#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 1.55 0.32 1.61 1.04 -1.26 -5.18 113.70 111.78 2di9 s SER 2 Ca 0.00 -1.52 -0.12 0.00 0.48 0.00 0.00 55.95 54.79 2di9 s SER 2 Cb 0.00 0.34 0.02 0.00 0.10 0.00 0.00 66.02 66.47 2di9 s SER 2 CO 0.00 -0.85 0.60 -0.94 0.98 0.00 0.00 173.24 173.03 2di9 s SER 3 N -3.38 0.21 0.00 7.02 1.04 -1.26 -5.19 113.70 112.15 2di9 s SER 3 Ca 0.35 -1.11 0.00 0.00 0.48 0.00 0.00 55.95 55.67 2di9 s SER 3 Cb 0.05 0.70 0.00 0.00 0.10 0.00 0.00 66.02 66.88 2di9 s SER 3 CO 0.16 -1.37 0.00 0.61 0.98 0.00 0.00 173.24 173.62 2di9 n GLY 4 N -0.49 5.12 3.61 7.32 0.00 -1.26 -5.18 105.19 114.32 2di9 n GLY 4 Ca -0.03 -1.76 -0.11 0.00 0.00 0.00 0.00 46.02 44.11 2di9 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2di9 s SER 5 N 1.00 -0.52 0.18 1.61 0.01 -1.26 -5.18 113.70 109.53 2di9 s SER 5 Ca 0.00 0.89 -0.19 0.00 1.31 0.00 0.00 55.95 57.96 2di9 s SER 5 Cb 0.00 0.86 0.04 0.00 0.21 0.00 0.00 66.02 67.13 2di9 s SER 5 CO 0.00 -0.26 0.54 -0.94 0.41 0.00 0.00 173.24 172.99 2di9 s SER 6 N -0.15 -0.35 0.00 2.44 1.04 -1.26 -5.18 113.70 110.24 2di9 s SER 6 Ca 0.00 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.12 2di9 s SER 6 Cb -0.04 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.66 2di9 s SER 6 CO -0.01 -1.02 0.00 0.61 0.98 0.00 0.00 173.24 173.80 2di9 n GLY 7 N -0.34 1.53 3.28 7.32 0.00 -1.26 -5.13 105.19 110.58 2di9 n GLY 7 Ca -0.13 -1.77 -0.11 0.00 0.00 0.00 0.00 46.02 44.02 2di9 n GLY 7 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2di9 s ASP 8 N -1.00 -0.52 0.26 1.61 -4.77 -1.26 -5.16 116.67 105.83 2di9 s ASP 8 Ca 0.00 0.90 -0.13 0.00 -3.30 0.00 0.00 52.55 50.02 2di9 s ASP 8 Cb 0.00 0.79 -0.08 0.00 -1.09 0.00 0.00 42.92 42.54 2di9 s ASP 8 CO 0.00 -0.19 0.64 0.68 0.70 0.00 0.00 175.17 177.00 2di9 s VAL 9 N 1.32 4.80 0.06 2.11 -7.23 -1.26 -5.09 120.40 115.11 2di9 s VAL 9 Ca -0.09 0.75 0.08 0.00 -1.81 0.00 0.00 61.98 60.92 2di9 s VAL 9 Cb -0.08 -3.64 -0.03 0.00 0.56 0.00 0.00 36.38 33.19 2di9 s VAL 9 CO -0.12 -0.07 -0.22 0.42 -0.31 0.00 0.00 175.10 174.81 2di9 s THR 10 N -1.83 2.54 0.15 5.32 -4.23 -1.26 -5.14 115.64 111.19 2di9 s THR 10 Ca 0.49 -1.34 0.00 0.00 -1.18 0.00 0.00 61.69 59.66 2di9 s THR 10 Cb -0.11 -2.06 -0.04 0.00 1.34 0.00 0.00 72.50 71.62 2di9 s THR 10 CO 0.19 0.30 0.03 -0.72 -0.54 0.00 0.00 174.62 173.88 2di9 s TYR 11 N -0.92 1.00 -0.05 3.99 -0.85 -1.26 -5.16 117.35 114.09 2di9 s TYR 11 Ca 0.14 -1.15 -0.02 0.00 -0.52 0.00 0.00 57.07 55.52 2di9 s TYR 11 Cb -0.10 -0.57 0.04 0.00 0.38 0.00 0.00 41.96 41.70 2di9 s TYR 11 CO 0.05 -0.39 0.10 -0.51 -1.52 0.00 0.00 175.55 173.27 2di9 s ASP 12 N -3.10 0.45 0.32 -0.18 1.01 -1.26 -5.15 116.67 108.76 2di9 s ASP 12 Ca 0.24 0.18 0.06 0.00 0.71 0.00 0.00 52.55 53.74 2di9 s ASP 12 Cb 0.07 0.05 -0.03 0.00 1.01 0.00 0.00 42.92 44.02 2di9 s ASP 12 CO 0.03 -0.19 0.27 -0.83 0.21 0.00 0.00 175.17 174.65 2di9 s GLY 13 N 1.66 2.22 0.02 0.21 0.00 -1.26 -5.17 107.32 104.99 2di9 s GLY 13 Ca -0.03 -2.03 0.03 0.00 0.00 0.00 0.00 44.72 42.69 2di9 s GLY 13 CO -0.04 -1.45 -0.08 0.30 0.00 0.00 0.00 173.10 171.82 2di9 s HIS 14 N -3.51 0.73 0.74 1.90 3.76 -1.26 -5.15 115.29 112.50 2di9 s HIS 14 Ca 0.40 -0.27 -0.12 0.00 -0.15 0.00 0.00 55.06 54.93 2di9 s HIS 14 Cb 0.03 -0.45 0.04 0.00 1.11 0.00 0.00 32.58 33.31 2di9 s HIS 14 CO 0.26 -0.02 1.10 -1.25 -0.85 0.00 0.00 174.74 173.97 2di9 s PRO 15 N -0.76 2.39 0.49 8.40 0.04 -1.26 -4.97 135.00 139.33 2di9 s PRO 15 Ca -0.01 1.22 -0.22 0.00 0.04 0.00 0.00 61.00 62.03 2di9 s PRO 15 Cb -0.06 -1.91 -0.09 0.00 0.04 0.00 0.00 34.50 32.49 2di9 s PRO 15 CO 0.00 -1.55 0.97 1.33 0.04 0.00 0.00 177.00 177.80 2di9 n VAL 16 N -3.25 2.80 0.98 -0.36 0.24 -1.26 -4.83 118.33 112.65 2di9 n VAL 16 Ca 0.09 -0.50 0.07 0.00 -2.04 0.00 0.00 64.34 61.96 2di9 n VAL 16 Cb 0.53 -1.14 0.42 0.00 -1.47 0.00 0.00 33.84 32.18 2di9 n VAL 16 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2di9 n PRO 17 N -0.22 0.49 0.00 7.34 -0.04 -1.26 -3.60 135.00 137.71 2di9 n PRO 17 Ca 0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2di9 n PRO 17 Cb 0.42 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 