#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 -7.98 -3.68 1.61 2.88 -1.26 -5.05 113.62 100.14 1va9 n SER 2 Ca 0.00 1.19 -0.12 0.00 -1.33 0.00 0.00 58.87 58.62 1va9 n SER 2 Cb 0.00 -5.23 -0.12 0.00 -0.75 0.00 0.00 64.21 58.11 1va9 n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1va9 s SER 3 N -1.85 -0.05 0.72 -3.46 1.04 -1.26 -5.15 113.70 103.69 1va9 s SER 3 Ca 0.06 0.73 -0.15 0.00 0.48 0.00 0.00 55.95 57.07 1va9 s SER 3 Cb -0.02 0.82 0.03 0.00 0.10 0.00 0.00 66.02 66.95 1va9 s SER 3 CO 0.76 -0.22 1.19 -0.83 0.98 0.00 0.00 173.24 175.13 1va9 s GLY 4 N 2.09 2.33 -0.05 7.32 0.00 -1.26 -5.05 107.32 112.71 1va9 s GLY 4 Ca -0.03 0.84 -0.26 0.00 0.00 0.00 0.00 44.72 45.26 1va9 s GLY 4 CO -0.10 1.24 0.58 -1.35 0.00 0.00 0.00 173.10 173.47 1va9 s SER 5 N -2.09 -0.54 -0.45 1.64 1.04 -1.26 -5.12 113.70 106.91 1va9 s SER 5 Ca 0.73 0.58 -0.08 0.00 0.48 0.00 0.00 55.95 57.66 1va9 s SER 5 Cb -0.28 0.51 0.11 0.00 0.10 0.00 0.00 66.02 66.46 1va9 s SER 5 CO 0.44 -0.55 0.31 -0.94 0.98 0.00 0.00 173.24 173.48 1va9 s SER 6 N -1.16 5.61 0.00 7.02 1.04 -1.26 -4.96 113.70 119.98 1va9 s SER 6 Ca -0.11 -1.89 0.00 0.00 0.48 0.00 0.00 55.95 54.43 1va9 s SER 6 Cb -0.02 -1.97 0.00 0.00 0.10 0.00 0.00 66.02 64.13 1va9 s SER 6 CO 0.08 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.26 1va9 n GLY 7 N 4.85 4.46 2.93 7.32 0.00 -1.26 -5.03 105.19 118.46 1va9 n GLY 7 Ca -0.07 -0.73 -0.40 0.00 0.00 0.00 0.00 46.02 44.81 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 -0.69 4.73 -3.29 -0.61 5.41 -1.26 -4.85 119.36 118.80 1va9 n ILE 8 Ca 0.00 -5.76 -0.13 0.00 1.00 0.00 0.00 62.75 57.86 1va9 n ILE 8 Cb 0.00 -2.12 -0.06 0.00 -0.71 0.00 0.00 39.64 36.75 1va9 n ILE 8 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 1va9 s SER 9 N -1.65 0.42 -0.10 4.38 0.01 -1.26 -4.97 113.70 110.53 1va9 s SER 9 Ca 0.32 -1.53 0.12 0.00 1.31 0.00 0.00 55.95 56.17 1va9 s SER 9 Cb 0.05 0.89 0.52 0.00 0.21 0.00 0.00 66.02 67.69 1va9 s SER 9 CO 0.07 -0.22 1.36 0.41 0.41 0.00 0.00 173.24 175.27 1va9 n THR 10 N 4.08 1.43 -3.85 1.44 -1.04 -1.26 -4.66 114.28 110.42 1va9 n THR 10 Ca 0.13 -0.85 -0.30 0.00 -2.04 0.00 0.00 64.05 60.99 1va9 n THR 10 Cb 0.48 -0.09 -0.14 0.00 -1.82 0.00 0.00 70.33 68.76 1va9 n THR 10 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1va9 s GLU 11 N -1.87 1.31 0.60 -2.82 2.02 -1.26 -5.11 118.70 111.56 1va9 s GLU 11 Ca 0.36 -1.83 0.04 0.00 0.02 0.00 0.00 54.97 53.57 1va9 s GLU 11 Cb 0.24 -2.66 0.08 0.00 0.10 0.00 0.00 34.13 31.89 1va9 s GLU 11 CO 0.15 -1.04 0.82 -1.21 0.02 0.00 0.00 175.26 174.01 1va9 s GLU 12 N 0.74 2.21 0.06 1.61 0.41 -1.26 -5.12 118.70 117.35 1va9 s GLU 12 Ca 0.14 -1.24 0.07 0.00 -0.41 0.00 0.00 54.97 53.52 1va9 s GLU 12 Cb -0.21 -2.53 -0.03 0.00 -1.78 0.00 0.00 34.13 29.58 1va9 s GLU 12 CO -0.09 -0.95 -0.19 0.00 -0.49 0.00 0.00 175.26 173.55 1va9 s ALA 13 N -2.80 1.61 0.87 5.21 0.00 -1.26 -4.70 121.76 120.69 1va9 s ALA 13 Ca 0.61 -1.07 -0.16 0.00 0.00 0.00 0.00 51.96 51.35 1va9 s ALA 13 Cb -0.07 -0.26 -0.09 0.00 0.00 0.00 0.00 23.12 22.70 1va9 s ALA 13 CO 0.40 0.33 -0.20 0.00 0.00 0.00 0.00 175.76 176.29 1va9 n ALA 14 N 1.56 -3.82 -1.80 0.00 0.00 -1.25 -4.73 120.51 110.47 1va9 n ALA 14 Ca -0.18 -0.51 -0.34 0.00 0.00 0.00 0.00 53.44 52.40 1va9 n ALA 14 Cb 0.54 -1.45 -0.04 0.00 0.00 0.00 0.00 19.45 18.50 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 -2.39 3.84 -0.52 0.00 0.04 -1.26 -4.82 135.00 129.89 1va9 s PRO 15 Ca 0.51 1.38 0.06 0.00 0.04 0.00 0.00 61.00 62.99 1va9 s PRO 15 Cb -0.26 -2.15 0.36 0.00 0.04 0.00 0.00 34.50 32.50 1va9 s PRO 15 CO 0.73 -0.40 0.95 -0.25 0.04 0.00 0.00 177.00 178.07 1va9 n ASP 16 N -0.86 3.99 0.00 6.66 8.00 -1.19 -4.06 116.55 129.09 1va9 n ASP 16 Ca 0.09 -3.58 0.00 0.00 0.71 0.00 0.00 54.79 52.01 1va9 n ASP 16 Cb 0.52 -0.55 0.00 0.00 -0.02 0.00 0.00 41.12 41.07 1va9 n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1va9 n GLY 17 N -0.22 3.26 3.77 0.44 