#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2di9 s SER 2 N 0.00 -0.11 0.31 1.61 1.04 -1.26 -5.19 113.70 110.09 2di9 s SER 2 Ca 0.00 -0.32 -0.18 0.00 0.48 0.00 0.00 55.95 55.93 2di9 s SER 2 Cb 0.00 0.35 0.03 0.00 0.10 0.00 0.00 66.02 66.50 2di9 s SER 2 CO 0.00 -0.66 0.71 -0.55 0.98 0.00 0.00 173.24 173.72 2di9 s SER 3 N -3.01 -0.13 0.33 7.02 0.15 -1.26 -5.19 113.70 111.61 2di9 s SER 3 Ca 0.14 -0.82 0.08 0.00 0.70 0.00 0.00 55.95 56.05 2di9 s SER 3 Cb 0.01 0.75 -0.06 0.00 -1.71 0.00 0.00 66.02 65.01 2di9 s SER 3 CO 0.00 -1.43 -0.06 -0.83 1.20 0.00 0.00 173.24 172.13 2di9 s GLY 4 N -2.98 2.10 -0.07 9.45 0.00 -1.26 -5.16 107.32 109.40 2di9 s GLY 4 Ca 0.14 -2.05 -0.30 0.00 0.00 0.00 0.00 44.72 42.50 2di9 s GLY 4 CO 0.09 -1.96 0.97 -1.35 0.00 0.00 0.00 173.10 170.85 2di9 s SER 5 N -3.56 -0.32 0.23 1.64 1.04 -1.26 -5.19 113.70 106.28 2di9 s SER 5 Ca 0.32 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.83 2di9 s SER 5 Cb 0.04 0.32 -0.05 0.00 0.10 0.00 0.00 66.02 66.44 2di9 s SER 5 CO 0.15 -0.49 0.10 -0.44 0.98 0.00 0.00 173.24 173.55 2di9 s SER 6 N -2.15 0.74 0.07 7.02 0.01 -1.26 -5.18 113.70 112.95 2di9 s SER 6 Ca 0.05 -1.37 -0.26 0.00 1.31 0.00 0.00 55.95 55.67 2di9 s SER 6 Cb -0.01 0.25 0.09 0.00 0.21 0.00 0.00 66.02 66.56 2di9 s SER 6 CO -0.06 -0.77 0.77 -0.83 0.41 0.00 0.00 173.24 172.76 2di9 s GLY 7 N -3.24 -0.52 -0.18 3.44 0.00 -1.26 -5.18 107.32 100.38 2di9 s GLY 7 Ca 0.37 0.77 -0.34 0.00 0.00 0.00 0.00 44.72 45.52 2di9 s GLY 7 CO 0.12 0.25 1.19 -0.35 0.00 0.00 0.00 173.10 174.31 2di9 s ASP 8 N -2.60 -0.15 -0.11 1.64 2.15 -1.26 -5.16 116.67 111.17 2di9 s ASP 8 Ca 0.04 0.02 -0.10 0.00 0.43 0.00 0.00 52.55 52.93 2di9 s ASP 8 Cb -0.01 0.16 -0.05 0.00 -0.30 0.00 0.00 42.92 42.72 2di9 s ASP 8 CO -0.10 -0.25 0.22 -0.69 -0.17 0.00 0.00 175.17 174.18 2di9 s VAL 9 N -2.35 5.36 -0.09 1.11 1.01 -1.26 -5.09 120.40 119.10 2di9 s VAL 9 Ca 0.09 0.39 -0.22 0.00 0.00 0.00 0.00 61.98 62.24 2di9 s VAL 9 Cb -0.01 -3.51 0.05 0.00 0.00 0.00 0.00 36.38 32.91 2di9 s VAL 9 CO -0.05 0.55 0.53 -0.89 0.00 0.00 0.00 175.10 175.24 2di9 s THR 10 N -0.61 0.02 -0.29 3.92 2.01 -1.26 -5.16 115.64 114.27 2di9 s THR 10 Ca 0.16 -0.14 -0.16 0.00 0.31 0.00 0.00 61.69 61.87 2di9 s THR 10 Cb -0.13 -0.81 0.11 0.00 0.01 0.00 0.00 72.50 71.68 2di9 s THR 10 CO 0.05 -0.08 0.81 -0.72 -0.69 0.00 0.00 174.62 173.99 2di9 s TYR 11 N -0.71 -0.88 -0.30 4.92 1.13 -1.26 -5.15 117.35 115.10 2di9 s TYR 11 Ca -0.08 1.74 -0.07 0.00 -1.41 0.00 0.00 57.07 57.25 2di9 s TYR 11 Cb -0.03 0.53 0.17 0.00 -1.10 0.00 0.00 41.96 41.53 2di9 s TYR 11 CO 0.05 -0.44 0.73 -0.51 -2.51 0.00 0.00 175.55 172.87 2di9 s ASP 12 N 1.62 -1.09 -0.41 -0.18 1.01 -1.26 -5.12 116.67 111.25 2di9 s ASP 12 Ca -0.09 1.01 0.08 0.00 0.71 0.00 0.00 52.55 54.25 2di9 s ASP 12 Cb -0.05 2.04 0.18 0.00 1.01 0.00 0.00 42.92 46.10 2di9 s ASP 12 CO -0.18 -0.21 0.61 -0.83 0.21 0.00 0.00 175.17 174.78 2di9 s GLY 13 N 2.83 -1.18 -0.03 0.21 0.00 -1.26 -5.15 107.32 102.75 2di9 s GLY 13 Ca 0.07 0.12 -0.07 0.00 0.00 0.00 0.00 44.72 44.84 2di9 s GLY 13 CO -0.19 3.60 0.16 -2.38 0.00 0.00 0.00 173.10 174.29 2di9 s HIS 14 N 1.80 -0.06 -0.08 1.90 -3.43 -1.26 -5.13 115.29 109.03 2di9 s HIS 14 Ca 0.16 0.14 -0.30 0.00 -0.80 0.00 0.00 55.06 54.27 2di9 s HIS 14 Cb -0.05 0.00 -0.04 0.00 -1.43 0.00 0.00 32.58 31.06 2di9 s HIS 14 CO -0.07 -0.20 1.52 -1.25 -2.00 0.00 0.00 174.74 172.74 2di9 s PRO 15 N -0.73 4.20 0.41 -0.38 0.04 -1.26 -4.96 135.00 132.33 2di9 s PRO 15 Ca -0.08 2.01 -0.24 0.00 0.04 0.00 0.00 61.00 62.73 2di9 s PRO 15 Cb -0.05 -3.89 -0.11 0.00 0.04 0.00 0.00 34.50 30.50 2di9 s PRO 15 CO 0.01 -0.78 0.94 1.33 0.04 0.00 0.00 177.00 178.53 2di9 n VAL 16 N 5.38 2.35 -1.30 -0.36 0.24 -1.26 -4.95 118.33 118.43 2di9 n VAL 16 Ca 0.16 -0.50 -0.31 0.00 -2.04 0.00 0.00 64.34 61.65 2di9 n VAL 16 Cb 0.43 -1.05 0.09 0.00 -1.47 0.00 0.00 33.84 31.85 2di9 n VAL 16 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2di9 s PRO 17 N -1.93 2.30 0.07 7.34 0.04 -1.26 -4.95 135.00 136.62 2di9 s PRO 17 Ca 0.63 1.19 -0.31 0.00 0.04 0.00 0.00 61.00 62.56 2di9 s PRO 17 Cb -0.57 -1.90 -0.09 0.00 0.04 0.00 0.00 34.50 31.98 2di9 s PRO 17 CO 0.57 -1.61 1.70 0.20 0.04 