0.95 0.00 0.00 175.26 176.21 1va9 s GLU 12 N 1.41 1.51 -0.04 -4.83 2.02 -1.26 -5.00 118.70 112.51 1va9 s GLU 12 Ca -0.05 -0.69 -0.07 0.00 0.02 0.00 0.00 54.97 54.18 1va9 s GLU 12 Cb -0.02 -2.15 0.01 0.00 0.10 0.00 0.00 34.13 32.07 1va9 s GLU 12 CO -0.12 -1.67 0.16 0.00 0.02 0.00 0.00 175.26 173.66 1va9 s ALA 13 N -3.38 -0.40 0.65 5.21 0.00 -1.14 -4.71 121.76 118.00 1va9 s ALA 13 Ca 0.67 0.25 -0.17 0.00 0.00 0.00 0.00 51.96 52.71 1va9 s ALA 13 Cb -0.06 -0.13 -0.03 0.00 0.00 0.00 0.00 23.12 22.90 1va9 s ALA 13 CO 0.47 -0.13 0.89 0.00 0.00 0.00 0.00 175.76 176.98 1va9 n ALA 14 N 2.37 -0.20 -1.85 0.00 0.00 -1.26 -4.66 120.51 114.91 1va9 n ALA 14 Ca -0.17 -0.08 -0.40 0.00 0.00 0.00 0.00 53.44 52.79 1va9 n ALA 14 Cb 0.57 -2.07 -0.04 0.00 0.00 0.00 0.00 19.45 17.91 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 -2.90 4.64 -0.28 0.00 0.04 -1.26 -4.84 135.00 130.39 1va9 s PRO 15 Ca 0.74 1.76 0.12 0.00 0.04 0.00 0.00 61.00 63.66 1va9 s PRO 15 Cb -0.39 -3.22 0.65 0.00 0.04 0.00 0.00 34.50 31.58 1va9 s PRO 15 CO 0.49 0.19 1.65 -0.25 0.04 0.00 0.00 177.00 179.12 1va9 n ASP 16 N 1.60 4.20 -3.59 6.66 9.92 -1.26 -3.91 116.55 130.17 1va9 n ASP 16 Ca 0.00 -3.26 -0.12 0.00 -0.53 0.00 0.00 54.79 50.88 1va9 n ASP 16 Cb 0.45 -0.67 -0.06 0.00 -0.64 0.00 0.00 41.12 40.20 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 -1.53 -0.33 0.99 0.44 0.00 -1.26 -4.90 107.32 100.72 1va9 s GLY 17 Ca 0.50 2.07 -0.15 0.00 0.00 0.00 0.00 44.72 47.14 1va9 s GLY 17 CO 0.10 1.32 1.17 2.56 0.00 0.00 0.00 173.10 178.25 1va9 s PRO 18 N -0.60 0.52 0.74 2.90 0.04 -1.26 -4.68 135.00 132.67 1va9 s PRO 18 Ca -0.02 0.06 -0.11 0.00 0.04 0.00 0.00 61.00 60.97 1va9 s PRO 18 Cb -0.02 -1.79 0.03 0.00 0.04 0.00 0.00 34.50 32.76 1va9 s PRO 18 CO 0.01 -2.57 1.07 -1.25 0.04 0.00 0.00 177.00 174.30 1va9 s PRO 19 N -5.44 2.60 0.56 0.56 0.04 -1.26 -4.53 135.00 127.52 1va9 s PRO 19 Ca 0.68 0.83 0.08 0.00 0.04 0.00 0.00 61.00 62.62 1va9 s PRO 19 Cb -0.11 -1.96 0.07 0.00 0.04 0.00 0.00 34.50 32.53 1va9 s PRO 19 CO 0.54 -1.30 0.64 -1.64 0.04 0.00 0.00 177.00 175.28 1va9 s MET 20 N -5.09 2.30 -0.82 4.56 -1.94 -0.86 -4.49 119.30 112.96 1va9 s MET 20 Ca 0.59 -1.77 -0.01 0.00 -1.71 0.00 0.00 55.69 52.78 1va9 s MET 20 Cb -0.14 -2.45 0.01 0.00 2.01 0.00 0.00 34.83 34.26 1va9 s MET 20 CO 0.55 -0.76 0.06 -3.47 -0.01 0.00 0.00 175.02 171.39 1va9 n ASP 21 N -2.06 -3.11 -4.60 3.03 2.03 -1.26 0.97 116.55 111.54 1va9 n ASP 21 Ca 0.09 0.19 -0.43 0.00 0.52 0.00 0.00 54.79 55.16 1va9 n ASP 21 Cb 0.63 -2.68 -0.02 0.00 -0.72 0.00 0.00 41.12 38.33 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 -2.50 4.02 0.11 5.18 1.01 -1.24 -3.30 120.40 123.67 1va9 s VAL 22 Ca 0.06 1.05 -0.18 0.00 0.00 0.00 0.00 61.98 62.91 1va9 s VAL 22 Cb -0.03 -4.32 0.04 0.00 0.00 0.00 0.00 36.38 32.07 1va9 s VAL 22 CO 0.07 -0.80 0.44 0.28 0.00 0.00 0.00 175.10 175.09 1va9 s THR 23 N 5.03 0.06 0.26 3.92 -1.32 -0.80 -4.99 115.64 117.79 1va9 s THR 23 Ca 0.57 -0.45 0.07 0.00 -1.21 0.00 0.00 61.69 60.67 1va9 s THR 23 Cb -0.12 -1.09 -0.04 0.00 -1.51 0.00 0.00 72.50 69.74 1va9 s THR 23 CO 0.31 -0.25 0.17 -0.76 -2.21 0.00 0.00 174.62 171.88 1va9 s LEU 24 N -2.58 3.71 -0.29 9.08 1.43 -1.26 -2.14 118.68 126.63 1va9 s LEU 24 Ca 0.01 -0.32 -0.08 0.00 -1.03 0.00 0.00 54.13 52.70 1va9 s LEU 24 Cb 0.01 -2.24 0.14 0.00 0.03 0.00 0.00 46.19 44.12 1va9 s LEU 24 CO -0.10 -0.04 0.61 -1.58 0.23 0.00 0.00 176.35 175.48 1va9 s GLN 25 N -3.82 0.55 -0.22 1.70 0.74 0.94 -4.95 119.66 114.61 1va9 s GLN 25 Ca 0.33 1.33 -0.29 0.00 0.05 0.00 0.00 55.36 56.78 1va9 s GLN 25 Cb -0.08 0.75 -0.01 0.00 1.10 0.00 0.00 