2di9 n PRO 17 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2di9 n GLY 18 N -0.02 0.15 2.81 0.55 0.00 -1.26 -4.90 105.19 102.52 2di9 n GLY 18 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 2di9 n GLY 18 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2di9 s SER 19 N -1.15 4.19 0.00 1.61 0.01 -1.26 -4.92 113.70 112.19 2di9 s SER 19 Ca 0.00 -3.63 0.15 0.00 1.31 0.00 0.00 55.95 53.78 2di9 s SER 19 Cb 0.00 -1.41 0.71 0.00 0.21 0.00 0.00 66.02 65.52 2di9 s SER 19 CO 0.00 -0.11 1.42 -0.81 0.41 0.00 0.00 173.24 174.15 2di9 n PRO 20 N 2.24 0.15 -0.32 12.44 -0.04 -1.24 -2.52 135.00 145.72 2di9 n PRO 20 Ca 0.20 0.18 0.04 0.00 -0.04 0.00 0.00 63.50 63.87 2di9 n PRO 20 Cb 0.37 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.50 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 -1.34 0.77 -4.28 0.54 4.01 -1.26 -4.86 117.16 110.73 2di9 n TYR 21 Ca 0.06 -0.29 -0.19 0.00 -0.16 0.00 0.00 57.90 57.32 2di9 n TYR 21 Cb 0.13 -0.19 -0.11 0.00 -0.31 0.00 0.00 39.34 38.86 2di9 n TYR 21 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2di9 s THR 22 N -1.71 1.51 -1.22 -0.72 2.01 -1.05 -5.02 115.64 109.45 2di9 s THR 22 Ca 0.23 -1.85 0.04 0.00 0.31 0.00 0.00 61.69 60.42 2di9 s THR 22 Cb 0.16 -1.70 0.19 0.00 0.01 0.00 0.00 72.50 71.16 2di9 s THR 22 CO 0.10 -0.43 0.92 0.52 -0.69 0.00 0.00 174.62 175.04 2di9 n VAL 23 N 0.32 0.53 -2.05 3.82 0.31 -1.26 -4.85 118.33 115.15 2di9 n VAL 23 Ca -0.14 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 63.88 2di9 n VAL 23 Cb 0.58 -0.25 0.00 0.00 -0.91 0.00 0.00 33.84 33.25 2di9 n VAL 23 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 2di9 n GLU 24 N 0.11 -2.48 -0.64 5.55 0.28 -1.26 -4.67 120.64 117.53 2di9 n GLU 24 Ca 0.07 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 57.15 2di9 n GLU 24 Cb 0.37 -3.84 0.33 0.00 1.43 0.00 0.00 31.44 29.74 2di9 n GLU 24 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2di9 n ALA 25 N -1.99 3.32 -3.38 -1.84 0.00 -1.26 -4.72 120.51 110.64 2di9 n ALA 25 Ca 0.00 -1.96 -0.34 0.00 0.00 0.00 0.00 53.44 51.14 2di9 n ALA 25 Cb 0.38 -0.91 -0.05 0.00 0.00 0.00 0.00 19.45 18.86 2di9 n ALA 25 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2di9 n SER 26 N 0.29 4.59 -3.74 0.00 7.64 -1.26 -4.91 113.62 116.22 2di9 n SER 26 Ca 0.24 -3.35 -0.13 0.00 1.01 0.00 0.00 58.87 56.64 2di9 n SER 26 Cb 0.99 -0.94 -0.10 0.00 -1.01 0.00 0.00 64.21 63.16 2di9 n SER 26 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2di9 s LEU 27 N -2.25 0.64 0.45 -3.43 1.43 -1.26 -5.11 118.68 109.15 2di9 s LEU 27 Ca 0.34 0.50 -0.23 0.00 -1.03 0.00 0.00 54.13 53.70 2di9 s LEU 27 Cb 0.06 1.32 -0.08 0.00 0.03 0.00 0.00 46.19 47.52 2di9 s LEU 27 CO -0.02 -0.26 1.17 -2.16 0.23 0.00 0.00 176.35 175.31 2di9 s PRO 28 N -0.42 3.82 -0.59 1.29 0.04 -1.26 -3.49 135.00 134.40 2di9 s PRO 28 Ca -0.05 1.80 -0.27 0.00 0.04 0.00 0.00 61.00 62.52 2di9 s PRO 28 Cb -0.03 -2.47 -0.02 0.00 0.04 0.00 0.00 34.50 32.01 2di9 s PRO 28 CO 0.02 -0.51 1.85 -1.25 0.04 0.00 0.00 177.00 177.15 2di9 s PRO 29 N -2.60 2.69 -0.60 0.56 0.04 -1.26 -4.14 135.00 129.69 2di9 s PRO 29 Ca 0.62 0.66 -0.12 0.00 0.04 0.00 0.00 61.00 62.20 2di9 s PRO 29 Cb -0.29 -4.37 0.15 0.00 0.04 0.00 0.00 34.50 30.03 2di9 s PRO 29 CO 0.36 -2.66 0.51 -0.51 0.04 0.00 0.00 177.00 174.74 2di9 s ASP 30 N 7.90 6.07 0.17 6.66 1.01 0.13 -4.92 116.67 133.69 2di9 s ASP 30 Ca 0.68 -2.16 -0.07 0.00 0.71 0.00 0.00 52.55 51.70 2di9 s ASP 30 Cb -0.13 -2.11 0.05 0.00 1.01 0.00 0.00 42.92 41.74 2di9 s ASP 30 CO 0.22 -0.68 1.51 1.55 0.21 0.00 0.00 175.17 177.98 2di9 h PRO 31 N 8.28 0.81 -0.54 8.23 0.13 -1.90 -3.01 132.00 144.00 2di9 h PRO 31 Ca -0.14 -0.42 0.16 0.00 -0.87 0.00 0.00 66.00 64.72 2di9 h PRO 31 Cb 1.06 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.18 2di9 h PRO 31 CO 0.88 1.06 0.64 0.77 -0.23 0.00 0.00 178.00 181.11 2di9 h SER 32 N 0.66 0.00 0.81 1.44 0.02 -1.94 0.99 113.55 115.53 2di9 h SER 32 Ca 0.05 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.85 2di9 h SER 32 Cb 0.96 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.48 2di9 h SER 32 CO 0.09 0.00 -1.28 0.11 -1.14 0.00 