0.00 0.00 177.00 177.89 2di9 s GLY 18 N -3.31 1.51 0.43 0.56 0.00 -1.26 -4.96 107.32 100.29 2di9 s GLY 18 Ca 0.62 1.24 -0.25 0.00 0.00 0.00 0.00 44.72 46.33 2di9 s GLY 18 CO 0.55 2.96 1.26 -0.56 0.00 0.00 0.00 173.10 177.31 2di9 s SER 19 N 2.59 6.23 0.00 1.64 0.01 -1.26 -4.89 113.70 118.01 2di9 s SER 19 Ca 0.76 2.54 0.15 0.00 1.31 0.00 0.00 55.95 60.71 2di9 s SER 19 Cb -0.41 -2.63 0.78 0.00 0.21 0.00 0.00 66.02 63.98 2di9 s SER 19 CO 0.33 -0.90 1.40 -0.81 0.41 0.00 0.00 173.24 173.68 2di9 n PRO 20 N -0.10 0.26 -1.12 12.44 -0.04 -1.26 -3.86 135.00 141.31 2di9 n PRO 20 Ca 0.05 0.12 -0.16 0.00 -0.04 0.00 0.00 63.50 63.47 2di9 n PRO 20 Cb 0.45 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.27 2di9 n PRO 20 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2di9 n TYR 21 N -1.24 0.41 -4.24 0.54 4.01 -1.26 -4.88 117.16 110.51 2di9 n TYR 21 Ca 0.08 -1.63 -0.30 0.00 -0.16 0.00 0.00 57.90 55.89 2di9 n TYR 21 Cb 0.11 -1.56 -0.09 0.00 -0.31 0.00 0.00 39.34 37.48 2di9 n TYR 21 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2di9 s THR 22 N 0.25 3.61 -0.31 -0.72 -4.23 -1.25 -5.02 115.64 107.97 2di9 s THR 22 Ca 0.65 -1.10 -0.01 0.00 -1.18 0.00 0.00 61.69 60.05 2di9 s THR 22 Cb 0.33 -2.68 0.23 0.00 1.34 0.00 0.00 72.50 71.73 2di9 s THR 22 CO -0.05 0.16 1.94 0.52 -0.54 0.00 0.00 174.62 176.65 2di9 n VAL 23 N 0.80 2.70 0.03 2.29 0.31 -1.26 -4.51 118.33 118.68 2di9 n VAL 23 Ca -0.13 -1.58 0.02 0.00 -0.01 0.00 0.00 64.34 62.64 2di9 n VAL 23 Cb 0.52 -1.26 0.09 0.00 -0.91 0.00 0.00 33.84 32.28 2di9 n VAL 23 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2di9 n GLU 24 N 0.25 0.02 -0.21 5.55 2.13 -1.26 -1.62 120.64 125.50 2di9 n GLU 24 Ca 0.30 0.50 -0.01 0.00 0.66 0.00 0.00 57.16 58.61 2di9 n GLU 24 Cb 0.64 -1.59 0.07 0.00 0.27 0.00 0.00 31.44 30.83 2di9 n GLU 24 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2di9 n ALA 25 N -1.52 2.92 -2.33 4.31 0.00 -1.26 -4.17 120.51 118.45 2di9 n ALA 25 Ca -0.00 -0.46 -0.31 0.00 0.00 0.00 0.00 53.44 52.66 2di9 n ALA 25 Cb 0.03 -1.05 0.01 0.00 0.00 0.00 0.00 19.45 18.44 2di9 n ALA 25 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2di9 n SER 26 N 0.14 5.62 -4.43 0.00 2.88 -0.64 -4.88 113.62 112.31 2di9 n SER 26 Ca 0.08 -3.75 -0.31 0.00 -1.33 0.00 0.00 58.87 53.56 2di9 n SER 26 Cb 0.56 -0.66 -0.13 0.00 -0.75 0.00 0.00 64.21 63.22 2di9 n SER 26 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2di9 s LEU 27 N -3.72 2.51 0.62 2.46 1.43 -1.26 -5.10 118.68 115.63 2di9 s LEU 27 Ca 0.49 -0.43 -0.16 0.00 -1.03 0.00 0.00 54.13 53.00 2di9 s LEU 27 Cb 0.40 -1.47 -0.02 0.00 0.03 0.00 0.00 46.19 45.13 2di9 s LEU 27 CO -0.26 0.27 1.12 -2.16 0.23 0.00 0.00 176.35 175.55 2di9 s PRO 28 N -1.27 3.00 -0.24 1.29 0.04 -1.26 -2.92 135.00 133.64 2di9 s PRO 28 Ca 0.13 1.46 -0.29 0.00 0.04 0.00 0.00 61.00 62.35 2di9 s PRO 28 Cb -0.10 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 2di9 s PRO 28 CO 0.04 -1.11 1.62 -1.25 0.04 0.00 0.00 177.00 176.34 2di9 s PRO 29 N -3.82 3.75 -0.50 0.56 0.04 -1.26 -3.71 135.00 130.06 2di9 s PRO 29 Ca 0.69 1.62 0.01 0.00 0.04 0.00 0.00 61.00 63.36 2di9 s PRO 29 Cb -0.22 -4.05 0.13 0.00 0.04 0.00 0.00 34.50 30.41 2di9 s PRO 29 CO 0.36 -1.34 0.27 -0.51 0.04 0.00 0.00 177.00 175.82 2di9 s ASP 30 N 4.36 4.82 0.34 6.66 1.11 0.37 -4.94 116.67 129.39 2di9 s ASP 30 Ca 0.72 -2.65 0.13 0.00 0.18 0.00 0.00 52.55 50.93 2di9 s ASP 30 Cb -0.24 -1.73 0.62 0.00 1.07 0.00 0.00 42.92 42.63 2di9 s ASP 30 CO 0.30 -0.35 1.75 1.55 1.18 0.00 0.00 175.17 179.59 2di9 h PRO 31 N 7.11 0.00 0.00 8.23 0.13 -1.88 -2.86 132.00 142.73 2di9 h PRO 31 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2di9 h PRO 31 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 2di9 h PRO 31 CO 0.67 0.45 0.08 1.03 -0.23 0.00 0.00 178.00 179.99 2di9 h SER 32 N 0.00 0.00 0.21 1.44 0.87 -1.94 0.10 113.55 114.23 2di9 h SER 32 Ca -0.00 0.00 -0.34 0.00 -1.23 0.00 0.00 61.79 60.22 2di9 h SER 32 Cb 0.83 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.73 2di9 h SER 32 CO 0.06 0.00 -2.10 0.29 -0.53 0.00 0.00 176.83 174.55 2di9 n LYS 33 N -2.48 0.67 -1.78 2.24 4.76 -1.08 -4.85 118.16 115.63 2di9 n LYS 33 Ca -0.02 0.13 -0.39 0.00 -2.87 