33.01 34.77 1va9 s GLN 25 CO 0.24 -0.28 1.31 -1.25 -0.55 0.00 0.00 175.29 174.76 1va9 s PRO 26 N 2.86 4.09 -0.21 1.67 0.04 -1.26 0.19 135.00 142.38 1va9 s PRO 26 Ca -0.01 1.52 0.07 0.00 0.04 0.00 0.00 61.00 62.61 1va9 s PRO 26 Cb -0.13 -3.83 -0.17 0.00 0.04 0.00 0.00 34.50 30.42 1va9 s PRO 26 CO -0.19 -0.90 -0.11 1.33 0.04 0.00 0.00 177.00 177.18 1va9 n VAL 27 N 5.75 1.25 -0.83 -0.36 0.24 -1.25 -4.87 118.33 118.26 1va9 n VAL 27 Ca 0.15 -0.58 0.00 0.00 -2.04 0.00 0.00 64.34 61.87 1va9 n VAL 27 Cb 0.45 -1.02 0.00 0.00 -1.47 0.00 0.00 33.84 31.80 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 -2.97 0.00 -0.08 3.34 -2.24 -1.23 -4.79 114.28 106.30 1va9 n THR 28 Ca -0.36 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.26 1va9 n THR 28 Cb 0.97 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 69.14 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 1.62 -2.28 3.42 2.88 -1.26 -3.78 113.62 114.22 1va9 n SER 29 Ca 0.00 0.13 -0.30 0.00 -1.33 0.00 0.00 58.87 57.37 1va9 n SER 29 Cb 0.00 -0.43 0.04 0.00 -0.75 0.00 0.00 64.21 63.07 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 -3.53 3.18 -3.53 -1.46 6.02 -1.26 -4.39 117.38 112.40 1va9 n GLN 30 Ca -0.32 -3.84 -0.13 0.00 -0.01 0.00 0.00 57.00 52.70 1va9 n GLN 30 Cb 0.75 -2.28 -0.05 0.00 1.02 0.00 0.00 30.24 29.68 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 -2.71 -0.50 0.02 1.08 0.01 -1.26 -0.95 113.70 109.40 1va9 s SER 31 Ca 0.56 0.46 0.00 0.00 1.31 0.00 0.00 55.95 58.27 1va9 s SER 31 Cb 0.45 0.43 -0.02 0.00 0.21 0.00 0.00 66.02 67.09 1va9 s SER 31 CO -0.06 -0.53 -0.03 -0.63 0.41 0.00 0.00 173.24 172.40 1va9 s ILE 32 N -1.56 0.13 -0.22 1.44 1.01 0.46 -3.57 121.20 118.88 1va9 s ILE 32 Ca -0.05 -0.96 -0.10 0.00 0.00 0.00 0.00 60.65 59.54 1va9 s ILE 32 Cb -0.00 -0.34 -0.05 0.00 0.01 0.00 0.00 42.46 42.08 1va9 s ILE 32 CO 0.03 -0.52 0.14 -1.58 0.00 0.00 0.00 174.94 173.01 1va9 s GLN 33 N -1.59 4.11 -0.27 2.79 0.74 0.52 -0.14 119.66 125.82 1va9 s GLN 33 Ca -0.15 -0.26 -0.03 0.00 0.05 0.00 0.00 55.36 54.98 1va9 s GLN 33 Cb -0.09 -3.48 0.03 0.00 1.10 0.00 0.00 33.01 30.56 1va9 s GLN 33 CO -0.01 0.16 -0.01 0.08 -0.55 0.00 0.00 175.29 174.95 1va9 s VAL 34 N 0.78 3.20 -0.00 1.34 1.01 -0.57 -0.04 120.40 126.11 1va9 s VAL 34 Ca 0.08 -1.02 0.05 0.00 0.00 0.00 0.00 61.98 61.09 1va9 s VAL 34 Cb -0.13 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 1va9 s VAL 34 CO 0.02 0.09 -0.16 0.42 0.00 0.00 0.00 175.10 175.47 1va9 s THR 35 N 1.36 2.93 0.17 3.92 -4.23 -0.91 -0.70 115.64 118.18 1va9 s THR 35 Ca -0.00 -0.95 -0.18 0.00 -1.18 0.00 0.00 61.69 59.37 1va9 s THR 35 Cb -0.17 -2.19 0.04 0.00 1.34 0.00 0.00 72.50 71.51 1va9 s THR 35 CO -0.02 0.46 0.51 -1.66 -0.54 0.00 0.00 174.62 173.37 1va9 s TRP 36 N -0.83 -0.24 0.41 3.99 -2.14 -0.69 -1.91 118.94 117.52 1va9 s TRP 36 Ca 0.13 -0.07 0.07 0.00 2.66 0.00 0.00 56.10 58.90 1va9 s TRP 36 Cb -0.11 0.40 -0.06 0.00 -3.10 0.00 0.00 33.47 30.61 1va9 s TRP 36 CO 0.03 -0.85 0.14 0.15 -2.66 0.00 0.00 176.95 173.77 1va9 s LYS 37 N -3.83 2.18 0.29 3.25 1.02 0.27 -1.77 119.74 121.15 1va9 s LYS 37 Ca 0.06 -1.88 -0.29 0.00 0.02 0.00 0.00 55.97 53.87 1va9 s LYS 37 Cb -0.00 -1.92 -0.13 0.00 -0.52 0.00 0.00 37.83 35.25 1va9 s LYS 37 CO -0.08 -0.09 1.31 0.00 -0.92 0.00 0.00 175.35 175.58 1va9 n ALA 38 N -1.18 1.05 -2.31 5.17 0.00 -0.55 -2.02 120.51 120.67 1va9 n ALA 38 Ca -0.02 0.39 -0.40 0.00 0.00 0.00 0.00 53.44 53.40 1va9 n ALA 38 Cb 0.65 -2.24 -0.03 0.00 0.00 0.00 0.00 19.45 17.83 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 -1.18 3.04 0.65 0.00 0.04 -1.26 -4.22 135.00 132.06 1va9 s PRO 39 