0.00 176.83 174.61 2di9 h LYS 33 N 0.00 0.00 -6.01 3.45 1.79 -1.78 -3.46 116.57 110.56 2di9 h LYS 33 Ca 0.25 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 58.12 2di9 h LYS 33 Cb 1.54 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.18 2di9 h LYS 33 CO -0.00 0.29 1.46 0.28 -1.08 0.00 0.00 179.45 180.40 2di9 n VAL 34 N -2.91 0.34 -4.23 0.50 0.31 0.34 -4.85 118.33 107.83 2di9 n VAL 34 Ca -0.08 -0.40 -0.34 0.00 -0.01 0.00 0.00 64.34 63.52 2di9 n VAL 34 Cb 0.81 -2.36 -0.08 0.00 -0.91 0.00 0.00 33.84 31.29 2di9 n VAL 34 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2di9 s LYS 35 N 6.20 2.96 -0.22 5.55 -0.14 -1.17 -4.79 119.74 128.13 2di9 s LYS 35 Ca 1.02 -0.49 -0.00 0.00 -1.36 0.00 0.00 55.97 55.14 2di9 s LYS 35 Cb -0.45 -2.79 0.06 0.00 -1.68 0.00 0.00 37.83 32.97 2di9 s LYS 35 CO 0.39 0.66 -0.03 0.00 -0.76 0.00 0.00 175.35 175.61 2di9 s ALA 36 N -1.06 1.70 -0.01 5.17 0.00 -1.26 -0.62 121.76 125.69 2di9 s ALA 36 Ca 0.18 -1.18 0.01 0.00 0.00 0.00 0.00 51.96 50.97 2di9 s ALA 36 Cb -0.12 -1.37 0.00 0.00 0.00 0.00 0.00 23.12 21.64 2di9 s ALA 36 CO 0.09 -1.19 -0.03 -3.38 0.00 0.00 0.00 175.76 171.24 2di9 s HIS 37 N 1.52 0.30 0.00 0.00 -3.43 -0.66 -5.01 115.29 108.01 2di9 s HIS 37 Ca -0.04 -0.05 0.00 0.00 -0.80 0.00 0.00 55.06 54.17 2di9 s HIS 37 Cb -0.18 -0.22 0.00 0.00 -1.43 0.00 0.00 32.58 30.74 2di9 s HIS 37 CO -0.07 -0.02 0.00 0.41 -2.00 0.00 0.00 174.74 173.06 2di9 n GLY 38 N 3.15 0.18 0.25 -1.38 0.00 -1.26 -0.53 105.19 105.61 2di9 n GLY 38 Ca -0.15 -1.19 -0.11 0.00 0.00 0.00 0.00 46.02 44.57 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 0.80 0.00 1.61 0.13 -1.89 -2.96 132.00 129.68 2di9 h PRO 39 Ca 0.00 -0.42 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 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 1.05 0.07 0.78 -0.23 0.00 0.00 178.00 179.67 2di9 h GLY 40 N 0.89 0.00 0.00 1.56 0.00 -1.19 -0.77 103.07 103.56 2di9 h GLY 40 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 2di9 h GLY 40 CO 0.09 0.00 -0.08 1.41 0.00 0.00 0.00 176.54 177.96 2di9 h LEU 41 N 0.00 0.00 -1.53 3.11 3.38 -1.77 -3.33 115.31 115.16 2di9 h LEU 41 Ca 0.00 -0.75 -0.05 0.00 0.09 0.00 0.00 57.88 57.17 2di9 h LEU 41 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2di9 h LEU 41 CO 0.00 0.93 -0.18 1.05 0.09 0.00 0.00 178.44 180.32 2di9 h GLU 42 N -1.00 0.07 0.00 1.13 4.11 -1.49 -3.23 114.58 114.18 2di9 h GLU 42 Ca -0.02 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.39 2di9 h GLU 42 Cb 0.81 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.05 2di9 h GLU 42 CO -0.01 0.25 0.00 0.41 0.07 0.00 0.00 179.01 179.73 2di9 n GLY 43 N -0.92 0.24 0.00 1.06 0.00 -0.34 -1.88 105.19 103.35 2di9 n GLY 43 Ca -0.02 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.34 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 0.00 1.99 3.21 -0.02 0.00 -1.10 -3.98 105.19 105.29 2di9 n GLY 44 Ca 0.00 -0.03 -0.14 0.00 0.00 0.00 0.00 46.02 45.84 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 2.46 0.54 0.99 1.43 -1.26 -1.17 118.68 121.67 2di9 s LEU 45 Ca 0.00 -0.90 -0.20 0.00 -1.03 0.00 0.00 54.13 52.00 2di9 s LEU 45 Cb 0.00 -0.33 -0.05 0.00 0.03 0.00 0.00 46.19 45.84 2di9 s LEU 45 CO 0.00 -0.29 1.21 -0.69 0.23 0.00 0.00 176.35 176.81 2di9 s VAL 46 N -2.81 2.76 -0.94 -1.59 1.01 -1.00 -2.61 120.40 115.22 2di9 s VAL 46 Ca 0.10 0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.60 2di9 s VAL 46 Cb -0.01 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.14 2di9 s VAL 46 CO 0.00 -0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.65 2di9 n GLY 47 N 0.47 0.64 3.39 4.51 0.00 -1.01 -4.77 105.19 108.41 2di9 n GLY 47 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.15 1.50 0.15 1.61 1.02 -1.07 -4.98 119.74 114.83 2di9 s LYS 48 Ca 0.00 -1.29 -0.31 0.00 0.02 0.00 0.00 55.97 54.39 2di9 s LYS 48 Cb 0.00 -1.93 -0.08 0.00 -0.52 0.00 0.00 37.83 35.30 2di9 s LYS 48 CO 0.00 0.46 1.34 -1.25 -0.92 0.00 0.00 175.35 174.98 2di9 s PRO 49 N -1.92 4.36 -0.04 -1.68 0.04 -1.26 -4.34 135.00 130.15 2di9 s PRO 49 Ca 0.14 2.04 -0.02 0.00 0.04 0.00 0.00 61.00 63.20 2di9 s PRO 49 Cb -0.10 -3.23 0.03 