0.00 0.00 58.31 55.16 2di9 n LYS 33 Cb 0.12 -1.64 -0.03 0.00 -1.84 0.00 0.00 35.03 31.64 2di9 n LYS 33 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2di9 s VAL 34 N -2.54 3.19 0.02 -0.18 1.01 0.02 -4.68 120.40 117.24 2di9 s VAL 34 Ca -0.08 0.14 0.06 0.00 0.00 0.00 0.00 61.98 62.10 2di9 s VAL 34 Cb 0.07 -3.40 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 2di9 s VAL 34 CO 0.82 -0.36 -0.18 -0.54 0.00 0.00 0.00 175.10 174.85 2di9 s LYS 35 N 7.25 2.18 -0.22 2.72 1.02 -1.10 -4.70 119.74 126.89 2di9 s LYS 35 Ca 0.86 -0.91 -0.02 0.00 0.02 0.00 0.00 55.97 55.92 2di9 s LYS 35 Cb -0.18 -2.22 0.01 0.00 -0.52 0.00 0.00 37.83 34.92 2di9 s LYS 35 CO 0.27 0.56 -0.09 0.00 -0.92 0.00 0.00 175.35 175.17 2di9 s ALA 36 N -0.86 2.64 -0.04 5.17 0.00 -1.26 -0.62 121.76 126.80 2di9 s ALA 36 Ca 0.14 -1.32 -0.01 0.00 0.00 0.00 0.00 51.96 50.77 2di9 s ALA 36 Cb -0.10 -1.57 0.03 0.00 0.00 0.00 0.00 23.12 21.47 2di9 s ALA 36 CO 0.04 -0.59 0.03 -3.38 0.00 0.00 0.00 175.76 171.85 2di9 s HIS 37 N 1.36 0.20 -3.52 0.00 -3.43 -0.33 -4.98 115.29 104.60 2di9 s HIS 37 Ca 0.03 0.10 0.00 0.00 -0.80 0.00 0.00 55.06 54.39 2di9 s HIS 37 Cb -0.15 -0.45 0.00 0.00 -1.43 0.00 0.00 32.58 30.55 2di9 s HIS 37 CO -0.06 -0.17 0.00 0.41 -2.00 0.00 0.00 174.74 172.92 2di9 n GLY 38 N 4.70 -1.87 0.16 -1.38 0.00 -1.26 -1.52 105.19 104.02 2di9 n GLY 38 Ca -0.16 -1.17 -0.13 0.00 0.00 0.00 0.00 46.02 44.56 2di9 n GLY 38 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2di9 h PRO 39 N 0.00 0.49 0.00 1.61 0.13 -1.91 -3.04 132.00 129.28 2di9 h PRO 39 Ca 0.00 -0.26 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2di9 h PRO 39 Cb 0.00 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.14 2di9 h PRO 39 CO 0.00 0.83 0.54 0.78 -0.23 0.00 0.00 178.00 179.92 2di9 h GLY 40 N 0.16 0.00 0.57 1.56 0.00 -0.19 0.30 103.07 105.47 2di9 h GLY 40 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 47.00 2di9 h GLY 40 CO 0.05 0.00 -1.96 1.04 0.00 0.00 0.00 176.54 175.67 2di9 n LEU 41 N -2.73 2.60 0.14 3.11 4.77 -1.15 -4.16 117.00 119.57 2di9 n LEU 41 Ca -0.01 0.22 -0.00 0.00 -0.03 0.00 0.00 56.01 56.18 2di9 n LEU 41 Cb 0.57 -1.11 0.24 0.00 -2.33 0.00 0.00 43.42 40.79 2di9 n LEU 41 CO 0.09 0.82 0.61 1.05 -1.33 0.00 0.00 177.39 178.63 2di9 h GLU 42 N 0.01 0.08 0.00 3.23 4.11 -0.51 -3.29 114.58 118.20 2di9 h GLU 42 Ca -0.42 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 58.97 2di9 h GLU 42 Cb 1.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.24 2di9 h GLU 42 CO 0.07 0.54 0.00 0.41 0.07 0.00 0.00 179.01 180.10 2di9 n GLY 43 N -0.10 1.01 0.00 1.06 0.00 0.21 -2.94 105.19 104.43 2di9 n GLY 43 Ca -0.02 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.01 2di9 n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2di9 n GLY 44 N -1.83 3.33 3.11 -0.02 0.00 -1.21 -4.37 105.19 104.20 2di9 n GLY 44 Ca 0.00 -0.20 -0.19 0.00 0.00 0.00 0.00 46.02 45.63 2di9 n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2di9 s LEU 45 N 0.00 2.13 0.29 0.99 1.43 -1.26 -1.77 118.68 120.49 2di9 s LEU 45 Ca 0.00 -0.38 -0.30 0.00 -1.03 0.00 0.00 54.13 52.42 2di9 s LEU 45 Cb 0.00 -0.55 -0.11 0.00 0.03 0.00 0.00 46.19 45.55 2di9 s LEU 45 CO 0.00 0.05 1.57 -0.69 0.23 0.00 0.00 176.35 177.51 2di9 s VAL 46 N -0.71 2.15 0.00 -1.59 1.01 -1.07 -1.60 120.40 118.59 2di9 s VAL 46 Ca 0.01 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.12 2di9 s VAL 46 Cb -0.07 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.23 2di9 s VAL 46 CO 0.01 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.74 2di9 n GLY 47 N 2.15 2.07 3.65 4.51 0.00 -1.25 -4.62 105.19 111.69 2di9 n GLY 47 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 2di9 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2di9 s LYS 48 N -0.16 2.44 0.60 1.61 1.02 -0.63 -5.00 119.74 119.62 2di9 s LYS 48 Ca 0.00 -0.87 -0.17 0.00 0.02 0.00 0.00 55.97 54.95 2di9 s LYS 48 Cb 0.00 -2.48 -0.03 0.00 -0.52 0.00 0.00 37.83 34.80 2di9 s LYS 48 CO 0.00 0.54 1.12 -1.25 -0.92 0.00 0.00 175.35 174.84 2di9 s PRO 49 N -2.15 3.11 -0.19 -1.68 0.04 -1.26 -4.41 135.00 128.46 2di9 s PRO 49 Ca 0.23 1.51 -0.06 0.00 0.04 0.00 0.00 61.00 62.72 2di9 s PRO 49 Cb -0.11 -1.98 0.09 0.00 