0.00 -1.26 -4.87 105.19 106.31 1va9 n GLY 17 Ca 0.31 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.59 0.36 0.88 1.61 0.04 -1.26 -4.67 135.00 131.36 1va9 s PRO 18 Ca 0.00 -0.01 -0.12 0.00 0.04 0.00 0.00 61.00 60.91 1va9 s PRO 18 Cb 0.00 -1.77 0.12 0.00 0.04 0.00 0.00 34.50 32.88 1va9 s PRO 18 CO 0.00 -2.67 1.13 -1.25 0.04 0.00 0.00 177.00 174.25 1va9 s PRO 19 N -5.49 1.40 0.25 0.56 0.04 -1.26 -4.08 135.00 126.42 1va9 s PRO 19 Ca 0.69 0.38 0.08 0.00 0.04 0.00 0.00 61.00 62.19 1va9 s PRO 19 Cb -0.10 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 1va9 s PRO 19 CO 0.54 -2.04 0.12 -1.64 0.04 0.00 0.00 177.00 174.02 1va9 s MET 20 N -5.25 2.68 -1.17 4.56 -1.94 -0.51 -4.62 119.30 113.05 1va9 s MET 20 Ca 0.63 -1.17 -0.02 0.00 -1.71 0.00 0.00 55.69 53.41 1va9 s MET 20 Cb -0.15 -2.42 0.00 0.00 2.01 0.00 0.00 34.83 34.28 1va9 s MET 20 CO 0.53 0.39 0.99 -3.47 -0.01 0.00 0.00 175.02 173.46 1va9 n ASP 21 N -1.00 -2.98 -4.52 3.03 2.03 -1.26 1.00 116.55 112.84 1va9 n ASP 21 Ca -0.07 -0.57 -0.43 0.00 0.52 0.00 0.00 54.79 54.24 1va9 n ASP 21 Cb 0.58 -4.88 -0.04 0.00 -0.72 0.00 0.00 41.12 36.06 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 -3.33 4.38 0.02 5.18 1.01 -1.26 -3.58 120.40 122.82 1va9 s VAL 22 Ca 0.13 0.30 -0.14 0.00 0.00 0.00 0.00 61.98 62.27 1va9 s VAL 22 Cb -0.06 -4.54 0.02 0.00 0.00 0.00 0.00 36.38 31.80 1va9 s VAL 22 CO 0.69 -1.12 0.29 0.28 0.00 0.00 0.00 175.10 175.25 1va9 s THR 23 N 3.97 0.08 0.24 3.92 -1.32 -1.17 -4.92 115.64 116.43 1va9 s THR 23 Ca 0.31 -0.63 0.07 0.00 -1.21 0.00 0.00 61.69 60.23 1va9 s THR 23 Cb -0.12 -0.81 -0.04 0.00 -1.51 0.00 0.00 72.50 70.02 1va9 s THR 23 CO 0.19 -0.35 0.17 -0.76 -2.21 0.00 0.00 174.62 171.66 1va9 s LEU 24 N -1.79 3.76 -0.21 9.08 2.01 -1.26 -2.60 118.68 127.67 1va9 s LEU 24 Ca -0.08 -0.26 -0.05 0.00 0.01 0.00 0.00 54.13 53.75 1va9 s LEU 24 Cb -0.03 -2.31 0.10 0.00 0.01 0.00 0.00 46.19 43.97 1va9 s LEU 24 CO -0.01 -0.01 0.37 -1.58 1.01 0.00 0.00 176.35 176.13 1va9 s GLN 25 N -3.68 0.30 -0.42 1.70 0.74 0.11 -4.95 119.66 113.46 1va9 s GLN 25 Ca 0.32 0.77 -0.29 0.00 0.05 0.00 0.00 55.36 56.21 1va9 s GLN 25 Cb -0.08 -0.09 0.01 0.00 1.10 0.00 0.00 33.01 33.95 1va9 s GLN 25 CO 0.24 -0.42 1.42 -1.25 -0.55 0.00 0.00 175.29 174.72 1va9 s PRO 26 N 2.55 3.55 -0.22 1.67 0.04 -1.26 0.15 135.00 141.48 1va9 s PRO 26 Ca 0.05 0.90 0.04 0.00 0.04 0.00 0.00 61.00 62.03 1va9 s PRO 26 Cb -0.13 -4.04 -0.16 0.00 0.04 0.00 0.00 34.50 30.21 1va9 s PRO 26 CO -0.13 -1.60 -0.15 1.33 0.04 0.00 0.00 177.00 176.48 1va9 n VAL 27 N 7.08 1.27 -3.61 -0.36 0.24 -1.25 -4.91 118.33 116.80 1va9 n VAL 27 Ca 0.16 -0.53 -0.03 0.00 -2.04 0.00 0.00 64.34 61.90 1va9 n VAL 27 Cb 0.48 -1.16 -0.00 0.00 -1.47 0.00 0.00 33.84 31.69 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 -3.07 0.00 0.01 3.34 -2.24 -1.20 -5.06 114.28 106.06 1va9 n THR 28 Ca -0.38 -0.21 -0.17 0.00 -2.27 0.00 0.00 64.05 61.02 1va9 n THR 28 Cb 0.95 -0.39 -0.14 0.00 -2.10 0.00 0.00 70.33 68.65 1va9 n THR 28 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1va9 h SER 29 N 0.07 0.32 -1.09 3.42 0.02 -1.95 -3.39 113.55 110.95 1va9 h SER 29 Ca -0.03 -0.64 -0.53 0.00 -0.84 0.00 0.00 61.79 59.75 1va9 h SER 29 Cb 0.12 -0.10 -0.42 0.00 0.14 0.00 0.00 62.40 62.14 1va9 h SER 29 CO 0.05 1.56 -0.84 0.00 -1.14 0.00 0.00 176.83 176.47 1va9 n GLN 30 N -3.37 3.16 -3.56 3.45 6.02 -1.26 -4.44 117.38 117.38 1va9 n GLN 30 Ca -0.25 -4.19 -0.11 0.00 -0.01 0.00 0.00 57.00 52.44 1va9 n GLN 30 Cb 1.05 -2.12 -0.05 0.00 1.02 0.00 0.00 30.24 30.14 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 -3.55 -0.41 0.02 1.08 0.01 -1.26 -1.85 113.70 107.75 1va9 s SER 31 Ca 0.46 0.38 0.02 0.00 1.31 0.00 0.00 55.95 58.12 1va9 s SER 31 Cb 0.40 0.34 -0.01 0.00 0.21 0.00 0.00 66.02 66.96 1va9 s SER 31 CO -0.07 -0.42 -0.07 -0.63 0.41 0.00 0.00 173.24 172.46 1va9 s ILE 32 N -1.43 0.51 -0.25 1.44 1.01 0.39 -3.25 121.20 119.63 1va9 s ILE 32 Ca -0.02 -0.67 -0.14 0.00 0.00 0.00 0.00 60.65 59.82 1va9 s ILE 32 Cb -0.00 -0.51 -0.04 0.00 0.01 0.00 0.00 42.46 41.91 1va9 s ILE 32 CO 0.01 -0.13 0.30 -1.58 0.00 0.00 0.00 174.94 173.55 1va9 s GLN 33 N -0.87 4.06 -0.21 2.79 0.74 0.41 -1.46 119.66 125.11 1va9 s GLN 33 Ca -0.04 -0.04 -0.05 0.00 0.05 0.00 0.00 55.36 55.28 1va9 s GLN 33 Cb -0.06 -3.60 -0.02 0.00 1.10 0.00 0.00 33.01 30.43 1va9 s GLN 33 CO 0.00 -0.12 0.00 0.08 -0.55 0.00 0.00 175.29 174.70 1va9 s VAL 34 N 1.59 3.90 -0.04 1.34 1.01 -1.14 0.09 120.40 127.14 1va9 s VAL 34 Ca 0.13 -0.32 0.04 0.00 0.00 0.00 0.00 61.98 61.83 1va9 s VAL 34 Cb -0.15 -2.78 -0.00 0.00 0.00 0.00 0.00 36.38 33.45 1va9 s VAL 34 CO 0.08 0.41 -0.17 0.42 0.00 0.00 0.00 175.10 175.84 1va9 s THR 35 N 1.21 1.42 0.24 3.92 -4.23 -1.07 -2.27 115.64 114.85 1va9 s THR 35 Ca 0.03 -0.71 -0.10 0.00 -1.18 0.00 0.00 61.69 59.73 1va9 s THR 35 Cb -0.15 -1.22 -0.01 0.00 1.34 0.00 0.00 72.50 72.46 1va9 s THR 35 CO 0.01 0.41 0.40 -1.66 -0.54 0.00 0.00 174.62 173.24 1va9 s TRP 36 N 0.02 0.55 0.21 3.99 -2.14 -0.98 -3.06 118.94 117.52 1va9 s TRP 36 Ca -0.03 -0.88 0.09 0.00 2.66 0.00 0.00 56.10 57.94 1va9 s TRP 36 Cb -0.11 0.03 -0.05 0.00 -3.10 0.00 0.00 33.47 30.24 1va9 s TRP 36 CO 0.02 -0.92 -0.16 0.15 -2.66 0.00 0.00 176.95 173.37 1va9 s LYS 37 N -4.03 1.39 0.31 3.25 1.02 0.28 -2.57 119.74 119.39 1va9 s LYS 37 Ca 0.26 -1.58 -0.24 0.00 0.02 0.00 0.00 55.97 54.43 1va9 s LYS 37 Cb 0.01 -1.30 -0.16 0.00 -0.52 0.00 0.00 37.83 35.86 1va9 s LYS 37 CO 0.10 0.23 0.28 0.00 -0.92 0.00 0.00 175.35 175.04 1va9 n ALA 38 N -0.28 -2.94 -1.47 5.17 0.00 0.26 -1.42 120.51 119.82 1va9 n ALA 38 Ca -0.09 0.26 -0.19 0.00 0.00 0.00 0.00 53.44 53.42 1va9 n ALA 38 Cb 0.60 -1.53 0.21 0.00 0.00 0.00 0.00 19.45 18.73 1va9 n ALA 38 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1va9 n PRO 39 N 1.18 -2.10 -1.22 0.00 -0.04 -1.26 -3.88 135.00 127.68 1va9 n PRO 39 Ca 0.14 -1.79 -0.40 0.00 -0.04 0.00 0.00 63.50 61.41 1va9 n PRO 39 Cb 0.33 -1.41 -0.01 0.00 -0.04 0.00 0.00 33.50 32.37 1va9 n PRO 39 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1va9 n LYS 40 N -4.14 0.00 0.21 0.54 4.01 -1.26 -4.75 118.16 112.78 1va9 n LYS 40 Ca 0.15 0.00 -0.12 0.00 -0.51 0.00 0.00 58.31 57.83 1va9 n LYS 40 Cb 0.55 -0.93 -0.07 0.00 -0.51 0.00 0.00 35.03 34.08 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 0.40 -0.56 -1.96 1.97 1.63 -1.99 -2.52 116.57 113.54 1va9 h LYS 41 Ca -0.33 0.04 -0.28 0.00 -0.85 0.00 0.00 60.65 59.23 1va9 h LYS 41 Cb 1.34 0.13 -0.10 0.00 -0.60 0.00 0.00 32.23 32.99 1va9 h LYS 41 CO 0.45 -0.26 -0.04 -0.85 -3.45 0.00 0.00 179.45 175.30 1va9 n GLU 42 N -5.19 2.00 0.00 1.90 0.28 -1.26 -3.43 120.64 114.95 1va9 n GLU 42 Ca -0.09 -1.36 0.00 0.00 -0.16 0.00 0.00 57.16 55.55 1va9 n GLU 42 Cb 0.29 -1.91 0.00 0.00 1.43 0.00 0.00 31.44 31.25 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 1.72 0.00 -0.21 -1.84 4.77 -1.20 -4.88 117.00 115.35 1va9 n LEU 43 Ca 0.39 0.00 0.19 0.00 -0.03 0.00 0.00 56.01 56.56 1va9 n LEU 43 Cb 0.73 0.10 0.36 0.00 -2.33 0.00 0.00 43.42 42.28 1va9 n LEU 43 CO 0.19 -0.26 0.67 0.00 -1.33 0.00 0.00 177.39 176.66 1va9 n GLN 44 N -2.01 -0.04 -3.35 3.23 6.02 -0.95 -3.20 117.38 117.07 1va9 n GLN 44 Ca 0.00 0.91 -0.17 0.00 -0.01 0.00 0.00 57.00 57.73 1va9 n GLN 44 Cb 0.00 -1.61 0.07 0.00 1.02 0.00 0.00 30.24 29.72 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 -4.54 -5.14 0.00 1.08 3.02 -1.26 -4.34 115.26 104.08 1va9 n ASN 45 Ca 0.23 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 54.07 1va9 n ASN 45 Cb 0.79 -5.00 0.00 0.00 -0.61 0.00 0.00 39.78 34.96 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 -1.26 -3.58 3.73 7.41 0.00 -1.26 -4.10 105.19 106.13 1va9 n GLY 46 Ca -0.14 -2.09 -0.31 0.00 0.00 0.00 0.00 46.02 43.48 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 -0.70 2.90 -0.17 1.61 0.11 -1.26 -5.02 120.40 117.86 1va9 s VAL 47 Ca 0.00 0.29 -0.03 0.00 -2.93 0.00 0.00 61.98 