Ca 0.61 0.32 0.00 0.00 0.04 0.00 0.00 61.00 61.97 1va9 s PRO 39 Cb -0.62 -4.23 0.00 0.00 0.04 0.00 0.00 34.50 29.69 1va9 s PRO 39 CO 0.56 -2.27 0.00 1.63 0.04 0.00 0.00 177.00 176.96 1va9 n LYS 40 N 9.06 -0.06 -0.02 4.56 4.01 -1.26 -2.93 118.16 131.52 1va9 n LYS 40 Ca 0.12 0.04 -0.03 0.00 -0.51 0.00 0.00 58.31 57.93 1va9 n LYS 40 Cb 0.50 -0.08 -0.01 0.00 -0.51 0.00 0.00 35.03 34.93 1va9 n LYS 40 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1va9 n LYS 41 N -0.76 0.08 0.09 1.97 3.00 -1.26 -4.28 118.16 117.01 1va9 n LYS 41 Ca 0.00 0.03 -0.06 0.00 -0.00 0.00 0.00 58.31 58.28 1va9 n LYS 41 Cb 0.01 -0.86 0.02 0.00 0.00 0.00 0.00 35.03 34.21 1va9 n LYS 41 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.40 178.45 1va9 h GLU 42 N -0.07 0.08 -0.02 1.64 4.11 -2.02 -3.13 114.58 115.17 1va9 h GLU 42 Ca -0.09 -0.08 -0.19 0.00 0.07 0.00 0.00 59.36 59.08 1va9 h GLU 42 Cb 1.10 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 1va9 h GLU 42 CO -0.03 0.86 -0.80 -0.07 0.07 0.00 0.00 179.01 179.03 1va9 h LEU 43 N 0.04 0.30 -1.72 3.06 3.38 -1.84 -3.16 115.31 115.38 1va9 h LEU 43 Ca -0.02 -0.22 0.52 0.00 0.09 0.00 0.00 57.88 58.24 1va9 h LEU 43 Cb 1.45 -0.09 -0.09 0.00 0.09 0.00 0.00 40.66 42.02 1va9 h LEU 43 CO 0.12 0.99 1.22 0.00 0.09 0.00 0.00 178.44 180.85 1va9 n GLN 44 N -3.73 -0.01 -4.04 1.13 6.02 -1.15 -4.07 117.38 111.53 1va9 n GLN 44 Ca -0.04 1.05 -0.45 0.00 -0.01 0.00 0.00 57.00 57.55 1va9 n GLN 44 Cb 0.76 -2.33 0.02 0.00 1.02 0.00 0.00 30.24 29.71 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 -3.96 -4.27 0.00 1.08 3.02 -1.20 -4.56 115.26 105.37 1va9 n ASN 45 Ca 0.41 -1.27 0.00 0.00 -0.03 0.00 0.00 54.58 53.69 1va9 n ASN 45 Cb 1.79 -1.81 0.00 0.00 -0.61 0.00 0.00 39.78 39.15 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 -2.05 -0.69 3.32 7.41 0.00 -1.26 -2.87 105.19 109.04 1va9 n GLY 46 Ca -0.11 -1.67 -0.33 0.00 0.00 0.00 0.00 46.02 43.91 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 -0.66 0.00 -5.03 1.61 0.31 -1.26 -4.97 118.33 108.33 1va9 n VAL 47 Ca 0.00 -0.27 -0.32 0.00 -0.01 0.00 0.00 64.34 63.74 1va9 n VAL 47 Cb 0.00 -0.60 -0.15 0.00 -0.91 0.00 0.00 33.84 32.18 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 -2.28 2.66 0.04 2.52 -1.09 -1.26 -4.94 121.20 116.85 1va9 s ILE 48 Ca 0.56 -0.86 0.05 0.00 -2.23 0.00 0.00 60.65 58.17 1va9 s ILE 48 Cb -0.15 -2.02 -0.24 0.00 -1.58 0.00 0.00 42.46 38.47 1va9 s ILE 48 CO 0.67 0.57 0.99 0.03 -1.23 0.00 0.00 174.94 175.97 1va9 h ARG 49 N 5.77 0.09 0.00 2.79 2.47 -1.93 -3.41 114.38 120.15 1va9 h ARG 49 Ca -0.39 -0.15 0.00 0.00 -1.26 0.00 0.00 59.98 58.18 1va9 h ARG 49 Cb 1.16 0.06 0.00 0.00 -1.65 0.00 0.00 29.97 29.54 1va9 h ARG 49 CO 0.50 0.92 0.00 0.41 0.56 0.00 0.00 179.97 182.35 1va9 n GLY 50 N 1.50 -0.76 3.31 0.04 0.00 -0.84 -2.99 105.19 105.45 1va9 n GLY 50 Ca -0.10 -1.14 -0.16 0.00 0.00 0.00 0.00 46.02 44.63 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 1.48 -0.13 1.61 1.51 -1.25 0.43 117.35 118.99 1va9 s TYR 51 Ca 0.00 -0.90 -0.01 0.00 -1.01 0.00 0.00 57.07 55.16 1va9 s TYR 51 Cb 0.00 -0.83 -0.02 0.00 -0.11 0.00 0.00 41.96 41.00 1va9 s TYR 51 CO 0.00 -0.03 -0.12 -0.65 -1.11 0.00 0.00 175.55 173.64 1va9 s GLN 52 N -3.84 3.41 -0.43 -0.62 -0.21 0.15 -3.46 119.66 114.66 1va9 s GLN 52 Ca 0.26 -0.67 -0.02 0.00 0.02 0.00 0.00 55.36 54.95 1va9 s GLN 52 Cb 0.05 -2.67 0.12 0.00 1.00 0.00 0.00 33.01 31.51 1va9 s GLN 52 CO 0.07 0.20 0.22 0.42 -2.12 0.00 0.00 175.29 174.08 1va9 s ILE 53 N 0.38 3.22 -0.28 1.08 1.09 -1.19 -1.82 121.20 123.69 1va9 s ILE 53 Ca -0.10 -2.22 -0.15 0.00 -1.10 0.00 0.00 60.65 57.08 1va9 