0.00 0.04 0.00 0.00 34.50 31.24 2di9 s PRO 49 CO 0.06 -0.34 0.05 0.00 0.04 0.00 0.00 177.00 176.81 2di9 s ALA 50 N 0.63 0.30 0.29 8.56 0.00 -0.73 -4.88 121.76 125.92 2di9 s ALA 50 Ca 0.60 0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.74 2di9 s ALA 50 Cb -0.36 -0.64 -0.04 0.00 0.00 0.00 0.00 23.12 22.09 2di9 s ALA 50 CO 0.34 -0.48 0.19 -1.83 0.00 0.00 0.00 175.76 173.98 2di9 s GLU 51 N 2.13 1.55 0.35 0.00 -1.05 -1.26 -0.51 118.70 119.92 2di9 s GLU 51 Ca 0.05 -1.88 -0.03 0.00 -0.15 0.00 0.00 54.97 52.96 2di9 s GLU 51 Cb -0.12 0.13 0.00 0.00 -0.44 0.00 0.00 34.13 33.71 2di9 s GLU 51 CO -0.03 -0.50 0.49 -0.59 0.95 0.00 0.00 175.26 175.57 2di9 s PHE 52 N -3.69 1.04 -0.19 4.83 -0.71 -1.22 -1.00 117.98 117.04 2di9 s PHE 52 Ca 0.38 -1.28 -0.06 0.00 -1.04 0.00 0.00 56.93 54.93 2di9 s PHE 52 Cb 0.05 -0.05 -0.03 0.00 -1.21 0.00 0.00 43.02 41.77 2di9 s PHE 52 CO 0.19 -1.15 0.03 0.99 -1.34 0.00 0.00 175.22 173.94 2di9 s THR 53 N -3.02 4.37 -0.13 -4.49 2.01 0.31 -4.33 115.64 110.36 2di9 s THR 53 Ca 0.30 -0.18 -0.01 0.00 0.31 0.00 0.00 61.69 62.12 2di9 s THR 53 Cb -0.01 -2.97 -0.02 0.00 0.01 0.00 0.00 72.50 69.51 2di9 s THR 53 CO 0.20 0.44 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.81 2di9 s ILE 54 N 0.73 3.12 -0.29 1.82 1.01 -1.25 -1.66 121.20 124.69 2di9 s ILE 54 Ca 0.02 -0.63 -0.16 0.00 0.00 0.00 0.00 60.65 59.87 2di9 s ILE 54 Cb -0.14 -2.32 -0.03 0.00 0.01 0.00 0.00 42.46 39.99 2di9 s ILE 54 CO 0.02 0.52 0.44 -1.81 0.00 0.00 0.00 174.94 174.11 2di9 s ASP 55 N 0.39 6.31 0.00 3.58 1.11 0.21 -3.55 116.67 124.72 2di9 s ASP 55 Ca -0.10 0.26 0.00 0.00 0.18 0.00 0.00 52.55 52.89 2di9 s ASP 55 Cb -0.16 -2.24 0.00 0.00 1.07 0.00 0.00 42.92 41.59 2di9 s ASP 55 CO 0.05 -0.28 0.00 0.35 1.18 0.00 0.00 175.17 176.47 2di9 n THR 56 N 5.20 0.00 -0.31 -1.27 -2.24 -1.24 -3.02 114.28 111.40 2di9 n THR 56 Ca -0.06 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.80 2di9 n THR 56 Cb 0.50 -0.41 0.19 0.00 -2.10 0.00 0.00 70.33 68.51 2di9 n THR 56 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2di9 h LYS 57 N 0.00 0.04 -1.12 -0.78 1.57 -1.88 0.94 116.57 115.34 2di9 h LYS 57 Ca 0.00 -0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.48 2di9 h LYS 57 Cb 0.57 -0.01 -0.16 0.00 0.08 0.00 0.00 32.23 32.71 2di9 h LYS 57 CO 0.00 0.02 0.38 0.41 -0.57 0.00 0.00 179.45 179.70 2di9 n GLY 58 N -1.50 3.58 1.17 3.86 0.00 -1.26 -4.17 105.19 106.87 2di9 n GLY 58 Ca 0.17 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2di9 n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2di9 n ALA 59 N -0.22 3.00 0.00 4.61 0.00 0.32 -4.62 120.51 123.60 2di9 n ALA 59 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2di9 n ALA 59 Cb 0.99 0.32 0.00 0.00 0.00 0.00 0.00 19.45 20.75 2di9 n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2di9 n GLY 60 N 2.98 0.39 2.95 0.00 0.00 -1.04 0.19 105.19 110.67 2di9 n GLY 60 Ca 0.00 -1.25 -0.15 0.00 0.00 0.00 0.00 46.02 44.62 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 -4.00 0.37 0.00 2.61 2.01 -1.23 -4.83 115.64 110.57 2di9 s THR 61 Ca 0.00 -0.22 0.00 0.00 0.31 0.00 0.00 61.69 61.78 2di9 s THR 61 Cb 0.00 -0.32 0.00 0.00 0.01 0.00 0.00 72.50 72.19 2di9 s THR 61 CO 0.00 0.09 0.00 0.61 -0.69 0.00 0.00 174.62 174.63 2di9 n GLY 62 N 2.93 -0.52 3.37 4.40 0.00 -1.26 -4.29 105.19 109.82 2di9 n GLY 62 Ca -0.13 0.35 -0.14 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.38 -0.06 -0.02 0.00 -1.26 -5.04 107.32 100.56 2di9 s GLY 63 Ca 0.00 0.58 0.03 0.00 0.00 0.00 0.00 44.72 45.33 2di9 s GLY 63 CO 0.00 0.29 -0.14 -2.27 0.00 0.00 0.00 173.10 170.98 2di9 s LEU 64 N -1.83 1.74 -0.38 0.66 2.96 -1.26 -0.36 118.68 120.21 2di9 s LEU 64 Ca -0.07 -0.32 -0.11 0.00 -0.22 0.00 0.00 54.13 53.41 2di9 s LEU 64 Cb -0.01 -0.89 0.03 0.00 0.50 0.00 0.00 46.19 45.82 2di9 s LEU 64 CO 0.00 0.07 0.22 -0.83 -1.32 0.00 0.00 176.35 174.49 2di9 s GLY 65 N 0.49 1.94 -0.21 7.98 0.00 0.20 -4.97 107.32 112.75 2di9 s GLY 65 Ca -0.12 -1.76 -0.06 0.00 0.00 0.00 0.00 44.72 42.77 2di9 s GLY 65 CO 0.04 0.86 0.04 -2.27 0.00 0.00 0.00 173.10 171.77 2di9 s LEU 66 N 1.55 3.48 -0.02 0.66 2.96 -1.25 -3.03 