0.04 0.00 0.00 34.50 32.53 2di9 s PRO 49 CO 0.15 -1.03 0.39 0.00 0.04 0.00 0.00 177.00 176.56 2di9 s ALA 50 N -2.03 -1.05 0.39 8.56 0.00 -0.87 -4.84 121.76 121.93 2di9 s ALA 50 Ca 0.70 1.37 0.04 0.00 0.00 0.00 0.00 51.96 54.07 2di9 s ALA 50 Cb -0.22 -1.30 -0.03 0.00 0.00 0.00 0.00 23.12 21.57 2di9 s ALA 50 CO 0.33 -0.77 0.15 -1.83 0.00 0.00 0.00 175.76 173.64 2di9 s GLU 51 N 2.58 1.89 0.31 0.00 4.04 -1.25 -0.75 118.70 125.51 2di9 s GLU 51 Ca -0.00 -2.14 -0.04 0.00 0.04 0.00 0.00 54.97 52.83 2di9 s GLU 51 Cb -0.12 -0.46 -0.00 0.00 0.02 0.00 0.00 34.13 33.56 2di9 s GLU 51 CO -0.12 -0.50 0.43 -0.59 -1.84 0.00 0.00 175.26 172.64 2di9 s PHE 52 N -3.26 0.98 -0.25 4.83 -0.71 -1.20 0.46 117.98 118.83 2di9 s PHE 52 Ca 0.27 -1.22 -0.07 0.00 -1.04 0.00 0.00 56.93 54.87 2di9 s PHE 52 Cb 0.03 -0.11 -0.02 0.00 -1.21 0.00 0.00 43.02 41.70 2di9 s PHE 52 CO 0.16 -1.05 0.06 0.99 -1.34 0.00 0.00 175.22 174.05 2di9 s THR 53 N -3.36 4.19 -0.15 -4.49 2.01 -0.58 -4.16 115.64 109.10 2di9 s THR 53 Ca 0.30 -0.26 -0.06 0.00 0.31 0.00 0.00 61.69 61.98 2di9 s THR 53 Cb 0.00 -2.98 -0.04 0.00 0.01 0.00 0.00 72.50 69.50 2di9 s THR 53 CO 0.18 0.32 0.05 -0.63 -0.69 0.00 0.00 174.62 173.84 2di9 s ILE 54 N 1.59 4.71 -0.46 1.82 1.01 -1.16 -1.19 121.20 127.53 2di9 s ILE 54 Ca 0.06 -0.07 -0.14 0.00 0.00 0.00 0.00 60.65 60.49 2di9 s ILE 54 Cb -0.15 -3.09 0.07 0.00 0.01 0.00 0.00 42.46 39.30 2di9 s ILE 54 CO 0.03 0.51 0.37 -0.62 0.00 0.00 0.00 174.94 175.23 2di9 s ASP 55 N -0.04 6.06 -0.20 3.58 2.15 0.21 -3.44 116.67 124.99 2di9 s ASP 55 Ca 0.06 -1.34 0.14 0.00 0.43 0.00 0.00 52.55 51.84 2di9 s ASP 55 Cb -0.12 -2.15 0.46 0.00 -0.30 0.00 0.00 42.92 40.81 2di9 s ASP 55 CO 0.01 -0.62 1.36 0.35 -0.17 0.00 0.00 175.17 176.09 2di9 n THR 56 N 5.16 2.27 -2.04 1.71 -2.24 -1.23 -2.71 114.28 115.20 2di9 n THR 56 Ca -0.12 -2.35 -0.42 0.00 -2.27 0.00 0.00 64.05 58.89 2di9 n THR 56 Cb 0.44 -0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 68.37 2di9 n THR 56 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2di9 s LYS 57 N -3.00 4.19 -0.62 -0.78 -0.14 -1.25 -2.06 119.74 116.08 2di9 s LYS 57 Ca 0.40 2.16 0.00 0.00 -1.36 0.00 0.00 55.97 57.17 2di9 s LYS 57 Cb 0.35 -3.91 0.00 0.00 -1.68 0.00 0.00 37.83 32.59 2di9 s LYS 57 CO 0.03 -0.81 0.00 0.41 -0.76 0.00 0.00 175.35 174.22 2di9 n GLY 58 N 4.06 0.78 0.08 -3.33 0.00 -1.26 -4.90 105.19 100.61 2di9 n GLY 58 Ca 0.17 -0.31 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 2di9 n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2di9 h ALA 59 N 0.00 -0.05 0.00 4.61 0.00 -1.68 -3.45 119.26 118.70 2di9 h ALA 59 Ca -0.12 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2di9 h ALA 59 Cb 0.60 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2di9 h ALA 59 CO 0.18 -0.13 0.00 0.41 0.00 0.00 0.00 179.25 179.71 2di9 n GLY 60 N 1.06 0.82 2.78 0.00 0.00 -1.24 0.14 105.19 108.74 2di9 n GLY 60 Ca -0.08 -1.84 -0.19 0.00 0.00 0.00 0.00 46.02 43.90 2di9 n GLY 60 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2di9 s THR 61 N -2.84 0.17 0.00 2.61 2.01 -1.15 -4.92 115.64 111.52 2di9 s THR 61 Ca 0.00 0.16 0.00 0.00 0.31 0.00 0.00 61.69 62.16 2di9 s THR 61 Cb 0.00 -0.31 0.00 0.00 0.01 0.00 0.00 72.50 72.20 2di9 s THR 61 CO 0.00 0.18 0.00 0.61 -0.69 0.00 0.00 174.62 174.72 2di9 n GLY 62 N 4.61 1.83 2.94 4.40 0.00 -1.26 -4.54 105.19 113.17 2di9 n GLY 62 Ca -0.17 0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.63 2di9 n GLY 62 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2di9 s GLY 63 N 0.00 0.78 -0.15 -0.02 0.00 -1.26 -5.00 107.32 101.68 2di9 s GLY 63 Ca 0.00 -0.46 -0.07 0.00 0.00 0.00 0.00 44.72 44.18 2di9 s GLY 63 CO 0.00 0.56 0.11 -2.27 0.00 0.00 0.00 173.10 171.51 2di9 s LEU 64 N 1.32 4.19 -0.29 0.66 2.96 -1.26 0.09 118.68 126.35 2di9 s LEU 64 Ca -0.03 0.32 -0.02 0.00 -0.22 0.00 0.00 54.13 54.19 2di9 s LEU 64 Cb -0.14 -2.04 0.04 0.00 0.50 0.00 0.00 46.19 44.56 2di9 s LEU 64 CO -0.04 0.31 -0.01 -0.83 -1.32 0.00 0.00 176.35 174.47 2di9 s GLY 65 N -0.45 1.73 -0.30 7.98 0.00 -0.24 -4.99 107.32 111.05 2di9 s GLY 65 Ca 0.11 -1.68 -0.08 0.00 0.00 0.00 0.00 44.72 43.07 2di9 s GLY 65 CO 0.02 0.66 0.10 -2.27 0.00 0.00 0.00 173.10 171.61 2di9 s