s ILE 53 Cb -0.16 -3.21 -0.03 0.00 -1.06 0.00 0.00 42.46 38.00 1va9 s ILE 53 CO 0.05 -0.71 0.39 -0.83 -0.10 0.00 0.00 174.94 173.75 1va9 s GLY 54 N 1.55 1.87 0.04 6.18 0.00 -0.83 -3.06 107.32 113.07 1va9 s GLY 54 Ca 0.10 -0.82 0.05 0.00 0.00 0.00 0.00 44.72 44.04 1va9 s GLY 54 CO -0.04 1.02 -0.14 -2.52 0.00 0.00 0.00 173.10 171.41 1va9 s TYR 55 N 2.11 1.26 -0.11 1.90 1.13 -0.95 0.10 117.35 122.79 1va9 s TYR 55 Ca 0.16 -0.34 -0.24 0.00 -1.41 0.00 0.00 57.07 55.24 1va9 s TYR 55 Cb -0.16 -0.75 0.06 0.00 -1.10 0.00 0.00 41.96 40.01 1va9 s TYR 55 CO 0.10 0.03 0.57 -0.98 -2.51 0.00 0.00 175.55 172.76 1va9 s ARG 56 N -1.08 0.84 0.88 -3.49 1.70 -1.03 -1.17 118.95 115.60 1va9 s ARG 56 Ca 0.02 0.38 -0.15 0.00 -0.47 0.00 0.00 55.73 55.51 1va9 s ARG 56 Cb -0.08 0.39 -0.05 0.00 -0.57 0.00 0.00 34.95 34.65 1va9 s ARG 56 CO 0.01 -0.20 0.02 -1.91 -1.08 0.00 0.00 175.30 172.14 1va9 n GLU 57 N 1.70 -0.04 -0.76 3.89 2.13 -1.26 -2.86 120.64 123.44 1va9 n GLU 57 Ca -0.17 0.02 -0.02 0.00 0.66 0.00 0.00 57.16 57.64 1va9 n GLU 57 Cb 0.56 -1.52 0.24 0.00 0.27 0.00 0.00 31.44 30.99 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 0.68 3.45 -4.20 4.31 2.85 -0.76 -4.66 115.26 116.93 1va9 n ASN 58 Ca 0.05 -3.42 -0.12 0.00 -0.11 0.00 0.00 54.58 50.98 1va9 n ASN 58 Cb 0.53 -0.64 -0.10 0.00 1.24 0.00 0.00 39.78 40.80 1va9 n ASN 58 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1va9 s SER 59 N -1.98 1.09 0.36 1.20 0.15 -1.26 -4.94 113.70 108.32 1va9 s SER 59 Ca 0.47 -1.10 -0.26 0.00 0.70 0.00 0.00 55.95 55.75 1va9 s SER 59 Cb 0.40 0.13 -0.09 0.00 -1.71 0.00 0.00 66.02 64.74 1va9 s SER 59 CO 0.06 -0.54 1.06 -2.16 1.20 0.00 0.00 173.24 172.86 1va9 s PRO 60 N -3.89 4.33 0.00 5.44 0.04 -1.26 -3.55 135.00 136.10 1va9 s PRO 60 Ca 0.19 1.60 0.00 0.00 0.04 0.00 0.00 61.00 62.83 1va9 s PRO 60 Cb 0.06 -2.76 0.00 0.00 0.04 0.00 0.00 34.50 31.84 1va9 s PRO 60 CO -0.00 -0.02 0.00 0.41 0.04 0.00 0.00 177.00 177.43 1va9 n GLY 61 N 0.64 1.19 3.81 0.56 0.00 -1.26 -5.08 105.19 105.05 1va9 n GLY 61 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 1va9 n GLY 61 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1va9 s SER 62 N -1.84 5.66 0.37 1.61 0.15 -1.23 -4.90 113.70 113.51 1va9 s SER 62 Ca 0.00 1.71 0.17 0.00 0.70 0.00 0.00 55.95 58.53 1va9 s SER 62 Cb 0.00 -2.51 1.11 0.00 -1.71 0.00 0.00 66.02 62.91 1va9 s SER 62 CO 0.00 -1.25 1.70 0.78 1.20 0.00 0.00 173.24 175.66 1va9 h ASN 63 N -0.06 0.49 0.00 5.45 2.35 -1.97 -3.45 115.58 118.38 1va9 h ASN 63 Ca -0.45 0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.44 1va9 h ASN 63 Cb 1.21 0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.67 1va9 h ASN 63 CO 0.57 -0.04 0.00 0.61 -1.65 0.00 0.00 177.43 176.92 1va9 n GLY 64 N -1.38 1.97 3.70 2.83 0.00 -1.26 -4.99 105.19 106.06 1va9 n GLY 64 Ca 0.30 -0.49 -0.62 0.00 0.00 0.00 0.00 46.02 45.21 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 0.51 -1.64 1.61 3.00 -1.26 -4.76 117.38 114.84 1va9 n GLN 65 Ca 0.00 0.19 -0.43 0.00 -0.01 0.00 0.00 57.00 56.75 1va9 n GLN 65 Cb 0.00 -1.76 -0.03 0.00 0.00 0.00 0.00 30.24 28.45 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 2.66 1.22 -0.36 1.08 2.02 -1.26 -4.87 117.35 117.84 1va9 s TYR 66 Ca 0.99 0.04 -0.28 0.00 -0.37 0.00 0.00 57.07 57.46 1va9 s TYR 66 Cb -1.28 -4.09 -0.04 0.00 -0.40 0.00 0.00 41.96 36.16 1va9 s TYR 66 CO 0.71 -4.83 2.05 -1.12 -1.57 0.00 0.00 175.55 170.78 1va9 s SER 67 N 6.38 5.42 0.26 2.29 0.01 -0.32 -4.66 113.70 123.08 1va9 s SER 67 Ca 0.95 1.33 -0.20 0.00 1.31 0.00 0.00 55.95 59.33 1va9 s SER 67 Cb -0.38 -2.52 -0.09 0.00 0.21 0.00 0.00 66.02 63.25 