118.68 123.02 2di9 s LEU 66 Ca 0.02 -0.12 0.00 0.00 -0.22 0.00 0.00 54.13 53.81 2di9 s LEU 66 Cb -0.20 -1.90 0.02 0.00 0.50 0.00 0.00 46.19 44.62 2di9 s LEU 66 CO 0.07 0.06 -0.00 0.42 -1.32 0.00 0.00 176.35 175.58 2di9 s THR 67 N 1.02 0.16 -0.64 3.68 -4.23 -1.14 -4.97 115.64 109.51 2di9 s THR 67 Ca 0.03 0.06 -0.22 0.00 -1.18 0.00 0.00 61.69 60.38 2di9 s THR 67 Cb -0.14 -0.23 0.07 0.00 1.34 0.00 0.00 72.50 73.54 2di9 s THR 67 CO 0.02 0.12 0.91 -0.69 -0.54 0.00 0.00 174.62 174.45 2di9 s VAL 68 N 0.80 4.42 -1.38 2.29 1.01 -1.26 -1.55 120.40 124.72 2di9 s VAL 68 Ca -0.08 -0.41 -0.10 0.00 0.00 0.00 0.00 61.98 61.39 2di9 s VAL 68 Cb -0.11 -4.63 0.09 0.00 0.00 0.00 0.00 36.38 31.73 2di9 s VAL 68 CO -0.01 -1.36 2.22 -0.62 0.00 0.00 0.00 175.10 175.32 2di9 n GLU 69 N 7.43 3.63 -3.92 2.72 -0.58 -0.87 -4.87 120.64 124.19 2di9 n GLU 69 Ca -0.04 -3.10 -0.26 0.00 -0.42 0.00 0.00 57.16 53.33 2di9 n GLU 69 Cb 0.45 -2.94 -0.01 0.00 -0.57 0.00 0.00 31.44 28.37 2di9 n GLU 69 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2di9 s GLY 70 N 1.52 2.39 0.56 0.62 0.00 -1.26 -3.70 107.32 107.45 2di9 s GLY 70 Ca 0.48 -1.24 0.34 0.00 0.00 0.00 0.00 44.72 44.30 2di9 s GLY 70 CO -0.05 -1.95 2.00 -0.56 0.00 0.00 0.00 173.10 172.55 2di9 h PRO 71 N 0.79 0.00 0.00 2.90 0.13 -1.92 -3.45 132.00 130.44 2di9 h PRO 71 Ca -0.37 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.31 2di9 h PRO 71 Cb 1.30 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.35 2di9 h PRO 71 CO 0.58 0.00 -0.33 0.00 -0.23 0.00 0.00 178.00 178.02 2di9 s GLU 73 N -3.24 3.09 0.09 0.00 2.12 -1.26 -4.98 118.70 114.52 2di9 s GLU 73 Ca 0.01 -2.72 -0.19 0.00 0.36 0.00 0.00 54.97 52.42 2di9 s GLU 73 Cb 0.00 -4.01 -0.07 0.00 0.26 0.00 0.00 34.13 30.31 2di9 s GLU 73 CO 0.01 -1.23 0.59 0.00 -0.54 0.00 0.00 175.26 174.09 2di9 s ALA 74 N -0.37 3.57 0.52 6.30 0.00 -1.26 -4.96 121.76 125.56 2di9 s ALA 74 Ca 0.20 0.05 -0.19 0.00 0.00 0.00 0.00 51.96 52.02 2di9 s ALA 74 Cb -0.14 -2.66 -0.07 0.00 0.00 0.00 0.00 23.12 20.25 2di9 s ALA 74 CO -0.07 0.39 1.07 0.21 0.00 0.00 0.00 175.76 177.37 2di9 s LYS 75 N -1.22 3.57 -0.18 0.00 2.36 -1.24 -4.89 119.74 118.13 2di9 s LYS 75 Ca 0.31 1.43 -0.01 0.00 -2.55 0.00 0.00 55.97 55.15 2di9 s LYS 75 Cb -0.19 -2.05 0.05 0.00 -1.05 0.00 0.00 37.83 34.58 2di9 s LYS 75 CO 0.20 -0.64 -0.03 0.42 1.55 0.00 0.00 175.35 176.85 2di9 s ILE 76 N -1.97 1.04 -0.48 5.43 1.01 -1.26 -2.71 121.20 122.26 2di9 s ILE 76 Ca 0.69 -0.71 -0.13 0.00 0.00 0.00 0.00 60.65 60.50 2di9 s ILE 76 Cb -0.19 -1.31 0.10 0.00 0.01 0.00 0.00 42.46 41.07 2di9 s ILE 76 CO 0.25 0.01 0.38 -1.61 0.00 0.00 0.00 174.94 173.97 2di9 s GLU 77 N 1.64 2.77 -0.28 2.79 0.41 0.55 -4.97 118.70 121.62 2di9 s GLU 77 Ca -0.01 -1.58 -0.08 0.00 -0.41 0.00 0.00 54.97 52.89 2di9 s GLU 77 Cb -0.16 -4.05 -0.01 0.00 -1.78 0.00 0.00 34.13 28.12 2di9 s GLU 77 CO -0.07 -1.14 0.10 0.00 -0.49 0.00 0.00 175.26 173.66 2di9 s SER 79 N 1.59 0.67 0.49 0.00 0.15 -1.18 -5.00 113.70 110.42 2di9 s SER 79 Ca 0.05 -0.38 -0.20 0.00 0.70 0.00 0.00 55.95 56.13 2di9 s SER 79 Cb -0.16 0.01 -0.08 0.00 -1.71 0.00 0.00 66.02 64.08 2di9 s SER 79 CO 0.04 -0.12 1.03 1.51 1.20 0.00 0.00 173.24 176.90 2di9 s ASP 80 N -1.04 6.36 -0.24 5.45 -4.77 -1.26 -1.31 116.67 119.86 2di9 s ASP 80 Ca -0.06 1.88 -0.02 0.00 -3.30 0.00 0.00 52.55 51.05 2di9 s ASP 80 Cb -0.07 -2.55 -0.18 0.00 -1.09 0.00 0.00 42.92 39.03 2di9 s ASP 80 CO 0.00 -0.77 -0.14 0.59 0.70 0.00 0.00 175.17 175.55 2di9 n ASN 81 N -1.05 2.00 0.00 2.11 3.02 -1.05 -4.82 115.26 115.47 2di9 n ASN 81 Ca 0.09 -0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 2di9 n ASN 81 Cb 0.53 -0.54 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 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 2.08 1.74 1.07 7.41 0.00 -1.26 -4.92 105.19 111.31 2di9 n GLY 82 Ca -0.45 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.62 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 3.01 0.00 1.61 2.03 -1.26 -4.83 116.55 117.11 2di9 n ASP 83 Ca 0.00 -2.35 0.00 0.00 0.52 0.00 0.00 54.79 52.96 2di9 n ASP 83 Cb 0.00 -0.50 0.00 0.00 -0.72 0.00 0.00 41.12 39.90 