59.31 1va9 s VAL 47 Cb 0.00 -2.66 -0.02 0.00 -1.53 0.00 0.00 36.38 32.17 1va9 s VAL 47 CO 0.00 -0.38 -0.05 -0.63 -3.33 0.00 0.00 175.10 170.71 1va9 s ILE 48 N -2.84 3.62 0.10 7.04 -1.09 -1.26 -4.86 121.20 121.91 1va9 s ILE 48 Ca 0.63 -0.44 0.02 0.00 -2.23 0.00 0.00 60.65 58.62 1va9 s ILE 48 Cb -0.19 -2.59 -0.24 0.00 -1.58 0.00 0.00 42.46 37.86 1va9 s ILE 48 CO 0.57 0.48 1.21 0.03 -1.23 0.00 0.00 174.94 176.00 1va9 h ARG 49 N 7.06 0.13 0.00 2.79 3.08 -1.92 -3.43 114.38 122.10 1va9 h ARG 49 Ca -0.32 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 59.51 1va9 h ARG 49 Cb 1.19 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.32 1va9 h ARG 49 CO 0.60 1.10 0.00 0.41 -1.07 0.00 0.00 179.97 181.02 1va9 n GLY 50 N 1.44 -1.02 3.05 0.04 0.00 -0.84 -3.29 105.19 104.56 1va9 n GLY 50 Ca -0.04 -1.05 -0.15 0.00 0.00 0.00 0.00 46.02 44.78 1va9 n GLY 50 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1va9 s TYR 51 N -2.00 0.69 0.12 1.61 1.51 -0.40 -0.40 117.35 118.49 1va9 s TYR 51 Ca 0.00 -0.38 -0.01 0.00 -1.01 0.00 0.00 57.07 55.67 1va9 s TYR 51 Cb 0.00 -0.42 -0.04 0.00 -0.11 0.00 0.00 41.96 41.39 1va9 s TYR 51 CO 0.00 -0.05 0.30 -0.65 -1.11 0.00 0.00 175.55 174.04 1va9 s GLN 52 N -1.17 3.50 -0.28 -0.62 -0.21 -0.14 -2.70 119.66 118.04 1va9 s GLN 52 Ca -0.05 -0.35 -0.01 0.00 0.02 0.00 0.00 55.36 54.96 1va9 s GLN 52 Cb -0.08 -2.94 0.09 0.00 1.00 0.00 0.00 33.01 31.08 1va9 s GLN 52 CO 0.00 0.52 0.07 0.42 -2.12 0.00 0.00 175.29 174.19 1va9 s ILE 53 N -1.65 0.88 -0.43 1.08 1.09 -0.96 -2.14 121.20 119.07 1va9 s ILE 53 Ca 0.37 -1.25 -0.18 0.00 -1.10 0.00 0.00 60.65 58.50 1va9 s ILE 53 Cb -0.12 -1.58 0.03 0.00 -1.06 0.00 0.00 42.46 39.73 1va9 s ILE 53 CO 0.27 -0.55 0.47 -0.83 -0.10 0.00 0.00 174.94 174.20 1va9 s GLY 54 N 1.63 1.88 0.01 6.18 0.00 0.22 -2.68 107.32 114.56 1va9 s GLY 54 Ca 0.07 -1.54 0.07 0.00 0.00 0.00 0.00 44.72 43.31 1va9 s GLY 54 CO -0.21 1.21 -0.20 -2.52 0.00 0.00 0.00 173.10 171.38 1va9 s TYR 55 N 2.21 1.81 0.01 1.90 1.13 -0.61 0.76 117.35 124.56 1va9 s TYR 55 Ca 0.13 -0.35 -0.24 0.00 -1.41 0.00 0.00 57.07 55.19 1va9 s TYR 55 Cb -0.17 -1.13 0.05 0.00 -1.10 0.00 0.00 41.96 39.61 1va9 s TYR 55 CO 0.14 0.02 0.54 -0.98 -2.51 0.00 0.00 175.55 172.75 1va9 s ARG 56 N -0.75 1.00 0.49 -3.49 1.70 -1.24 -0.36 118.95 116.31 1va9 s ARG 56 Ca 0.08 -0.09 -0.20 0.00 -0.47 0.00 0.00 55.73 55.04 1va9 s ARG 56 Cb -0.08 0.46 -0.11 0.00 -0.57 0.00 0.00 34.95 34.65 1va9 s ARG 56 CO 0.00 -0.34 0.56 -1.91 -1.08 0.00 0.00 175.30 172.53 1va9 n GLU 57 N 0.64 0.60 -1.13 3.89 0.00 -1.26 -3.11 120.64 120.26 1va9 n GLU 57 Ca -0.19 0.22 -0.26 0.00 0.00 0.00 0.00 57.16 56.94 1va9 n GLU 57 Cb 0.59 -1.63 0.10 0.00 0.00 0.00 0.00 31.44 30.49 1va9 n GLU 57 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1va9 n ASN 58 N 0.88 6.00 -4.97 4.31 2.85 -0.89 -4.73 115.26 118.71 1va9 n ASN 58 Ca 0.11 -3.48 -0.21 0.00 -0.11 0.00 0.00 54.58 50.89 1va9 n ASN 58 Cb 0.43 -0.93 -0.02 0.00 1.24 0.00 0.00 39.78 40.51 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 -1.09 6.31 -0.28 1.20 0.01 -1.26 -4.95 113.70 113.64 1va9 s SER 59 Ca 0.52 0.07 -0.29 0.00 1.31 0.00 0.00 55.95 57.55 1va9 s SER 59 Cb 0.42 -1.85 -0.00 0.00 0.21 0.00 0.00 66.02 64.79 1va9 s SER 59 CO 0.03 -0.07 1.34 -2.16 0.41 0.00 0.00 173.24 172.79 1va9 s PRO 60 N -3.96 3.93 -1.06 12.44 0.04 -1.26 -3.55 135.00 141.58 1va9 s PRO 60 Ca 0.34 1.34 -0.04 0.00 0.04 0.00 0.00 61.00 62.68 1va9 s PRO 60 Cb -0.09 -3.89 -0.04 0.00 0.04 0.00 0.00 34.50 30.52 1va9 s PRO 60 CO 0.29 -1.10 0.91 0.41 0.04 0.00 0.00 177.00 177.55 1va9 n GLY 61 N 4.29 -0.83 0.00 0.56 0.00 -1.26 -4.87 105.19 103.09 1va9 n GLY 61 Ca 0.15 0.39 0.12 0.00 0.00 0.00 0.00 46.02 46.68 1va9 n GLY 61 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1va9 n SER 62 N -3.12 0.00 -4.36 1.61 7.64 -1.23 -4.85 113.62 109.31 1va9 n SER 62 Ca -0.14 -0.51 -0.40 0.00 1.01 0.00 0.00 58.87 58.83 1va9 n SER 62 Cb 0.63 -0.10 -0.07 0.00 -1.01 0.00 0.00 64.21 63.66 1va9 n SER 62 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1va9 n ASN 63 N -1.10 -1.73 -3.74 6.43 3.02 -1.26 -4.84 115.26 112.03 1va9 n ASN 63 Ca 0.16 -1.14 -0.29 0.00 -0.03 0.00 0.00 54.58 53.28 1va9 n ASN 63 Cb 0.12 -1.52 -0.12 0.00 -0.61 0.00 0.00 39.78 37.65 1va9 n ASN 63 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1va9 s GLY 64 N -3.12 2.09 0.12 7.41 0.00 -1.26 -5.10 107.32 107.47 1va9 s GLY 64 Ca 0.78 -3.05 -0.33 0.00 0.00 0.00 0.00 44.72 42.12 1va9 s GLY 64 CO 0.95 1.43 0.83 0.61 0.00 0.00 0.00 173.10 176.92 1va9 n GLN 65 N 2.87 0.19 -1.40 2.90 0.00 -1.26 -4.58 117.38 116.11 1va9 n GLN 65 Ca 0.15 0.07 -0.60 0.00 0.00 0.00 0.00 57.00 56.62 1va9 n GLN 65 Cb 0.37 -1.33 -0.11 0.00 0.00 0.00 0.00 30.24 29.17 1va9 n GLN 65 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1va9 n TYR 66 N 0.77 1.39 -1.81 2.61 4.01 -1.26 -4.75 117.16 118.11 1va9 n TYR 66 Ca 0.18 0.75 -0.41 0.00 -0.16 0.00 0.00 57.90 58.26 1va9 n TYR 66 Cb 0.19 -2.33 -0.03 0.00 -0.31 0.00 0.00 39.34 36.86 1va9 n TYR 66 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1va9 s SER 67 N 5.51 5.34 0.29 7.72 0.01 0.51 -4.65 113.70 128.43 1va9 s SER 67 Ca 1.14 1.22 -0.18 0.00 1.31 0.00 0.00 55.95 59.44 1va9 s SER 67 Cb -1.38 -2.52 -0.09 0.00 0.21 0.00 0.00 66.02 62.25 1va9 s SER 67 CO 0.66 -2.16 0.76 -0.63 0.41 0.00 0.00 173.24 172.28 1va9 s ILE 68 N 8.86 4.59 -0.21 1.44 -1.09 -1.26 -1.58 121.20 131.95 1va9 s ILE 68 Ca 0.87 1.16 -0.04 0.00 -2.23 0.00 0.00 60.65 60.41 1va9 s ILE 68 Cb -0.22 -3.72 0.11 0.00 -1.58 0.00 0.00 42.46 37.04 1va9 s ILE 68 CO 0.30 -0.03 0.32 0.68 -1.23 0.00 0.00 174.94 174.98 1va9 s VAL 69 N -1.81 -0.51 0.37 2.92 -7.23 -1.09 -4.92 120.40 108.13 1va9 s VAL 69 Ca 0.50 0.00 -0.23 0.00 -1.81 0.00 0.00 61.98 60.44 1va9 s VAL 69 Cb -0.13 -0.70 -0.10 0.00 0.56 0.00 0.00 36.38 36.01 1va9 s VAL 69 CO 0.19 -0.08 0.93 -0.70 -0.31 0.00 0.00 175.10 175.13 1va9 s GLU 70 N 2.48 4.41 -0.04 4.82 -6.30 -1.26 -2.28 118.70 120.52 1va9 s GLU 70 Ca 0.08 1.21 -0.27 0.00 -2.50 0.00 0.00 54.97 53.48 1va9 s GLU 70 Cb -0.15 -2.53 0.06 0.00 0.00 0.00 0.00 34.13 31.51 1va9 s GLU 70 CO -0.13 0.15 0.59 0.00 0.02 0.00 0.00 175.26 175.89 1va9 s MET 71 N -2.55 0.97 0.49 4.30 0.23 -1.10 -5.01 119.30 116.63 1va9 s MET 71 Ca 0.55 0.16 -0.19 0.00 -1.03 0.00 0.00 55.69 55.19 1va9 s MET 71 Cb -0.14 0.45 -0.09 0.00 -1.53 0.00 0.00 34.83 33.52 1va9 s MET 71 CO 0.19 -0.29 0.99 -1.59 -2.03 0.00 0.00 175.02 172.29 1va9 s LYS 72 N -1.20 3.95 -0.35 3.16 -2.85 -1.26 -1.27 119.74 119.91 1va9 s LYS 72 Ca -0.11 1.11 -0.21 0.00 -1.00 0.00 0.00 55.97 55.75 1va9 s LYS 72 Cb -0.01 -2.13 0.00 0.00 -2.06 0.00 0.00 37.83 33.63 1va9 s LYS 72 CO 0.09 -0.28 0.69 0.00 0.10 0.00 0.00 175.35 175.95 1va9 s ALA 73 N -2.35 3.46 0.23 0.59 0.00 -1.21 -4.77 121.76 117.72 1va9 s ALA 73 Ca 0.62 -0.73 -0.08 0.00 0.00 0.00 0.00 51.96 51.77 1va9 s ALA 73 Cb -0.11 -3.23 0.24 0.00 0.00 0.00 0.00 23.12 20.02 1va9 s ALA 73 CO 0.24 -1.34 1.88 1.79 0.00 0.00 0.00 175.76 178.34 1va9 h THR 74 N 5.67 1.15 0.00 0.00 1.35 -1.96 -3.48 112.91 115.65 1va9 h THR 74 Ca -0.26 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.23 1va9 h THR 74 Cb 1.11 -0.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 1va9 h THR 74 CO 0.86 0.20 0.00 0.61 -0.25 0.00 0.00 175.52 176.93 1va9 n GLY 75 N -1.33 -0.65 0.31 5.82 0.00 -1.26 -4.97 105.19 103.10 1va9 n GLY 75 Ca 0.10 0.20 -0.04 0.00 0.00 0.00 0.00 46.02 46.28 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 0.94 -3.58 1.61 3.32 -1.99 -3.42 116.42 113.30 1va9 h ASP 76 Ca 0.00 -0.04 -0.67 0.00 0.02 0.00 0.00 57.03 56.34 1va9 h ASP 76 Cb 0.00 -0.24 -0.16 0.00 0.22 0.00 0.00 39.33 39.15 1va9 h ASP 76 CO 0.00 0.70 -0.73 -0.94 -1.72 0.00 0.00 179.24 176.55 1va9 s SER 77 N -5.97 4.44 0.04 6.45 1.04 -1.26 -0.58 113.70 117.85 1va9 s SER 77 Ca -0.13 -0.34 0.01 0.00 0.48 0.00 0.00 55.95 55.97 1va9 s SER 77 