1va9 s SER 67 CO 0.38 -2.08 0.77 -0.63 0.41 0.00 0.00 173.24 172.10 1va9 s ILE 68 N 8.54 4.51 -0.09 1.44 -1.09 -1.26 -2.23 121.20 131.02 1va9 s ILE 68 Ca 0.88 1.35 -0.02 0.00 -2.23 0.00 0.00 60.65 60.63 1va9 s ILE 68 Cb -0.24 -3.85 0.03 0.00 -1.58 0.00 0.00 42.46 36.83 1va9 s ILE 68 CO 0.31 0.14 0.01 0.68 -1.23 0.00 0.00 174.94 174.85 1va9 s VAL 69 N -1.61 0.34 0.24 2.92 -7.23 -1.17 -4.95 120.40 108.94 1va9 s VAL 69 Ca 0.46 0.04 -0.29 0.00 -1.81 0.00 0.00 61.98 60.38 1va9 s VAL 69 Cb -0.16 -0.58 -0.09 0.00 0.56 0.00 0.00 36.38 36.11 1va9 s VAL 69 CO 0.21 0.17 0.92 -0.70 -0.31 0.00 0.00 175.10 175.38 1va9 s GLU 70 N 1.98 4.77 0.35 4.82 2.12 -1.26 -3.15 118.70 128.33 1va9 s GLU 70 Ca 0.04 1.42 -0.04 0.00 0.36 0.00 0.00 54.97 56.75 1va9 s GLU 70 Cb -0.13 -3.20 0.01 0.00 0.26 0.00 0.00 34.13 31.07 1va9 s GLU 70 CO -0.06 0.49 0.51 0.00 -0.54 0.00 0.00 175.26 175.66 1va9 s MET 71 N -1.32 1.94 0.15 4.30 0.23 -1.22 -5.05 119.30 118.33 1va9 s MET 71 Ca 0.42 -1.72 0.10 0.00 -1.03 0.00 0.00 55.69 53.46 1va9 s MET 71 Cb -0.24 0.46 -0.04 0.00 -1.53 0.00 0.00 34.83 33.48 1va9 s MET 71 CO 0.30 -0.82 -0.19 -1.59 -2.03 0.00 0.00 175.02 170.69 1va9 s LYS 72 N -2.99 1.71 -0.68 3.16 -2.85 -1.26 -3.90 119.74 112.93 1va9 s LYS 72 Ca 0.29 -1.31 -0.24 0.00 -1.00 0.00 0.00 55.97 53.71 1va9 s LYS 72 Cb -0.01 -2.03 0.05 0.00 -2.06 0.00 0.00 37.83 33.79 1va9 s LYS 72 CO 0.19 0.45 1.07 0.00 0.10 0.00 0.00 175.35 177.16 1va9 s ALA 73 N -1.37 3.00 0.26 0.59 0.00 -1.16 -4.84 121.76 118.24 1va9 s ALA 73 Ca 0.19 -1.64 -0.05 0.00 0.00 0.00 0.00 51.96 50.47 1va9 s ALA 73 Cb -0.09 -3.98 0.31 0.00 0.00 0.00 0.00 23.12 19.36 1va9 s ALA 73 CO 0.10 -2.91 1.91 1.79 0.00 0.00 0.00 175.76 176.66 1va9 h THR 74 N 6.00 1.24 0.00 0.00 1.35 -1.94 -3.48 112.91 116.08 1va9 h THR 74 Ca -0.28 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 65.05 1va9 h THR 74 Cb 1.06 -0.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.47 1va9 h THR 74 CO 1.21 0.25 0.00 0.61 -0.25 0.00 0.00 175.52 177.34 1va9 n GLY 75 N -1.27 2.37 0.10 5.82 0.00 -1.26 -5.03 105.19 105.93 1va9 n GLY 75 Ca 0.10 -0.19 -0.12 0.00 0.00 0.00 0.00 46.02 45.81 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 0.22 -2.83 1.61 5.19 -1.99 -3.43 116.42 115.20 1va9 h ASP 76 Ca 0.00 -0.32 -0.64 0.00 -0.62 0.00 0.00 57.03 55.46 1va9 h ASP 76 Cb 0.00 -0.06 -0.06 0.00 0.18 0.00 0.00 39.33 39.39 1va9 h ASP 76 CO 0.00 0.48 -0.41 -0.94 -3.12 0.00 0.00 179.24 175.25 1va9 s SER 77 N -5.74 6.47 0.07 6.45 1.04 -1.26 -1.49 113.70 119.24 1va9 s SER 77 Ca -0.14 0.53 0.02 0.00 0.48 0.00 0.00 55.95 56.84 1va9 s SER 77 Cb 0.05 -2.08 -0.03 0.00 0.10 0.00 0.00 66.02 64.06 1va9 s SER 77 CO 0.71 0.30 -0.08 -1.61 0.98 0.00 0.00 173.24 173.54 1va9 s GLU 78 N -1.55 0.70 -0.01 4.02 2.02 -0.73 -4.66 118.70 118.50 1va9 s GLU 78 Ca 0.24 -1.03 -0.16 0.00 0.02 0.00 0.00 54.97 54.04 1va9 s GLU 78 Cb -0.13 -0.32 0.03 0.00 0.10 0.00 0.00 34.13 33.80 1va9 s GLU 78 CO 0.13 0.04 0.33 0.54 0.02 0.00 0.00 175.26 176.32 1va9 s VAL 79 N -2.34 0.06 -0.12 2.63 0.11 -1.26 -1.70 120.40 117.79 1va9 s VAL 79 Ca 0.01 -0.48 -0.05 0.00 -2.93 0.00 0.00 61.98 58.53 1va9 s VAL 79 Cb -0.03 -0.70 0.06 0.00 -1.53 0.00 0.00 36.38 34.18 1va9 s VAL 79 CO -0.01 -0.26 0.24 -0.47 -3.33 0.00 0.00 175.10 171.27 1va9 s TYR 80 N -1.55 -0.37 -0.66 1.54 6.14 0.13 -4.99 117.35 117.59 1va9 s TYR 80 Ca -0.12 0.89 -0.24 0.00 0.64 0.00 0.00 57.07 58.25 1va9 s TYR 80 Cb -0.04 -0.06 0.06 0.00 0.42 0.00 0.00 41.96 42.34 1va9 s TYR 80 CO 0.03 -0.33 1.03 0.99 0.64 0.00 0.00 175.55 177.91 1va9 s THR 81 N 2.26 4.20 -0.52 4.34 2.01 -1.26 -1.51 