LEU 66 N 1.28 3.97 -0.07 0.66 2.96 -1.25 -3.02 118.68 123.21 2di9 s LEU 66 Ca -0.04 -0.70 0.01 0.00 -0.22 0.00 0.00 54.13 53.18 2di9 s LEU 66 Cb -0.19 -1.91 0.02 0.00 0.50 0.00 0.00 46.19 44.61 2di9 s LEU 66 CO -0.01 -0.21 -0.08 0.42 -1.32 0.00 0.00 176.35 175.14 2di9 s THR 67 N 1.52 0.90 -0.47 3.68 -4.23 -1.06 -4.95 115.64 111.04 2di9 s THR 67 Ca 0.03 -0.30 -0.22 0.00 -1.18 0.00 0.00 61.69 60.02 2di9 s THR 67 Cb -0.17 -0.88 0.03 0.00 1.34 0.00 0.00 72.50 72.81 2di9 s THR 67 CO 0.03 0.32 0.75 -0.69 -0.54 0.00 0.00 174.62 174.50 2di9 s VAL 68 N 1.08 4.68 -1.10 2.29 1.01 -1.26 -0.45 120.40 126.65 2di9 s VAL 68 Ca -0.07 0.22 -0.06 0.00 0.00 0.00 0.00 61.98 62.07 2di9 s VAL 68 Cb -0.14 -4.32 0.30 0.00 0.00 0.00 0.00 36.38 32.21 2di9 s VAL 68 CO -0.01 -0.76 1.39 -0.62 0.00 0.00 0.00 175.10 175.10 2di9 n GLU 69 N 6.65 4.19 -0.07 2.72 -0.58 0.69 -4.74 120.64 129.51 2di9 n GLU 69 Ca 0.00 -4.50 0.00 0.00 -0.42 0.00 0.00 57.16 52.25 2di9 n GLU 69 Cb 0.48 -2.54 0.00 0.00 -0.57 0.00 0.00 31.44 28.81 2di9 n GLU 69 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2di9 n GLY 70 N 1.77 6.05 0.00 0.62 0.00 -1.26 -3.59 105.19 108.79 2di9 n GLY 70 Ca 0.26 -2.04 0.07 0.00 0.00 0.00 0.00 46.02 44.31 2di9 n GLY 70 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2di9 n PRO 71 N -0.01 0.08 -3.50 1.61 -0.04 -1.26 -4.78 135.00 127.10 2di9 n PRO 71 Ca 0.00 0.21 -0.12 0.00 -0.04 0.00 0.00 63.50 63.55 2di9 n PRO 71 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 2di9 n PRO 71 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2di9 s GLU 73 N -2.42 3.62 -0.11 0.00 2.12 -1.26 -4.93 118.70 115.72 2di9 s GLU 73 Ca -0.01 0.86 -0.04 0.00 0.36 0.00 0.00 54.97 56.14 2di9 s GLU 73 Cb -0.01 -3.99 -0.04 0.00 0.26 0.00 0.00 34.13 30.36 2di9 s GLU 73 CO -0.03 -1.50 0.06 0.00 -0.54 0.00 0.00 175.26 173.24 2di9 s ALA 74 N 5.16 3.50 0.50 6.30 0.00 -1.26 -4.96 121.76 131.00 2di9 s ALA 74 Ca 0.58 -0.74 -0.23 0.00 0.00 0.00 0.00 51.96 51.56 2di9 s ALA 74 Cb -0.12 -1.71 -0.07 0.00 0.00 0.00 0.00 23.12 21.22 2di9 s ALA 74 CO 0.32 0.53 1.39 1.17 0.00 0.00 0.00 175.76 179.17 2di9 n LYS 75 N 2.32 1.96 -3.78 0.00 4.81 -1.24 -4.83 118.16 117.40 2di9 n LYS 75 Ca -0.19 0.71 -0.26 0.00 -0.87 0.00 0.00 58.31 57.70 2di9 n LYS 75 Cb 0.54 -2.60 -0.17 0.00 0.02 0.00 0.00 35.03 32.82 2di9 n LYS 75 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2di9 s ILE 76 N -1.24 0.59 -0.49 3.15 1.01 -1.26 -2.18 121.20 120.77 2di9 s ILE 76 Ca 0.66 -0.29 -0.16 0.00 0.00 0.00 0.00 60.65 60.86 2di9 s ILE 76 Cb -0.43 -0.88 0.09 0.00 0.01 0.00 0.00 42.46 41.24 2di9 s ILE 76 CO 0.53 0.06 0.44 -0.70 0.00 0.00 0.00 174.94 175.27 2di9 s GLU 77 N 1.86 2.99 -0.21 2.79 -6.30 0.25 -4.98 118.70 115.10 2di9 s GLU 77 Ca 0.02 -1.43 -0.22 0.00 -2.50 0.00 0.00 54.97 50.85 2di9 s GLU 77 Cb -0.15 -4.18 -0.02 0.00 0.00 0.00 0.00 34.13 29.78 2di9 s GLU 77 CO -0.07 -1.13 0.67 0.00 0.02 0.00 0.00 175.26 174.75 2di9 s SER 79 N 1.27 0.60 0.15 0.00 0.15 -1.23 -5.03 113.70 109.61 2di9 s SER 79 Ca 0.30 -0.35 0.04 0.00 0.70 0.00 0.00 55.95 56.63 2di9 s SER 79 Cb -0.16 0.01 -0.04 0.00 -1.71 0.00 0.00 66.02 64.13 2di9 s SER 79 CO 0.10 -0.12 0.18 -1.81 1.20 0.00 0.00 173.24 172.79 2di9 s ASP 80 N -0.97 5.83 -0.19 5.45 1.11 -1.26 -1.39 116.67 125.25 2di9 s ASP 80 Ca -0.06 -0.00 -0.18 0.00 0.18 0.00 0.00 52.55 52.49 2di9 s ASP 80 Cb -0.07 -1.62 -0.21 0.00 1.07 0.00 0.00 42.92 42.09 2di9 s ASP 80 CO -0.00 0.07 0.24 0.59 1.18 0.00 0.00 175.17 177.26 2di9 n ASN 81 N -0.33 1.93 0.00 0.27 3.02 -0.74 -4.87 115.26 114.54 2di9 n ASN 81 Ca -0.08 0.37 0.00 0.00 -0.03 0.00 0.00 54.58 54.84 2di9 n ASN 81 Cb 0.54 -0.94 0.00 0.00 -0.61 0.00 0.00 39.78 38.77 2di9 n ASN 81 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2di9 n GLY 82 N 1.57 1.85 0.02 7.41 0.00 -1.26 -4.91 105.19 109.87 2di9 n GLY 82 Ca -0.33 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.80 2di9 n GLY 82 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2di9 n ASP 83 N 0.00 0.60 0.00 1.61 2.03 -1.26 -4.92 116.55 114.61 2di9 n ASP 83 Ca 0.00 -0.35 0.00 0.00 0.52 0.00 0.00 54.79 54.96 2di9 n ASP 83 Cb 0.00 1.01 0.00 0.00 -0.72 0.00 0.00 41.12 41.41 2di9 n ASP 83 