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 0.51 0.65 3.42 0.27 0.00 -1.26 -4.98 105.19 103.80 2di9 n GLY 84 Ca 0.13 -0.74 -0.20 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.00 1.20 -0.11 2.61 -4.23 -1.26 -3.53 115.64 108.32 2di9 s THR 85 Ca 0.00 -2.03 0.03 0.00 -1.18 0.00 0.00 61.69 58.52 2di9 s THR 85 Cb 0.00 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.20 2di9 s THR 85 CO 0.00 -0.11 -0.22 0.00 -0.54 0.00 0.00 174.62 173.74 2di9 s SER 87 N 0.50 6.35 -0.20 0.00 1.04 -0.43 -3.76 113.70 117.20 2di9 s SER 87 Ca -0.15 -3.38 -0.15 0.00 0.48 0.00 0.00 55.95 52.74 2di9 s SER 87 Cb -0.17 -2.03 -0.04 0.00 0.10 0.00 0.00 66.02 63.88 2di9 s SER 87 CO 0.06 -0.30 0.37 -0.69 0.98 0.00 0.00 173.24 173.65 2di9 s VAL 88 N -0.87 5.23 -0.07 5.02 1.01 -1.26 -3.09 120.40 126.37 2di9 s VAL 88 Ca 0.25 0.64 0.04 0.00 0.00 0.00 0.00 61.98 62.91 2di9 s VAL 88 Cb -0.11 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.58 2di9 s VAL 88 CO -0.09 0.28 -0.19 -0.94 0.00 0.00 0.00 175.10 174.16 2di9 s SER 89 N 0.98 2.44 0.19 3.32 1.04 0.32 -3.40 113.70 118.59 2di9 s SER 89 Ca 0.18 -0.42 0.11 0.00 0.48 0.00 0.00 55.95 56.30 2di9 s SER 89 Cb -0.14 -0.93 -0.04 0.00 0.10 0.00 0.00 66.02 65.01 2di9 s SER 89 CO 0.07 0.13 -0.24 -0.72 0.98 0.00 0.00 173.24 173.47 2di9 s TYR 90 N 0.27 2.29 -0.28 5.02 1.13 0.33 -0.33 117.35 125.78 2di9 s TYR 90 Ca -0.11 -0.36 0.00 0.00 -1.41 0.00 0.00 57.07 55.19 2di9 s TYR 90 Cb -0.15 -1.13 0.08 0.00 -1.10 0.00 0.00 41.96 39.66 2di9 s TYR 90 CO 0.05 0.50 0.04 -0.51 -2.51 0.00 0.00 175.55 173.12 2di9 s LEU 91 N -2.67 2.71 1.10 -3.49 1.43 -1.10 -1.78 118.68 114.88 2di9 s LEU 91 Ca 0.21 -1.53 -0.15 0.00 -1.03 0.00 0.00 54.13 51.62 2di9 s LEU 91 Cb -0.08 -1.07 0.24 0.00 0.03 0.00 0.00 46.19 45.31 2di9 s LEU 91 CO 0.10 -0.35 1.10 -2.16 0.23 0.00 0.00 176.35 175.27 2di9 s PRO 92 N 1.44 -0.39 0.00 1.29 0.04 -1.26 -3.71 135.00 132.41 2di9 s PRO 92 Ca 0.05 0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.33 2di9 s PRO 92 Cb -0.18 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.69 2di9 s PRO 92 CO -0.15 -3.22 0.00 -2.37 0.04 0.00 0.00 177.00 171.30 2di9 n THR 93 N -4.47 0.00 -3.89 1.26 5.66 -1.26 -2.41 114.28 109.17 2di9 n THR 93 Ca 0.09 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.98 2di9 n THR 93 Cb 0.58 -0.88 -0.11 0.00 -1.55 0.00 0.00 70.33 68.38 2di9 n THR 93 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2di9 s LYS 94 N -1.89 0.34 -0.48 1.09 1.02 -1.26 -4.67 119.74 113.88 2di9 s LYS 94 Ca 0.00 -0.32 -0.27 0.00 0.02 0.00 0.00 55.97 55.39 2di9 s LYS 94 Cb 0.00 0.14 -0.02 0.00 -0.52 0.00 0.00 37.83 37.43 2di9 s LYS 94 CO 0.00 -0.07 1.78 -1.25 -0.92 0.00 0.00 175.35 174.89 2di9 s PRO 95 N -1.04 3.00 0.00 -1.68 0.04 -1.26 -4.78 135.00 129.28 2di9 s PRO 95 Ca -0.11 0.95 0.00 0.00 0.04 0.00 0.00 61.00 61.88 2di9 s PRO 95 Cb -0.07 -4.27 0.00 0.00 0.04 0.00 0.00 34.50 30.20 2di9 s PRO 95 CO 0.00 -2.27 0.00 0.41 0.04 0.00 0.00 177.00 175.19 2di9 n GLY 96 N 5.52 3.07 2.87 0.56 0.00 -1.26 -4.97 105.19 110.98 2di9 n GLY 96 Ca 0.21 -0.10 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 2di9 n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2di9 s GLU 97 N 2.90 0.05 -0.16 1.61 2.02 -1.26 -3.69 118.70 120.17 2di9 s GLU 97 Ca 0.00 0.41 0.02 0.00 0.02 0.00 0.00 54.97 55.42 2di9 s GLU 97 Cb 0.00 -0.23 0.02 0.00 0.10 0.00 0.00 34.13 34.01 2di9 s GLU 97 CO 0.00 -0.22 -0.20 0.71 0.02 0.00 0.00 175.26 175.57 2di9 s TYR 98 N 1.56 2.65 -0.52 1.61 1.51 -1.19 -4.25 117.35 118.72 2di9 s TYR 98 Ca -0.05 -1.47 -0.16 0.00 -1.01 0.00 0.00 57.07 54.38 2di9 s TYR 98 Cb -0.12 -1.83 0.11 0.00 -0.11 0.00 0.00 41.96 40.01 2di9 s TYR 98 CO -0.05 -0.71 0.48 -0.06 -1.11 0.00 0.00 175.55 174.09 2di9 s PHE 99 N 1.12 3.24 -0.60 2.71 0.40 -1.24 -1.75 117.98 121.85 2di9 s PHE 99 Ca 0.00 -1.17 -0.27 0.00 -0.60 0.00 0.00 56.93 54.89 2di9 s PHE 99 Cb -0.14 -3.63 0.01 0.00 0.51 0.00 0.00 43.02 39.77 2di9 s PHE 99 CO -0.08 -0.97 1.49 0.08 0.70 0.00 0.00 175.22 176.44 2di9 s VAL 100 N 1.66 3.67 -0.60 -0.44 1.01 -1.23 -2.04 120.40 122.43 2di9 s VAL 100 Ca 0.04 0.51 -0.28 0.00 0.00 0.00 0.00 61.98 