115.64 125.16 1va9 s THR 81 Ca 0.00 -0.14 -0.28 0.00 0.31 0.00 0.00 61.69 61.58 1va9 s THR 81 Cb -0.12 -4.72 0.02 0.00 0.01 0.00 0.00 72.50 67.70 1va9 s THR 81 CO -0.08 -1.51 1.28 -0.76 -0.69 0.00 0.00 174.62 172.86 1va9 s LEU 82 N 4.40 3.51 0.00 4.42 1.43 0.81 -4.86 118.68 128.38 1va9 s LEU 82 Ca 0.26 0.38 0.04 0.00 -1.03 0.00 0.00 54.13 53.78 1va9 s LEU 82 Cb -0.15 -3.31 0.06 0.00 0.03 0.00 0.00 46.19 42.82 1va9 s LEU 82 CO 0.12 -1.47 0.49 -0.90 0.23 0.00 0.00 176.35 174.82 1va9 n ASP 83 N 8.64 1.14 -3.09 2.29 5.75 -1.26 -0.40 116.55 129.61 1va9 n ASP 83 Ca 0.12 -1.85 -0.14 0.00 -0.01 0.00 0.00 54.79 52.91 1va9 n ASP 83 Cb 0.49 -0.28 0.07 0.00 -1.03 0.00 0.00 41.12 40.37 1va9 n ASP 83 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1va9 n ASN 84 N -2.68 -5.32 -3.86 -1.12 3.02 -0.32 -4.87 115.26 100.11 1va9 n ASN 84 Ca 0.10 -0.62 -0.21 0.00 -0.03 0.00 0.00 54.58 53.82 1va9 n ASN 84 Cb 0.35 -4.72 -0.03 0.00 -0.61 0.00 0.00 39.78 34.77 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 -3.21 0.00 -4.99 3.41 4.77 -0.12 -4.98 117.00 111.87 1va9 n LEU 85 Ca -0.10 -2.11 -0.23 0.00 -0.03 0.00 0.00 56.01 53.53 1va9 n LEU 85 Cb 0.62 0.17 0.11 0.00 -2.33 0.00 0.00 43.42 41.98 1va9 n LEU 85 CO 0.53 -0.36 0.54 -0.75 -1.33 0.00 0.00 177.39 176.03 1va9 s LYS 86 N -3.33 1.70 -0.21 3.23 2.36 -1.26 -4.62 119.74 117.61 1va9 s LYS 86 Ca 0.06 -1.13 -0.10 0.00 -2.55 0.00 0.00 55.97 52.24 1va9 s LYS 86 Cb -0.00 -2.34 -0.05 0.00 -1.05 0.00 0.00 37.83 34.38 1va9 s LYS 86 CO 0.04 -1.43 0.14 0.15 1.55 0.00 0.00 175.35 175.79 1va9 s LYS 87 N -5.13 4.15 -0.99 4.03 1.02 -1.26 -4.20 119.74 117.36 1va9 s LYS 87 Ca 0.66 -0.24 -0.21 0.00 0.02 0.00 0.00 55.97 56.20 1va9 s LYS 87 Cb -0.05 -3.44 0.03 0.00 -0.52 0.00 0.00 37.83 33.84 1va9 s LYS 87 CO 0.44 0.24 0.60 0.34 -0.92 0.00 0.00 175.35 176.04 1va9 n PHE 88 N 3.72 -1.46 -3.97 3.18 7.35 -0.88 -4.95 117.46 120.45 1va9 n PHE 88 Ca -0.16 0.30 -0.09 0.00 -0.76 0.00 0.00 57.45 56.73 1va9 n PHE 88 Cb 0.52 -2.51 -0.11 0.00 0.35 0.00 0.00 39.48 37.72 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 -3.39 0.13 0.21 3.13 0.00 -1.26 -4.88 121.76 115.70 1va9 s ALA 89 Ca 0.29 -0.55 -0.30 0.00 0.00 0.00 0.00 51.96 51.41 1va9 s ALA 89 Cb -0.16 0.13 -0.08 0.00 0.00 0.00 0.00 23.12 23.01 1va9 s ALA 89 CO 0.87 -0.14 1.11 -1.14 0.00 0.00 0.00 175.76 176.46 1va9 s GLN 90 N -1.35 4.60 -0.01 0.00 0.74 -1.26 -2.60 119.66 119.79 1va9 s GLN 90 Ca -0.15 1.76 0.00 0.00 0.05 0.00 0.00 55.36 57.02 1va9 s GLN 90 Cb -0.09 -3.25 0.01 0.00 1.10 0.00 0.00 33.01 30.78 1va9 s GLN 90 CO -0.01 0.11 0.01 0.71 -0.55 0.00 0.00 175.29 175.55 1va9 s TYR 91 N -0.52 0.02 -0.16 1.67 2.02 -1.26 -1.83 117.35 117.29 1va9 s TYR 91 Ca 0.48 0.03 0.01 0.00 -0.37 0.00 0.00 57.07 57.22 1va9 s TYR 91 Cb -0.30 -0.07 0.00 0.00 -0.40 0.00 0.00 41.96 41.19 1va9 s TYR 91 CO 0.37 -0.02 -0.17 0.20 -1.57 0.00 0.00 175.55 174.35 1va9 s GLY 92 N 0.27 1.44 0.13 0.71 0.00 -1.13 -2.89 107.32 105.84 1va9 s GLY 92 Ca -0.02 -1.08 0.05 0.00 0.00 0.00 0.00 44.72 43.66 1va9 s GLY 92 CO -0.01 0.05 -0.11 0.54 0.00 0.00 0.00 173.10 173.57 1va9 s VAL 93 N 0.88 1.18 0.25 1.40 0.11 -1.21 -2.47 120.40 120.55 1va9 s VAL 93 Ca -0.04 -1.91 0.07 0.00 -2.93 0.00 0.00 61.98 57.16 1va9 s VAL 93 Cb -0.15 -1.69 -0.05 0.00 -1.53 0.00 0.00 36.38 32.96 1va9 s VAL 93 CO -0.02 -0.63 -0.09 0.68 -3.33 0.00 0.00 175.10 171.71 1va9 s VAL 94 N -2.89 1.67 -0.02 2.04 -7.23 0.11 -3.24 120.40 110.84 1va9 s VAL 94 Ca 0.13 -2.15 0.02 0.00 -1.81 0.00 0.00 61.98 58.16 1va9 s VAL 94 Cb -0.00 -2.32 0.01 0.00 0.56 0.00 0.00 36.38 34.63 1va9 s VAL 94 CO 0.01 -0.39 -0.05 -0.69 -0.31 0.00 0.00 175.10 173.67 1va9 s VAL 95 N -3.00 0.51 -0.03 1.32 1.01 -1.26 -1.96 120.40 116.98 1va9 s VAL 95 Ca 0.27 -0.19 -0.05 0.00 0.00 0.00 0.00 61.98 62.01 1va9 s VAL 95 Cb 0.02 -0.49 0.01 0.00 0.00 0.00 0.00 36.38 35.92 1va9 s VAL 95 CO 0.10 0.18 0.12 0.00 0.00 0.00 0.00 175.10 175.51 1va9 s GLN 96 N 0.40 0.27 -0.21 2.72 -2.07 -0.75 -2.17 119.66 117.84 1va9 s GLN 96 Ca -0.05 -0.06 -0.19 0.00 -1.82 0.00 0.00 55.36 53.24 1va9 s GLN 96 Cb -0.09 0.12 -0.03 0.00 -1.09 0.00 0.00 33.01 31.92 1va9 s GLN 96 CO -0.00 -0.05 0.53 0.00 -1.32 0.00 0.00 175.29 174.45 1va9 s ALA 97 N -0.51 3.56 -0.10 2.60 0.00 -1.26 0.32 121.76 126.36 1va9 s ALA 97 Ca -0.06 -0.43 0.04 0.00 0.00 0.00 0.00 51.96 51.51 1va9 s ALA 97 Cb -0.04 -2.85 0.00 0.00 0.00 0.00 0.00 23.12 20.23 1va9 s ALA 97 CO 0.01 -0.53 -0.23 -0.59 0.00 0.00 0.00 175.76 174.42 1va9 s PHE 98 N 1.84 2.48 0.48 0.00 -0.12 0.17 -2.61 117.98 120.22 1va9 s PHE 98 Ca 0.24 -1.06 0.02 0.00 -0.05 0.00 0.00 56.93 56.08 1va9 s PHE 98 Cb -0.15 -1.67 -0.02 0.00 -0.63 0.00 0.00 43.02 40.55 1va9 s PHE 98 CO 0.09 -0.44 0.04 0.54 -0.05 0.00 0.00 175.22 175.40 1va9 s ASN 99 N 0.46 3.75 0.48 1.98 2.20 0.80 -1.99 114.94 122.63 1va9 s ASN 99 Ca -0.16 -1.66 0.22 0.00 -0.94 0.00 0.00 52.86 50.32 1va9 s ASN 99 Cb -0.17 0.52 1.24 0.00 -2.00 0.00 0.00 41.25 40.83 1va9 s ASN 99 CO 0.06 -0.88 2.02 0.03 -2.94 0.00 0.00 177.10 175.40 1va9 h ARG 100 N 1.48 0.00 0.00 3.55 2.47 -1.96 -0.85 114.38 119.07 1va9 h ARG 100 Ca -0.41 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.24 1va9 h ARG 100 Cb 1.30 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.61 1va9 h ARG 100 CO 0.69 0.17 -0.33 0.00 0.56 0.00 0.00 179.97 181.06 1va9 h ALA 101 N 1.83 1.08 0.00 0.04 0.00 -1.88 -3.49 119.26 116.85 1va9 h ALA 101 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1va9 h ALA 101 Cb 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1va9 h ALA 101 CO 0.02 0.41 0.00 0.41 0.00 0.00 0.00 179.25 180.09 1va9 n GLY 102 N 0.02 -0.09 3.73 0.00 0.00 -0.32 -4.22 105.19 104.30 1va9 n GLY 102 Ca -0.01 -1.63 -0.22 0.00 0.00 0.00 0.00 46.02 44.16 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 -2.31 3.90 0.08 2.61 2.01 -1.26 -0.14 115.64 120.53 1va9 s THR 103 Ca 0.00 -1.66 0.00 0.00 0.31 0.00 0.00 61.69 60.34 1va9 s THR 103 Cb 0.00 -3.11 0.00 0.00 0.01 0.00 0.00 72.50 69.40 1va9 s THR 103 CO 0.00 -0.35 0.04 0.61 -0.69 0.00 0.00 174.62 174.22 1va9 n GLY 104 N -1.04 3.47 3.80 4.40 0.00 -1.07 -4.37 105.19 110.37 1va9 n GLY 104 Ca -0.07 -2.21 -0.30 0.00 0.00 0.00 0.00 46.02 43.44 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 -2.33 1.99 0.71 1.61 0.04 -1.26 -4.81 135.00 130.96 1va9 s PRO 105 Ca 0.03 0.60 -0.05 0.00 0.04 0.00 0.00 61.00 61.62 1va9 s PRO 105 Cb -0.00 -1.91 0.09 0.00 0.04 0.00 0.00 34.50 32.72 1va9 s PRO 105 CO 0.02 -1.68 1.01 -1.54 0.04 0.00 0.00 177.00 174.85 1va9 s SER 106 N -3.92 4.57 0.28 6.66 1.04 -1.26 -4.05 113.70 117.03 1va9 s SER 106 Ca 0.61 0.17 0.06 0.00 0.48 0.00 0.00 55.95 57.27 1va9 s SER 106 Cb -0.14 -0.73 -0.02 0.00 0.10 0.00 0.00 66.02 65.23 1va9 s SER 106 CO 0.54 -1.72 0.40 -0.94 0.98 0.00 0.00 173.24 172.49 1va9 s SER 107 N -4.60 6.10 -0.32 7.02 1.04 -0.92 -4.47 113.70 117.55 1va9 s SER 107 Ca 0.63 -0.08 -0.37 0.00 0.48 0.00 0.00 55.95 56.61 1va9 s SER 107 Cb -0.09 -1.53 -0.13 0.00 0.10 0.00 0.00 66.02 64.37 1va9 s SER 107 CO 0.45 -0.24 2.04 -1.54 0.98 0.00 0.00 173.24 174.93 1va9 n SER 108 N -1.50 2.19 -4.65 7.02 3.41 -1.26 -4.67 113.62 114.15 1va9 n SER 108 Ca -0.05 0.66 -0.58 0.00 -0.26 0.00 0.00 58.87 58.64 1va9 n SER 108 Cb 0.58 -1.21 -0.07 0.00 -0.26 0.00 0.00 64.21 63.24 1va9 n SER 108 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1va9 n GLU 109 N 7.28 0.79 -3.70 4.33 2.13 -1.26 -4.95 120.64 125.26 1va9 n GLU 109 Ca 0.37 0.29 -0.24 0.00 0.66 0.00 0.00 57.16 58.24 1va9 n GLU 109 Cb 0.18 -1.90 -0.01 0.00 0.27 0.00 0.00 31.44 29.98 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 3.47 0.00 -3.98 6.31 -5.35 -1.20 -5.01 119.36 113.59 1va9 n ILE 110 Ca 0.24 -1.92 -0.10 0.00 -0.27 0.00 0.00 62.75 60.70 1va9 n ILE 110 Cb 0.11 0.03 -0.04 0.00 -1.74 0.00 0.00 39.64 38.00 1va9 n ILE 110 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1va9 s ASN 111 N -3.68 0.12 0.00 7.28 4.22 -1.26 -3.32 114.94 118.31 1va9 s ASN 111 Ca 0.20 -1.05 0.00 0.00 -2.14 0.00 0.00 52.86 49.87 1va9 s ASN 111 Cb -0.02 0.65 0.00 0.00 1.28 0.00 0.00 41.25 43.16 1va9 s ASN 111 CO 0.13 -1.26 0.00 0.00 -2.04 0.00 0.00 177.10 173.93 1va9 n ALA 112 N -0.45 0.00 -1.88 3.54 0.00 -1.14 -4.53 120.51 116.05 1va9 n ALA 112 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.99 1va9 n ALA 112 Cb 0.61 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.04 1va9 n ALA 112 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1va9 s THR 113 N 0.00 3.36 0.87 0.00 2.01 -1.26 -4.25 115.64 116.37 1va9 s THR 113 Ca 0.00 0.42 -0.15 0.00 0.31 0.00 0.00 61.69 62.27 1va9 s THR 113 Cb 0.00 -3.34 -0.03 0.00 0.01 0.00 0.00 72.50 69.14 1va9 s THR 113 CO 0.00 -0.11 0.21 0.35 -0.69 0.00 0.00 174.62 174.38 1va9 n THR 114 N 6.23 0.53 -0.58 -0.82 -2.24 -1.07 -4.84 114.28 111.50 1va9 n THR 114 Ca 0.21 -0.32 -0.30 0.00 -2.27 0.00 0.00 64.05 61.37 1va9 n THR 114 Cb 0.44 -0.52 0.20 0.00 -2.10 0.00 0.00 70.33 68.34 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 -0.03 -2.06 -0.94 3.22 7.99 -1.25 -3.98 117.00 119.95 1va9 n LEU 115 Ca 0.06 -0.23 0.08 0.00 -0.01 0.00 0.00 56.01 55.92 1va9 n LEU 115 Cb 0.53 -1.00 0.23 0.00 -0.11 0.00 0.00 43.42 43.06 1va9 n LEU 115 CO 0.51 -3.25 0.69 -1.84 -1.51 0.00 0.00 177.39 171.99 1va9 n GLU 116 N -2.95 2.80 -3.89 3.23 0.28 -1.26 -2.06 120.64 116.79 1va9 n GLU 116 Ca 0.02 -2.31 -0.08 0.00 -0.16 0.00 0.00 57.16 54.63 1va9 n GLU 116 Cb 0.58 -1.40 -0.03 0.00 1.43 0.00 0.00 31.44 32.03 1va9 n GLU 116 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 1va9 s SER 117 N -1.00 -0.21 1.04 -1.84 0.01 -1.26 -4.94 113.70 105.50 1va9 s SER 117 Ca 0.34 -0.70 -0.16 0.00 1.31 0.00 0.00 55.95 56.74 1va9 s SER 117 Cb 0.18 0.70 0.21 0.00 0.21 0.00 0.00 66.02 67.32 1va9 s SER 117 CO 0.23 -1.30 1.17 -0.83 0.41 0.00 0.00 173.24 172.91 1va9 s GLY 118 N -2.95 1.62 0.83 3.44 0.00 -1.26 -4.32 107.32 104.68 1va9 s GLY 118 Ca 0.14 -0.83 -0.12 0.00 0.00 0.00 0.00 44.72 43.91 1va9 s GLY 118 CO 0.08 -0.09 1.11 2.56 0.00 0.00 0.00 173.10 176.75 1va9 s PRO 119 N -5.44 1.85 -0.29 2.90 0.04 -1.26 -4.92 135.00 127.88 1va9 s PRO 119 Ca 0.69 0.55 -0.14 0.00 0.04 0.00 0.00 61.00 62.14 1va9 s PRO 119 Cb -0.11 -1.90 0.11 0.00 0.04 0.00 0.00 34.50 32.65 1va9 s PRO 119 CO 0.55 -1.76 0.75 0.45 0.04 0.00 0.00 177.00 177.02 1va9 s SER 120 N -3.94 -0.90 -0.63 6.66 0.15 -1.26 -5.09 113.70 108.68 1va9 s SER 120 Ca 0.61 1.36 -0.26 0.00 0.70 0.00 0.00 55.95 58.37 1va9 s SER 120 Cb -0.14 1.64 -0.07 0.00 -1.71 0.00 0.00 66.02 65.74 1va9 s SER 120 CO 0.54 -0.21 2.19 -0.44 1.20 0.00 0.00 173.24 176.53 1va9 s SER 121 N 2.01 4.66 0.00 5.45 0.01 -1.26 -5.25 113.70 119.32 1va9 s SER 121 Ca -0.08 0.45 0.00 0.00 1.31 0.00 0.00 55.95 57.63 1va9 s SER 121 Cb -0.07 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.64 1va9 s SER 121 CO -0.19 -2.91 0.00 0.61 0.41 0.00 0.00 173.24 171.17