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2di9 n GLY 84 N 1.38 1.00 3.31 0.27 0.00 -1.26 -5.07 105.19 104.82 2di9 n GLY 84 Ca 0.02 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 2di9 n GLY 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2di9 s THR 85 N -1.14 0.78 -0.02 2.61 -4.23 -1.26 -3.48 115.64 108.89 2di9 s THR 85 Ca 0.00 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.53 2di9 s THR 85 Cb 0.00 -2.41 0.00 0.00 1.34 0.00 0.00 72.50 71.43 2di9 s THR 85 CO 0.00 -0.23 -0.08 0.00 -0.54 0.00 0.00 174.62 173.76 2di9 s SER 87 N 0.13 4.55 -0.15 0.00 0.15 -0.49 -2.98 113.70 114.91 2di9 s SER 87 Ca -0.02 -2.76 -0.15 0.00 0.70 0.00 0.00 55.95 53.72 2di9 s SER 87 Cb -0.07 -1.67 -0.04 0.00 -1.71 0.00 0.00 66.02 62.53 2di9 s SER 87 CO 0.00 -0.29 0.36 -0.69 1.20 0.00 0.00 173.24 173.82 2di9 s VAL 88 N 0.06 5.26 -0.10 4.45 1.01 -1.26 -3.55 120.40 126.28 2di9 s VAL 88 Ca 0.15 0.68 0.03 0.00 0.00 0.00 0.00 61.98 62.85 2di9 s VAL 88 Cb -0.24 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 2di9 s VAL 88 CO -0.02 0.35 -0.21 -0.94 0.00 0.00 0.00 175.10 174.27 2di9 s SER 89 N 0.59 3.32 0.05 3.32 1.04 -0.83 -3.26 113.70 117.94 2di9 s SER 89 Ca 0.19 -0.49 0.08 0.00 0.48 0.00 0.00 55.95 56.22 2di9 s SER 89 Cb -0.14 -1.33 -0.03 0.00 0.10 0.00 0.00 66.02 64.63 2di9 s SER 89 CO 0.06 0.18 -0.23 -0.72 0.98 0.00 0.00 173.24 173.52 2di9 s TYR 90 N 0.21 1.97 -0.29 5.02 -0.85 0.07 -0.58 117.35 122.91 2di9 s TYR 90 Ca -0.13 -0.39 -0.01 0.00 -0.52 0.00 0.00 57.07 56.02 2di9 s TYR 90 Cb -0.16 -1.16 0.05 0.00 0.38 0.00 0.00 41.96 41.06 2di9 s TYR 90 CO 0.07 0.12 -0.03 -0.51 -1.52 0.00 0.00 175.55 173.68 2di9 s LEU 91 N -1.30 3.73 1.14 -3.49 1.43 -0.92 -2.04 118.68 117.22 2di9 s LEU 91 Ca 0.09 -1.26 -0.17 0.00 -1.03 0.00 0.00 54.13 51.76 2di9 s LEU 91 Cb -0.09 -1.67 0.26 0.00 0.03 0.00 0.00 46.19 44.71 2di9 s LEU 91 CO 0.02 -0.23 1.10 -2.16 0.23 0.00 0.00 176.35 175.32 2di9 s PRO 92 N 1.23 -0.69 0.00 1.29 0.04 -1.26 -3.65 135.00 131.96 2di9 s PRO 92 Ca -0.05 0.12 0.00 0.00 0.04 0.00 0.00 61.00 61.11 2di9 s PRO 92 Cb -0.19 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.70 2di9 s PRO 92 CO -0.02 -3.40 0.00 0.25 0.04 0.00 0.00 177.00 173.87 2di9 n THR 93 N -4.57 0.00 -4.16 1.26 -2.24 -1.26 -3.93 114.28 99.38 2di9 n THR 93 Ca 0.10 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.73 2di9 n THR 93 Cb 0.59 -0.31 -0.11 0.00 -2.10 0.00 0.00 70.33 68.39 2di9 n THR 93 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2di9 s LYS 94 N -1.60 0.78 0.14 -0.78 1.02 -1.26 -4.80 119.74 113.24 2di9 s LYS 94 Ca 0.00 -1.03 -0.31 0.00 0.02 0.00 0.00 55.97 54.66 2di9 s LYS 94 Cb 0.00 -0.58 -0.08 0.00 -0.52 0.00 0.00 37.83 36.65 2di9 s LYS 94 CO 0.00 0.11 1.34 -1.25 -0.92 0.00 0.00 175.35 174.63 2di9 s PRO 95 N -2.26 4.35 0.00 -1.68 0.04 -1.26 -4.80 135.00 129.39 2di9 s PRO 95 Ca 0.01 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2di9 s PRO 95 Cb -0.06 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.24 2di9 s PRO 95 CO 0.01 -0.36 0.00 0.41 0.04 0.00 0.00 177.00 177.10 2di9 n GLY 96 N 3.11 -0.43 3.33 0.56 0.00 -1.17 -5.02 105.19 105.56 2di9 n GLY 96 Ca 0.09 0.46 -0.04 0.00 0.00 0.00 0.00 46.02 46.54 2di9 n GLY 96 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2di9 s GLU 97 N 0.00 0.45 -0.19 1.61 -1.05 -1.26 -2.17 118.70 116.09 2di9 s GLU 97 Ca 0.00 1.10 -0.09 0.00 -0.15 0.00 0.00 54.97 55.83 2di9 s GLU 97 Cb 0.00 0.44 -0.05 0.00 -0.44 0.00 0.00 34.13 34.08 2di9 s GLU 97 CO 0.00 -0.35 0.11 0.71 0.95 0.00 0.00 175.26 176.68 2di9 s TYR 98 N 2.74 3.38 -0.40 4.83 1.51 -1.07 -4.29 117.35 124.04 2di9 s TYR 98 Ca 0.03 0.27 -0.15 0.00 -1.01 0.00 0.00 57.07 56.21 2di9 s TYR 98 Cb -0.13 -2.13 0.02 0.00 -0.11 0.00 0.00 41.96 39.61 2di9 s TYR 98 CO -0.17 0.28 0.33 -0.06 -1.11 0.00 0.00 175.55 174.82 2di9 s PHE 99 N 0.29 3.22 -0.50 2.71 0.40 -1.24 -1.49 117.98 121.37 2di9 s PHE 99 Ca 0.07 -0.47 -0.25 0.00 -0.60 0.00 0.00 56.93 55.68 2di9 s PHE 99 Cb -0.11 -2.66 0.03 0.00 0.51 0.00 0.00 43.02 40.79 2di9 s PHE 99 CO -0.01 -0.59 0.95 0.08 0.70 0.00 0.00 175.22 176.35 2di9 s VAL 100 N 1.81 4.41 -0.57 -0.44 1.01 -1.21 -0.22 120.40 125.20 2di9 s VAL 100 Ca 0.07 0.59 -0.27 0.00 0.00 0.00 0.00 61.98 62.37 2di9 s VAL 100 Cb -0.18 -4.49 0.03 0.00 0.00 0.00 0.00 36.38 31.74 2di9 s VAL 100 CO 0.11 -0.97 1.11 0.20 0.00 0.00 0.00 175.10 175.55 2di9 s ASN 101 N 2.52 6.42 -0.37 3.32 0.01 0.40 -2.37 114.94 124.87 2di9 s ASN 101 Ca 0.35 -0.01 -0.10 0.00 -0.71 0.00 0.00 52.86 52.39 2di9 s ASN 101 Cb -0.11 -2.52 0.03 0.00 0.41 0.00 0.00 41.25 39.07 2di9 s ASN 101 CO 0.24 -1.39 0.18 -0.63 -1.51 0.00 0.00 177.10 173.99 2di9 s ILE 102 N 4.63 4.35 -0.04 0.60 1.01 -1.26 -2.56 121.20 127.92 2di9 s ILE 102 Ca 0.39 -0.96 0.02 0.00 0.00 0.00 0.00 60.65 60.10 2di9 s ILE 102 Cb -0.09 -3.45 0.01 0.00 0.01 0.00 0.00 42.46 38.95 2di9 s ILE 102 CO 0.24 -0.23 -0.07 -1.48 0.00 0.00 0.00 174.94 173.39 2di9 s LEU 103 N 1.51 1.54 -0.32 2.97 0.05 -1.17 -1.56 118.68 121.70 2di9 s LEU 103 Ca 0.01 -0.17 -0.10 0.00 0.05 0.00 0.00 54.13 53.92 2di9 s LEU 103 Cb -0.19 -0.53 -0.00 0.00 -2.05 0.00 0.00 46.19 43.41 2di9 s LEU 103 CO 0.05 -0.00 0.16 0.12 -0.55 0.00 0.00 176.35 176.14 2di9 s PHE 104 N 0.63 3.19 -1.36 3.48 5.36 0.17 -1.08 117.98 128.37 2di9 s PHE 104 Ca -0.10 -0.61 -0.08 0.00 -0.96 0.00 0.00 56.93 55.18 2di9 s PHE 104 Cb -0.13 -2.37 0.02 0.00 -0.34 0.00 0.00 43.02 40.20 2di9 s PHE 104 CO 0.01 -0.48 1.12 0.39 -1.46 0.00 0.00 175.22 174.80 2di9 n GLU 105 N 4.99 -7.39 -2.12 10.12 -0.58 0.11 -1.70 120.64 124.07 2di9 n GLU 105 Ca -0.13 0.79 -0.07 0.00 -0.42 0.00 0.00 57.16 57.33 2di9 n GLU 105 Cb 0.49 -5.81 -0.00 0.00 -0.57 0.00 0.00 31.44 25.54 2di9 n GLU 105 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2di9 n GLU 106 N -4.83 -0.59 -3.85 3.49 1.02 -1.26 -5.02 120.64 109.59 2di9 n GLU 106 Ca -0.04 0.36 -0.27 0.00 -0.02 0.00 0.00 57.16 57.19 2di9 n GLU 106 Cb 0.57 -4.27 -0.17 0.00 -0.02 0.00 0.00 31.44 27.56 2di9 n GLU 106 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2di9 s VAL 107 N -2.37 0.94 -0.07 2.62 1.01 -0.69 -5.10 120.40 116.74 2di9 s VAL 107 Ca 0.00 -0.53 -0.30 0.00 0.00 0.00 0.00 61.98 61.15 2di9 s VAL 107 Cb 0.00 -1.16 -0.06 0.00 0.00 0.00 0.00 36.38 35.16 2di9 s VAL 107 CO 0.00 0.10 1.76 -1.00 0.00 0.00 0.00 175.10 175.96 2di9 s HIS 108 N 1.70 1.77 0.62 5.22 3.76 -1.26 0.45 115.29 127.55 2di9 s HIS 108 Ca 0.01 0.12 -0.17 0.00 -0.15 0.00 0.00 55.06 54.86 2di9 s HIS 108 Cb -0.15 -4.01 -0.02 0.00 1.11 0.00 0.00 32.58 29.51 2di9 s HIS 108 CO -0.07 -4.14 1.16 0.96 -0.85 0.00 0.00 174.74 171.80 2di9 s ILE 109 N 4.65 2.88 -1.04 0.60 -4.36 -0.60 -4.89 121.20 118.43 2di9 s ILE 109 Ca 0.79 0.49 -0.24 0.00 -0.26 0.00 0.00 60.65 61.43 2di9 s ILE 109 Cb -0.34 -3.11 -0.07 0.00 1.25 0.00 0.00 42.46 40.19 2di9 s ILE 109 CO 0.33 -0.17 1.94 -2.16 0.24 0.00 0.00 174.94 175.12 2di9 s PRO 110 N -3.60 2.53 0.00 0.37 0.04 -1.26 -2.36 135.00 130.72 2di9 s PRO 110 Ca 0.73 -0.72 0.00 0.00 0.04 0.00 0.00 61.00 61.05 2di9 s PRO 110 Cb -0.26 -5.15 0.00 0.00 0.04 0.00 0.00 34.50 29.13 2di9 s PRO 110 CO 0.35 -3.68 0.00 0.41 0.04 0.00 0.00 177.00 174.13 2di9 n GLY 111 N 6.34 0.25 3.82 0.56 0.00 -1.26 -5.00 105.19 109.89 2di9 n GLY 111 Ca 0.42 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.18 2di9 n GLY 111 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2di9 s SER 112 N 0.00 5.64 1.09 1.61 1.04 -0.99 -4.22 113.70 117.86 2di9 s SER 112 Ca 0.00 -0.09 -0.15 0.00 0.48 0.00 0.00 55.95 56.19 2di9 s SER 112 Cb 0.00 -1.51 0.23 0.00 0.10 0.00 0.00 66.02 64.84 2di9 s SER 112 CO 0.00 0.06 1.10 -2.16 0.98 0.00 0.00 173.24 173.22 2di9 s PRO 113 N -3.15 -0.28 -0.38 4.02 0.04 -1.26 -4.85 135.00 129.14 2di9 s PRO 113 Ca 0.32 0.27 0.04 0.00 0.04 0.00 0.00 61.00 61.66 2di9 s PRO 113 Cb -0.10 -1.68 0.11 0.00 0.04 0.00 0.00 34.50 32.87 2di9 s PRO 113 CO 0.24 -3.15 0.10 -0.06 0.04 0.00 0.00 177.00 174.17 2di9 s PHE 114 N -2.98 3.60 0.02 0.56 0.40 -1.00 -4.86 117.98 113.72 2di9 s PHE 114 Ca 0.68 -3.03 -0.30 0.00 -0.60 0.00 0.00 56.93 53.67 2di9 s PHE 114 Cb -0.15 -2.89 -0.08 0.00 0.51 0.00 0.00 43.02 40.41 2di9 s PHE 114 CO 0.57 -0.90 1.93 0.21 0.70 0.00 0.00 175.22 177.73 2di9 s LYS 115 N 0.63 4.13 -0.31 0.44 2.20 -1.26 -3.33 119.74 122.23 2di9 s LYS 115 Ca 0.12 2.54 -0.03 0.00 -0.36 0.00 0.00 55.97 58.25 2di9 s LYS 115 Cb -0.21 -4.14 0.05 0.00 -1.51 0.00 0.00 