62.25 2di9 s VAL 100 Cb -0.28 -4.41 0.03 0.00 0.00 0.00 0.00 36.38 31.72 2di9 s VAL 100 CO 0.04 -1.23 1.21 0.20 0.00 0.00 0.00 175.10 175.32 2di9 s ASN 101 N 5.10 6.40 -0.35 3.32 0.01 -0.60 -2.54 114.94 126.28 2di9 s ASN 101 Ca 0.53 0.06 -0.10 0.00 -0.71 0.00 0.00 52.86 52.64 2di9 s ASN 101 Cb -0.11 -2.55 0.02 0.00 0.41 0.00 0.00 41.25 39.02 2di9 s ASN 101 CO 0.22 -1.53 0.17 -0.63 -1.51 0.00 0.00 177.10 173.82 2di9 s ILE 102 N 5.10 4.39 -0.05 0.60 1.01 -1.26 -2.91 121.20 128.08 2di9 s ILE 102 Ca 0.43 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 60.25 2di9 s ILE 102 Cb -0.08 -3.42 0.02 0.00 0.01 0.00 0.00 42.46 38.99 2di9 s ILE 102 CO 0.24 -0.17 -0.07 -1.48 0.00 0.00 0.00 174.94 173.46 2di9 s LEU 103 N 1.53 1.49 -0.37 2.97 0.05 -1.17 -1.62 118.68 121.56 2di9 s LEU 103 Ca 0.02 -0.19 -0.14 0.00 0.05 0.00 0.00 54.13 53.87 2di9 s LEU 103 Cb -0.19 -0.58 0.00 0.00 -2.05 0.00 0.00 46.19 43.38 2di9 s LEU 103 CO 0.06 -0.01 0.26 0.12 -0.55 0.00 0.00 176.35 176.23 2di9 s PHE 104 N 0.73 3.23 -1.23 3.48 5.36 0.17 -0.63 117.98 129.10 2di9 s PHE 104 Ca -0.12 -0.44 -0.06 0.00 -0.96 0.00 0.00 56.93 55.36 2di9 s PHE 104 Cb -0.14 -2.52 0.01 0.00 -0.34 0.00 0.00 43.02 40.02 2di9 s PHE 104 CO 0.01 -0.48 1.06 0.39 -1.46 0.00 0.00 175.22 174.74 2di9 n GLU 105 N 5.12 -7.12 -1.86 10.12 1.02 0.51 -1.97 120.64 126.46 2di9 n GLU 105 Ca -0.12 0.78 -0.08 0.00 -0.02 0.00 0.00 57.16 57.72 2di9 n GLU 105 Cb 0.48 -5.66 -0.01 0.00 -0.02 0.00 0.00 31.44 26.23 2di9 n GLU 105 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2di9 n GLU 106 N -4.50 -0.60 -3.91 3.49 1.02 -1.26 -5.01 120.64 109.86 2di9 n GLU 106 Ca -0.07 0.50 -0.29 0.00 -0.02 0.00 0.00 57.16 57.29 2di9 n GLU 106 Cb 0.58 -4.41 -0.16 0.00 -0.02 0.00 0.00 31.44 27.44 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 -2.36 1.29 -0.02 2.62 1.01 -0.83 -5.09 120.40 117.02 2di9 s VAL 107 Ca 0.00 -0.88 -0.30 0.00 0.00 0.00 0.00 61.98 60.80 2di9 s VAL 107 Cb 0.00 -1.50 -0.07 0.00 0.00 0.00 0.00 36.38 34.81 2di9 s VAL 107 CO 0.00 0.04 1.72 -1.00 0.00 0.00 0.00 175.10 175.86 2di9 s HIS 108 N 1.53 1.89 0.60 5.22 3.76 -1.26 0.44 115.29 127.47 2di9 s HIS 108 Ca -0.02 0.07 -0.18 0.00 -0.15 0.00 0.00 55.06 54.79 2di9 s HIS 108 Cb -0.17 -3.99 -0.03 0.00 1.11 0.00 0.00 32.58 29.50 2di9 s HIS 108 CO -0.07 -4.23 1.14 0.96 -0.85 0.00 0.00 174.74 171.69 2di9 s ILE 109 N 3.93 3.06 -1.11 0.60 -4.36 -0.64 -4.89 121.20 117.78 2di9 s ILE 109 Ca 0.77 0.59 -0.23 0.00 -0.26 0.00 0.00 60.65 61.52 2di9 s ILE 109 Cb -0.36 -3.17 -0.08 0.00 1.25 0.00 0.00 42.46 40.10 2di9 s ILE 109 CO 0.33 -0.21 1.94 -2.16 0.24 0.00 0.00 174.94 175.07 2di9 s PRO 110 N -3.61 2.50 0.00 0.37 0.04 -1.26 -2.35 135.00 130.70 2di9 s PRO 110 Ca 0.72 -0.95 0.00 0.00 0.04 0.00 0.00 61.00 60.81 2di9 s PRO 110 Cb -0.24 -5.20 0.00 0.00 0.04 0.00 0.00 34.50 29.10 2di9 s PRO 110 CO 0.34 -3.84 0.00 0.41 0.04 0.00 0.00 177.00 173.94 2di9 n GLY 111 N 6.07 0.18 3.89 0.56 0.00 -1.26 -5.05 105.19 109.58 2di9 n GLY 111 Ca 0.44 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.20 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 6.05 1.08 1.61 1.04 -0.99 -4.23 113.70 118.26 2di9 s SER 112 Ca 0.00 0.06 -0.15 0.00 0.48 0.00 0.00 55.95 56.34 2di9 s SER 112 Cb 0.00 -1.74 0.23 0.00 0.10 0.00 0.00 66.02 64.60 2di9 s SER 112 CO 0.00 0.05 1.10 -2.16 0.98 0.00 0.00 173.24 173.21 2di9 s PRO 113 N -3.22 -0.21 -0.43 4.02 0.04 -1.26 -4.86 135.00 129.08 2di9 s PRO 113 Ca 0.33 0.30 0.02 0.00 0.04 0.00 0.00 61.00 61.69 2di9 s PRO 113 Cb -0.11 -1.68 0.12 0.00 0.04 0.00 0.00 34.50 32.87 2di9 s PRO 113 CO 0.27 -3.11 0.18 -0.06 0.04 0.00 0.00 177.00 174.32 2di9 s PHE 114 N -2.98 3.55 -0.09 0.56 0.40 -1.05 -4.85 117.98 113.52 2di9 s PHE 114 Ca 0.67 -2.88 -0.33 0.00 -0.60 0.00 0.00 56.93 53.80 2di9 s PHE 114 Cb -0.16 -3.01 -0.11 0.00 0.51 0.00 0.00 43.02 40.26 2di9 s PHE 114 CO 0.57 -0.89 1.94 1.17 0.70 0.00 0.00 175.22 178.71 2di9 n LYS 115 N 3.98 2.23 -3.94 0.44 4.81 -1.26 -3.58 118.16 120.83 2di9 n LYS 115 Ca 0.03 0.80 -0.35 0.00 -0.87 0.00 0.00 58.31 57.92 2di9 n LYS 115 Cb 0.39 -2.74 -0.14 0.00 0.02 0.00 0.00 35.03 32.56 2di9 