Cb 0.16 -0.88 -0.02 0.00 0.10 0.00 0.00 66.02 65.37 1va9 s SER 77 CO 0.79 0.20 -0.06 -1.61 0.98 0.00 0.00 173.24 173.54 1va9 s GLU 78 N -2.06 0.46 -0.05 4.02 8.01 -1.06 -4.28 118.70 123.74 1va9 s GLU 78 Ca 0.21 -0.75 -0.13 0.00 0.01 0.00 0.00 54.97 54.31 1va9 s GLU 78 Cb -0.11 -0.11 0.03 0.00 -4.31 0.00 0.00 34.13 29.63 1va9 s GLU 78 CO 0.13 0.00 0.31 0.54 0.01 0.00 0.00 175.26 176.25 1va9 s VAL 79 N -1.62 0.04 -0.03 2.63 0.11 -1.26 -2.33 120.40 117.94 1va9 s VAL 79 Ca -0.11 -0.34 -0.00 0.00 -2.93 0.00 0.00 61.98 58.60 1va9 s VAL 79 Cb -0.09 -0.56 0.03 0.00 -1.53 0.00 0.00 36.38 34.23 1va9 s VAL 79 CO -0.01 -0.19 0.04 -0.47 -3.33 0.00 0.00 175.10 171.15 1va9 s TYR 80 N -0.87 0.03 -0.61 1.54 5.04 -0.96 -5.01 117.35 116.51 1va9 s TYR 80 Ca -0.09 0.17 -0.26 0.00 -2.44 0.00 0.00 57.07 54.44 1va9 s TYR 80 Cb -0.04 -0.28 0.04 0.00 0.35 0.00 0.00 41.96 42.02 1va9 s TYR 80 CO 0.03 -0.11 1.11 0.99 -1.34 0.00 0.00 175.55 176.23 1va9 s THR 81 N 1.30 4.09 -0.54 4.34 2.01 -1.26 -2.90 115.64 122.69 1va9 s THR 81 Ca -0.06 0.49 -0.24 0.00 0.31 0.00 0.00 61.69 62.19 1va9 s THR 81 Cb -0.13 -4.71 0.04 0.00 0.01 0.00 0.00 72.50 67.71 1va9 s THR 81 CO -0.03 -1.39 0.94 -0.76 -0.69 0.00 0.00 174.62 172.69 1va9 s LEU 82 N 4.73 4.07 0.00 4.42 1.43 -0.53 -4.93 118.68 127.87 1va9 s LEU 82 Ca 0.36 -0.27 0.07 0.00 -1.03 0.00 0.00 54.13 53.25 1va9 s LEU 82 Cb -0.10 -2.89 0.07 0.00 0.03 0.00 0.00 46.19 43.29 1va9 s LEU 82 CO 0.20 -1.20 0.55 -0.90 0.23 0.00 0.00 176.35 175.22 1va9 n ASP 83 N 7.43 1.86 -2.99 2.29 5.68 -1.26 -0.46 116.55 129.10 1va9 n ASP 83 Ca 0.03 -2.29 -0.10 0.00 -0.50 0.00 0.00 54.79 51.93 1va9 n ASP 83 Cb 0.48 -0.25 0.04 0.00 -1.14 0.00 0.00 41.12 40.25 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 -2.31 -6.37 -2.55 -1.12 3.02 -0.77 -4.90 115.26 100.26 1va9 n ASN 84 Ca 0.09 -0.47 -0.07 0.00 -0.03 0.00 0.00 54.58 54.09 1va9 n ASN 84 Cb 0.48 -4.69 -0.02 0.00 -0.61 0.00 0.00 39.78 34.94 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 -2.66 0.00 -4.92 3.41 4.77 -1.19 -5.02 117.00 111.40 1va9 n LEU 85 Ca -0.04 -0.74 -0.21 0.00 -0.03 0.00 0.00 56.01 54.99 1va9 n LEU 85 Cb 0.58 0.10 -0.03 0.00 -2.33 0.00 0.00 43.42 41.74 1va9 n LEU 85 CO 0.50 -0.11 -0.07 -0.75 -1.33 0.00 0.00 177.39 175.64 1va9 s LYS 86 N -2.42 3.17 -0.11 3.23 2.20 -1.26 -4.82 119.74 119.73 1va9 s LYS 86 Ca 0.01 -0.94 -0.19 0.00 -0.36 0.00 0.00 55.97 54.49 1va9 s LYS 86 Cb 0.00 -2.74 -0.04 0.00 -1.51 0.00 0.00 37.83 33.54 1va9 s LYS 86 CO 0.00 0.34 0.51 0.15 -0.36 0.00 0.00 175.35 176.00 1va9 s LYS 87 N -3.97 4.35 -0.94 4.03 1.02 -1.26 -4.37 119.74 118.61 1va9 s LYS 87 Ca 0.36 0.52 -0.10 0.00 0.02 0.00 0.00 55.97 56.76 1va9 s LYS 87 Cb -0.08 -3.44 0.01 0.00 -0.52 0.00 0.00 37.83 33.79 1va9 s LYS 87 CO 0.28 0.14 0.68 0.34 -0.92 0.00 0.00 175.35 175.86 1va9 n PHE 88 N 3.70 -2.08 -3.76 3.18 7.35 -0.46 -4.97 117.46 120.43 1va9 n PHE 88 Ca -0.06 0.68 -0.13 0.00 -0.76 0.00 0.00 57.45 57.18 1va9 n PHE 88 Cb 0.52 -3.16 -0.10 0.00 0.35 0.00 0.00 39.48 37.09 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 -3.18 -0.82 0.32 3.13 0.00 -1.26 -4.87 121.76 115.07 1va9 s ALA 89 Ca 0.18 0.72 -0.28 0.00 0.00 0.00 0.00 51.96 52.59 1va9 s ALA 89 Cb -0.08 -0.32 -0.09 0.00 0.00 0.00 0.00 23.12 22.63 1va9 s ALA 89 CO 0.88 -0.20 1.09 -1.14 0.00 0.00 0.00 175.76 176.38 1va9 s GLN 90 N -0.39 4.49 -0.04 0.00 0.74 -1.26 -2.07 119.66 121.14 1va9 s GLN 90 Ca -0.05 1.72 -0.02 0.00 0.05 0.00 0.00 55.36 57.06 1va9 s GLN 90 Cb -0.03 -3.00 0.02 0.00 1.10 0.00 0.00 33.01 31.10 1va9 s GLN 90 CO 0.02 0.10 0.08 0.71 -0.55 0.00 0.00 175.29 175.65 1va9 s TYR 91 N -1.30 -0.07 -0.30 1.67 2.02 -1.26 -2.10 117.35 116.01 1va9 s TYR 91 Ca 0.48 0.25 0.01 0.00 -0.37 0.00 0.00 57.07 57.44 1va9 s TYR 91 Cb -0.29 -0.10 0.07 0.00 -0.40 0.00 0.00 41.96 41.24 1va9 s TYR 91 CO 0.37 -0.09 -0.01 0.20 -1.57 0.00 0.00 175.55 174.45 1va9 s GLY 92 N 0.72 1.78 0.28 0.71 0.00 -1.18 -2.59 107.32 