37.83 32.02 2di9 s LYS 115 CO -0.06 -0.97 0.03 0.00 -0.36 0.00 0.00 175.35 173.99 2di9 s ALA 116 N 4.49 2.87 -0.30 3.13 0.00 -0.56 -4.73 121.76 126.66 2di9 s ALA 116 Ca 0.87 -1.78 -0.29 0.00 0.00 0.00 0.00 51.96 50.76 2di9 s ALA 116 Cb -0.41 -2.02 -0.01 0.00 0.00 0.00 0.00 23.12 20.68 2di9 s ALA 116 CO 0.40 -1.30 1.57 0.34 0.00 0.00 0.00 175.76 176.76 2di9 s ASP 117 N 1.30 6.30 -0.19 0.00 2.15 -1.15 -2.61 116.67 122.47 2di9 s ASP 117 Ca -0.04 1.31 -0.12 0.00 0.43 0.00 0.00 52.55 54.13 2di9 s ASP 117 Cb -0.20 -2.53 -0.05 0.00 -0.30 0.00 0.00 42.92 39.84 2di9 s ASP 117 CO -0.00 -1.38 0.20 -0.63 -0.17 0.00 0.00 175.17 173.19 2di9 s ILE 118 N 5.53 5.36 0.27 4.11 -1.09 -0.92 -3.29 121.20 131.16 2di9 s ILE 118 Ca 0.69 0.34 0.08 0.00 -2.23 0.00 0.00 60.65 59.53 2di9 s ILE 118 Cb -0.21 -3.54 -0.04 0.00 -1.58 0.00 0.00 42.46 37.09 2di9 s ILE 118 CO 0.30 0.40 0.13 -1.61 -1.23 0.00 0.00 174.94 172.93 2di9 s GLU 119 N 0.50 2.66 0.22 2.79 2.02 -0.73 -3.06 118.70 123.11 2di9 s GLU 119 Ca 0.12 -1.22 -0.30 0.00 0.02 0.00 0.00 54.97 53.59 2di9 s GLU 119 Cb -0.12 -2.40 -0.09 0.00 0.10 0.00 0.00 34.13 31.63 2di9 s GLU 119 CO 0.01 0.36 1.10 -1.64 0.02 0.00 0.00 175.26 175.11 2di9 s MET 120 N -3.79 4.61 0.90 1.61 -1.94 -1.26 -2.61 119.30 116.81 2di9 s MET 120 Ca 0.33 1.76 -0.12 0.00 -1.71 0.00 0.00 55.69 55.95 2di9 s MET 120 Cb -0.07 -3.24 0.13 0.00 2.01 0.00 0.00 34.83 33.66 2di9 s MET 120 CO 0.23 0.14 1.09 -1.25 -0.01 0.00 0.00 175.02 175.22 2di9 s PRO 121 N -0.83 1.26 -0.12 2.03 0.04 -1.26 -4.89 135.00 131.22 2di9 s PRO 121 Ca 0.47 0.82 -0.08 0.00 0.04 0.00 0.00 61.00 62.25 2di9 s PRO 121 Cb -0.31 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 2di9 s PRO 121 CO 0.37 -2.24 0.17 0.12 0.04 0.00 0.00 177.00 175.46 2di9 s PHE 122 N -2.94 3.58 -0.10 0.56 5.36 -1.26 -5.06 117.98 118.13 2di9 s PHE 122 Ca 0.63 0.55 -0.05 0.00 -0.96 0.00 0.00 56.93 57.11 2di9 s PHE 122 Cb -0.18 -2.02 -0.04 0.00 -0.34 0.00 0.00 43.02 40.44 2di9 s PHE 122 CO 0.57 0.65 0.10 0.34 -1.46 0.00 0.00 175.22 175.42 2di9 s ASP 123 N -0.79 6.02 0.00 6.13 2.15 -1.26 -4.98 116.67 123.94 2di9 s ASP 123 Ca 0.15 0.35 0.15 0.00 0.43 0.00 0.00 52.55 53.63 2di9 s ASP 123 Cb -0.12 -1.87 0.73 0.00 -0.30 0.00 0.00 42.92 41.36 2di9 s ASP 123 CO 0.04 0.39 1.41 -0.81 -0.17 0.00 0.00 175.17 176.03 2di9 n PRO 124 N 1.93 0.19 -2.56 4.34 -0.04 -1.26 -4.69 135.00 132.90 2di9 n PRO 124 Ca -0.19 0.16 -0.43 0.00 -0.04 0.00 0.00 63.50 63.00 2di9 n PRO 124 Cb 0.54 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.48 2di9 n PRO 124 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2di9 s SER 125 N -2.62 6.92 -0.10 3.54 0.15 -1.26 -5.00 113.70 115.33 2di9 s SER 125 Ca 0.13 1.27 -0.15 0.00 0.70 0.00 0.00 55.95 57.91 2di9 s SER 125 Cb 0.10 -2.54 0.03 0.00 -1.71 0.00 0.00 66.02 61.90 2di9 s SER 125 CO 0.23 -0.85 0.37 -0.94 1.20 0.00 0.00 173.24 173.25 2di9 s SER 126 N 1.85 -0.34 0.32 5.45 1.04 -1.26 -5.18 113.70 115.58 2di9 s SER 126 Ca 0.49 0.54 0.00 0.00 0.48 0.00 0.00 55.95 57.46 2di9 s SER 126 Cb -0.15 0.62 -0.00 0.00 0.10 0.00 0.00 66.02 66.58 2di9 s SER 126 CO 0.15 -0.26 0.01 0.61 0.98 0.00 0.00 173.24 174.72 2di9 n GLY 127 N 2.24 3.78 0.07 7.32 0.00 -1.26 -5.02 105.19 112.31 2di9 n GLY 127 Ca -0.16 -2.30 0.09 0.00 0.00 0.00 0.00 46.02 43.65 2di9 n GLY 127 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2di9 n PRO 128 N -0.80 0.10 -1.87 1.61 -0.04 -1.26 -4.80 135.00 127.94 2di9 n PRO 128 Ca -0.13 0.35 -0.35 0.00 -0.04 0.00 0.00 63.50 63.32 2di9 n PRO 128 Cb 0.41 -1.69 0.05 0.00 -0.04 0.00 0.00 33.50 32.23 2di9 n PRO 128 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2di9 s SER 129 N -3.64 5.00 -0.17 3.54 0.01 -1.26 -4.99 113.70 112.19 2di9 s SER 129 Ca 0.05 2.32 -0.18 0.00 1.31 0.00 0.00 55.95 59.45 2di9 s SER 129 Cb 0.09 -2.59 -0.15 0.00 0.21 0.00 0.00 66.02 63.58 2di9 s SER 129 CO 0.32 -1.72 0.23 0.28 0.41 0.00 0.00 173.24 172.77 2di9 h SER 130 N 0.53 0.00 0.00 2.44 0.02 -2.06 -3.53 113.55 110.95 2di9 h SER 130 Ca -0.49 -0.46 0.00 0.00 -0.84 0.00 0.00 61.79 60.00 2di9 h SER 130 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2di9 h SER 130 CO 0.54 1.13 0.00 0.61 -1.14 0.00 0.00 176.83 177.97