n LYS 115 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2di9 s ALA 116 N 4.66 2.73 -0.36 3.14 0.00 -0.72 -4.62 121.76 126.59 2di9 s ALA 116 Ca 0.94 -1.43 -0.27 0.00 0.00 0.00 0.00 51.96 51.20 2di9 s ALA 116 Cb -0.63 -1.72 0.02 0.00 0.00 0.00 0.00 23.12 20.79 2di9 s ALA 116 CO 0.49 -0.77 0.98 0.34 0.00 0.00 0.00 175.76 176.79 2di9 s ASP 117 N 1.35 6.74 -0.09 0.00 -1.08 -0.79 -3.15 116.67 119.66 2di9 s ASP 117 Ca 0.01 0.69 -0.12 0.00 -0.52 0.00 0.00 52.55 52.62 2di9 s ASP 117 Cb -0.16 -2.49 -0.05 0.00 -1.46 0.00 0.00 42.92 38.76 2di9 s ASP 117 CO -0.04 -0.89 0.28 -0.63 0.52 0.00 0.00 175.17 174.41 2di9 s ILE 118 N 3.59 5.27 0.36 4.11 -1.09 -1.24 -2.72 121.20 129.47 2di9 s ILE 118 Ca 0.41 0.53 0.09 0.00 -2.23 0.00 0.00 60.65 59.45 2di9 s ILE 118 Cb -0.12 -3.58 -0.06 0.00 -1.58 0.00 0.00 42.46 37.13 2di9 s ILE 118 CO 0.19 0.54 0.00 -1.61 -1.23 0.00 0.00 174.94 172.83 2di9 s GLU 119 N -0.64 2.02 0.21 2.79 2.02 -0.32 -4.12 118.70 120.66 2di9 s GLU 119 Ca 0.19 -1.85 -0.30 0.00 0.02 0.00 0.00 54.97 53.03 2di9 s GLU 119 Cb -0.14 -1.85 -0.08 0.00 0.10 0.00 0.00 34.13 32.16 2di9 s GLU 119 CO 0.07 0.09 1.05 -1.64 0.02 0.00 0.00 175.26 174.85 2di9 s MET 120 N -3.71 4.68 0.42 1.61 -1.94 -1.26 -2.39 119.30 116.71 2di9 s MET 120 Ca 0.35 1.66 -0.24 0.00 -1.71 0.00 0.00 55.69 55.75 2di9 s MET 120 Cb 0.02 -3.26 -0.08 0.00 2.01 0.00 0.00 34.83 33.52 2di9 s MET 120 CO 0.19 0.23 1.18 -1.25 -0.01 0.00 0.00 175.02 175.36 2di9 s PRO 121 N -0.83 3.94 1.15 2.03 0.04 -1.26 -4.92 135.00 135.15 2di9 s PRO 121 Ca 0.46 1.85 -0.17 0.00 0.04 0.00 0.00 61.00 63.17 2di9 s PRO 121 Cb -0.29 -2.59 0.26 0.00 0.04 0.00 0.00 34.50 31.93 2di9 s PRO 121 CO 0.36 -0.42 1.10 -0.06 0.04 0.00 0.00 177.00 178.02 2di9 s PHE 122 N -1.45 0.95 -0.03 0.56 0.40 -1.26 -5.04 117.98 112.11 2di9 s PHE 122 Ca 0.59 0.64 -0.06 0.00 -0.60 0.00 0.00 56.93 57.51 2di9 s PHE 122 Cb -0.31 -3.38 -0.04 0.00 0.51 0.00 0.00 43.02 39.80 2di9 s PHE 122 CO 0.38 -3.63 0.22 0.16 0.70 0.00 0.00 175.22 173.05 2di9 s ASP 123 N -3.73 6.45 0.79 1.36 1.47 -1.26 -5.09 116.67 116.65 2di9 s ASP 123 Ca 0.69 0.49 -0.11 0.00 1.18 0.00 0.00 52.55 54.81 2di9 s ASP 123 Cb -0.13 -2.07 0.07 0.00 -0.34 0.00 0.00 42.92 40.45 2di9 s ASP 123 CO 0.57 0.30 1.09 -2.16 0.68 0.00 0.00 175.17 175.64 2di9 s PRO 124 N -1.61 2.12 -0.41 2.11 0.04 -1.26 -4.96 135.00 131.03 2di9 s PRO 124 Ca 0.24 1.12 -0.29 0.00 0.04 0.00 0.00 61.00 62.12 2di9 s PRO 124 Cb -0.13 -1.88 0.02 0.00 0.04 0.00 0.00 34.50 32.54 2di9 s PRO 124 CO 0.14 -1.73 1.26 -1.12 0.04 0.00 0.00 177.00 175.60 2di9 s SER 125 N -3.40 6.56 -0.28 6.66 0.01 -1.26 -4.97 113.70 117.02 2di9 s SER 125 Ca 0.61 0.79 -0.19 0.00 1.31 0.00 0.00 55.95 58.47 2di9 s SER 125 Cb -0.17 -2.54 0.08 0.00 0.21 0.00 0.00 66.02 63.59 2di9 s SER 125 CO 0.56 -1.26 0.72 -0.55 0.41 0.00 0.00 173.24 173.12 2di9 s SER 126 N 3.00 -0.86 0.00 2.44 0.15 -1.26 -5.01 113.70 112.16 2di9 s SER 126 Ca 0.54 1.46 0.00 0.00 0.70 0.00 0.00 55.95 58.65 2di9 s SER 126 Cb -0.12 1.40 0.00 0.00 -1.71 0.00 0.00 66.02 65.59 2di9 s SER 126 CO 0.29 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.10 2di9 n GLY 127 N 3.70 2.43 0.00 9.45 0.00 -1.26 -4.89 105.19 114.62 2di9 n GLY 127 Ca -0.18 -0.52 0.07 0.00 0.00 0.00 0.00 46.02 45.40 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 0.00 0.17 -2.58 1.61 -0.04 -1.26 -4.78 135.00 128.12 2di9 n PRO 128 Ca 0.00 0.17 -0.35 0.00 -0.04 0.00 0.00 63.50 63.27 2di9 n PRO 128 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 2di9 n PRO 128 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2di9 s SER 129 N -2.66 6.66 -0.24 3.54 0.15 -1.26 -5.00 113.70 114.89 2di9 s SER 129 Ca 0.13 1.96 -0.17 0.00 0.70 0.00 0.00 55.95 58.57 2di9 s SER 129 Cb 0.10 -2.57 -0.16 0.00 -1.71 0.00 0.00 66.02 61.67 2di9 s SER 129 CO 0.23 -0.56 -0.05 -0.24 1.20 0.00 0.00 173.24 173.82 2di9 n SER 130 N -0.40 1.92 -0.88 5.45 2.88 -1.26 -5.14 113.62 116.19 2di9 n SER 130 Ca 0.06 0.36 0.11 0.00 -1.33 0.00 0.00 58.87 58.07 2di9 n SER 130 Cb 0.51 -0.88 0.09 0.00 -0.75 0.00 0.00 64.21 63.18 2di9 n SER 130 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42