107.04 1va9 s GLY 92 Ca -0.06 -1.98 0.08 0.00 0.00 0.00 0.00 44.72 42.77 1va9 s GLY 92 CO -0.03 0.74 0.12 -1.34 0.00 0.00 0.00 173.10 172.59 1va9 s VAL 93 N 1.13 3.68 -0.01 1.40 -7.23 -1.26 -3.60 120.40 114.52 1va9 s VAL 93 Ca -0.02 -1.65 0.03 0.00 -1.81 0.00 0.00 61.98 58.53 1va9 s VAL 93 Cb -0.20 -3.09 -0.01 0.00 0.56 0.00 0.00 36.38 33.65 1va9 s VAL 93 CO -0.04 -0.30 -0.10 0.68 -0.31 0.00 0.00 175.10 175.02 1va9 s VAL 94 N -2.28 0.81 0.05 1.32 -7.23 0.23 -3.43 120.40 109.87 1va9 s VAL 94 Ca 0.34 -0.44 0.06 0.00 -1.81 0.00 0.00 61.98 60.13 1va9 s VAL 94 Cb -0.06 -0.68 -0.04 0.00 0.56 0.00 0.00 36.38 36.17 1va9 s VAL 94 CO 0.23 0.23 -0.11 -0.69 -0.31 0.00 0.00 175.10 174.44 1va9 s VAL 95 N -0.22 3.29 -0.03 1.32 1.01 -1.26 -0.61 120.40 123.89 1va9 s VAL 95 Ca 0.04 -1.08 -0.20 0.00 0.00 0.00 0.00 61.98 60.74 1va9 s VAL 95 Cb -0.04 -2.46 0.04 0.00 0.00 0.00 0.00 36.38 33.92 1va9 s VAL 95 CO -0.00 0.27 0.44 0.00 0.00 0.00 0.00 175.10 175.81 1va9 s GLN 96 N -1.72 0.79 -0.13 2.72 -2.07 -0.91 -1.30 119.66 117.04 1va9 s GLN 96 Ca 0.18 0.00 -0.19 0.00 -1.82 0.00 0.00 55.36 53.53 1va9 s GLN 96 Cb -0.11 0.36 -0.04 0.00 -1.09 0.00 0.00 33.01 32.13 1va9 s GLN 96 CO 0.09 -0.22 0.51 0.00 -1.32 0.00 0.00 175.29 174.35 1va9 s ALA 97 N -1.20 3.48 -0.07 2.60 0.00 -1.26 -0.96 121.76 124.35 1va9 s ALA 97 Ca -0.12 -0.21 0.04 0.00 0.00 0.00 0.00 51.96 51.67 1va9 s ALA 97 Cb -0.03 -2.72 0.00 0.00 0.00 0.00 0.00 23.12 20.37 1va9 s ALA 97 CO 0.06 -0.12 -0.19 -0.59 0.00 0.00 0.00 175.76 174.92 1va9 s PHE 98 N 0.90 2.00 0.47 0.00 -0.12 0.47 -1.58 117.98 120.11 1va9 s PHE 98 Ca 0.27 -0.73 0.02 0.00 -0.05 0.00 0.00 56.93 56.44 1va9 s PHE 98 Cb -0.15 -1.37 -0.02 0.00 -0.63 0.00 0.00 43.02 40.85 1va9 s PHE 98 CO 0.11 -0.30 0.06 0.54 -0.05 0.00 0.00 175.22 175.58 1va9 s ASN 99 N 0.34 3.54 0.17 1.98 2.20 0.11 -1.98 114.94 121.30 1va9 s ASN 99 Ca -0.13 -1.67 0.17 0.00 -0.94 0.00 0.00 52.86 50.29 1va9 s ASN 99 Cb -0.16 0.52 0.79 0.00 -2.00 0.00 0.00 41.25 40.40 1va9 s ASN 99 CO 0.05 -0.89 1.53 0.54 -2.94 0.00 0.00 177.10 175.39 1va9 n ARG 100 N -1.11 0.11 0.13 3.55 5.12 -1.26 -0.91 116.66 122.29 1va9 n ARG 100 Ca -0.13 0.44 0.04 0.00 -1.93 0.00 0.00 57.85 56.27 1va9 n ARG 100 Cb 0.66 -1.75 0.02 0.00 -1.16 0.00 0.00 32.46 30.24 1va9 n ARG 100 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1va9 h ALA 101 N 2.22 0.70 0.00 7.54 0.00 -1.88 -3.50 119.26 124.35 1va9 h ALA 101 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1va9 h ALA 101 Cb 0.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1va9 h ALA 101 CO 0.00 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.19 1va9 n GLY 102 N 1.24 0.12 3.22 0.00 0.00 -0.08 -3.91 105.19 105.78 1va9 n GLY 102 Ca -0.00 -1.27 -0.25 0.00 0.00 0.00 0.00 46.02 44.50 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 -3.67 1.57 0.27 2.61 2.01 -1.26 0.07 115.64 117.23 1va9 s THR 103 Ca 0.00 -1.05 -0.01 0.00 0.31 0.00 0.00 61.69 60.94 1va9 s THR 103 Cb 0.00 -1.35 0.06 0.00 0.01 0.00 0.00 72.50 71.22 1va9 s THR 103 CO 0.00 0.27 0.36 0.61 -0.69 0.00 0.00 174.62 175.17 1va9 n GLY 104 N 2.13 0.23 3.81 4.40 0.00 -0.62 -4.57 105.19 110.57 1va9 n GLY 104 Ca -0.16 -1.91 -0.30 0.00 0.00 0.00 0.00 46.02 43.65 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 -3.47 2.49 0.31 1.61 0.04 -1.26 -4.81 135.00 129.92 1va9 s PRO 105 Ca 0.23 0.79 -0.14 0.00 0.04 0.00 0.00 61.00 61.92 1va9 s PRO 105 Cb -0.01 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.49 1va9 s PRO 105 CO 0.15 -1.37 0.71 -1.54 0.04 0.00 0.00 177.00 174.99 1va9 s SER 106 N -3.85 6.73 0.69 6.66 1.04 -1.26 -4.23 113.70 119.48 1va9 s SER 106 Ca 0.59 1.22 -0.07 0.00 0.48 0.00 0.00 55.95 58.17 1va9 s SER 106 Cb -0.14 -2.35 0.05 0.00 0.10 0.00 0.00 66.02 63.68 1va9 s SER 106 CO 0.55 -0.20 1.02 -0.94 0.98 0.00 0.00 173.24 174.64 1va9 s SER 107 N -2.34 4.98 -0.01 7.02 1.04 -0.42 -4.82 113.70 119.15 1va9 s SER 107 Ca 0.53 0.60 -0.31 0.00 0.48 0.00 0.00 55.95 57.25 1va9 s SER 107 Cb -0.10 -1.31 -0.09 0.00 0.10 0.00 0.00 66.02 64.61 1va9 s SER 107 CO 0.19 -1.51 1.97 -1.20 0.98 0.00 0.00 173.24 173.67 1va9 n SER 108 N -2.91 3.93 -4.62 7.02 7.64 -1.26 -4.60 113.62 118.83 1va9 n SER 108 Ca 0.07 0.87 -0.43 0.00 1.01 0.00 0.00 58.87 60.39 1va9 n SER 108 Cb 0.60 -1.49 -0.03 0.00 -1.01 0.00 0.00 64.21 62.28 1va9 n SER 108 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1va9 s GLU 109 N 4.52 3.52 0.00 1.43 2.12 -1.26 -4.90 118.70 124.12 1va9 s GLU 109 Ca 0.91 1.75 0.00 0.00 0.36 0.00 0.00 54.97 57.99 1va9 s GLU 109 Cb -0.50 -4.18 0.00 0.00 0.26 0.00 0.00 34.13 29.71 1va9 s GLU 109 CO 0.44 -1.64 0.00 -0.89 -0.54 0.00 0.00 175.26 172.63 1va9 n ILE 110 N 7.00 0.00 -3.71 -3.70 -0.00 -1.22 -4.91 119.36 112.82 1va9 n ILE 110 Ca 0.23 0.00 -0.12 0.00 -0.00 0.00 0.00 62.75 62.86 1va9 n ILE 110 Cb 0.45 -1.54 -0.10 0.00 -0.00 0.00 0.00 39.64 38.45 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 -0.51 -0.36 4.38 4.22 -1.26 -4.02 114.94 116.38 1va9 s ASN 111 Ca 0.00 0.93 0.04 0.00 -2.14 0.00 0.00 52.86 51.69 1va9 s ASN 111 Cb 0.00 0.88 0.16 0.00 1.28 0.00 0.00 41.25 43.57 1va9 s ASN 111 CO 0.00 -0.18 0.41 0.00 -2.04 0.00 0.00 177.10 175.30 1va9 s ALA 112 N 0.79 -0.80 0.23 3.54 0.00 -1.07 -4.89 121.76 119.56 1va9 s ALA 112 Ca -0.04 -0.64 -0.31 0.00 0.00 0.00 0.00 51.96 50.97 1va9 s ALA 112 Cb -0.05 -2.14 -0.11 0.00 0.00 0.00 0.00 23.12 20.81 1va9 s ALA 112 CO -0.06 -2.08 1.61 0.99 0.00 0.00 0.00 175.76 176.22 1va9 s THR 113 N 1.67 2.25 1.14 0.00 2.01 -1.26 -4.24 115.64 117.20 1va9 s THR 113 Ca 0.16 0.19 -0.12 0.00 0.31 0.00 0.00 61.69 62.22 1va9 s THR 113 Cb -0.13 -3.12 0.26 0.00 0.01 0.00 0.00 72.50 69.52 1va9 s THR 113 CO -0.09 0.02 1.01 0.35 -0.69 0.00 0.00 174.62 175.22 1va9 n THR 114 N 3.21 0.00 -0.78 -0.82 -2.24 -0.88 -4.84 114.28 107.93 1va9 n THR 114 Ca 0.12 -0.37 -0.29 0.00 -2.27 0.00 0.00 64.05 61.23 1va9 n THR 114 Cb 0.37 -0.98 0.24 0.00 -2.10 0.00 0.00 70.33 67.86 1va9 n THR 114 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1va9 s LEU 115 N -6.97 0.43 0.00 3.22 2.01 -1.26 -3.98 118.68 112.13 1va9 s LEU 115 Ca 0.68 1.03 0.25 0.00 0.01 0.00 0.00 54.13 56.09 1va9 s LEU 115 Cb -0.25 -2.81 1.36 0.00 0.01 0.00 0.00 46.19 44.50 1va9 s LEU 115 CO 0.64 -4.28 1.89 -0.62 1.01 0.00 0.00 176.35 174.99 1va9 n GLU 116 N -4.92 1.15 -1.27 1.70 1.02 -1.26 -1.36 120.64 115.71 1va9 n GLU 116 Ca 0.08 -0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 1va9 n GLU 116 Cb 0.58 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 1va9 n GLU 116 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1va9 n SER 117 N -0.64 -6.32 0.00 1.62 2.88 -1.26 -4.85 113.62 105.05 1va9 n SER 117 Ca 0.18 0.81 0.00 0.00 -1.33 0.00 0.00 58.87 58.54 1va9 n SER 117 Cb 0.14 -3.00 0.00 0.00 -0.75 0.00 0.00 64.21 60.60 1va9 n SER 117 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1va9 n GLY 118 N 0.60 0.54 3.76 0.46 0.00 -1.26 -5.12 105.19 104.17 1va9 n GLY 118 Ca 0.00 -1.63 -0.40 0.00 0.00 0.00 0.00 46.02 43.99 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 -1.54 4.59 0.30 1.61 0.04 -1.26 -5.02 135.00 133.72 1va9 s PRO 119 Ca 0.00 1.73 0.07 0.00 0.04 0.00 0.00 61.00 62.85 1va9 s PRO 119 Cb 0.00 -3.10 -0.03 0.00 0.04 0.00 0.00 34.50 31.41 1va9 s PRO 119 CO 0.00 0.19 0.24 -1.54 0.04 0.00 0.00 177.00 175.92 1va9 s SER 120 N -1.01 5.31 0.02 6.66 1.04 -1.26 -5.12 113.70 119.34 1va9 s SER 120 Ca 0.46 -0.42 0.01 0.00 0.48 0.00 0.00 55.95 56.47 1va9 s SER 120 Cb -0.30 -1.12 -0.04 0.00 0.10 0.00 0.00 66.02 64.67 1va9 s SER 120 CO 0.38 -0.22 0.09 -0.44 0.98 0.00 0.00 173.24 174.03 1va9 s SER 121 N -3.92 5.67 0.00 7.02 0.01 -1.26 -5.33 113.70 115.90 1va9 s SER 121 Ca 0.37 0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.74 1va9 s SER 121 Cb -0.06 -1.61 0.00 0.00 0.21 0.00 0.00 66.02 64.56 1va9 s SER 121 CO 0.25 0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.75