#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 -0.92 0.31 1.61 0.01 -1.26 -5.17 113.70 108.28 2di9 s SER 2 Ca 0.00 1.27 -0.18 0.00 1.31 0.00 0.00 55.95 58.36 2di9 s SER 2 Cb 0.00 2.03 0.03 0.00 0.21 0.00 0.00 66.02 68.29 2di9 s SER 2 CO 0.00 -0.18 0.71 -0.44 0.41 0.00 0.00 173.24 173.74 2di9 s SER 3 N 2.68 -0.10 0.00 2.44 0.01 -1.26 -5.17 113.70 112.30 2di9 s SER 3 Ca -0.05 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.35 2di9 s SER 3 Cb -0.09 0.75 0.00 0.00 0.21 0.00 0.00 66.02 66.89 2di9 s SER 3 CO -0.18 -1.44 0.00 0.61 0.41 0.00 0.00 173.24 172.64 2di9 n GLY 4 N -0.48 -0.35 2.99 3.44 0.00 -1.26 -5.05 105.19 104.48 2di9 n GLY 4 Ca -0.05 -0.75 -0.16 0.00 0.00 0.00 0.00 46.02 45.06 2di9 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2di9 n SER 5 N 0.00 -4.38 -4.91 1.61 7.64 -1.26 -5.01 113.62 107.31 2di9 n SER 5 Ca 0.00 -0.42 -0.29 0.00 1.01 0.00 0.00 58.87 59.18 2di9 n SER 5 Cb 0.00 -3.88 -0.03 0.00 -1.01 0.00 0.00 64.21 59.29 2di9 n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2di9 s SER 6 N -3.45 6.45 0.00 6.43 1.04 -1.26 -4.99 113.70 117.92 2di9 s SER 6 Ca 0.32 0.69 0.00 0.00 0.48 0.00 0.00 55.95 57.43 2di9 s SER 6 Cb -0.14 -2.13 0.00 0.00 0.10 0.00 0.00 66.02 63.85 2di9 s SER 6 CO 0.54 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 175.20 2di9 n GLY 7 N -0.85 0.21 3.50 7.32 0.00 -1.26 -5.11 105.19 109.00 2di9 n GLY 7 Ca -0.02 -2.29 -0.11 0.00 0.00 0.00 0.00 46.02 43.60 2di9 n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2di9 s ASP 8 N -4.00 -0.47 -0.24 1.61 1.01 -1.26 -5.14 116.67 108.17 2di9 s ASP 8 Ca 0.00 0.21 -0.18 0.00 0.71 0.00 0.00 52.55 53.29 2di9 s ASP 8 Cb 0.00 0.45 -0.03 0.00 1.01 0.00 0.00 42.92 44.35 2di9 s ASP 8 CO 0.00 -0.65 0.49 -0.69 0.21 0.00 0.00 175.17 174.53 2di9 s VAL 9 N -2.55 5.10 0.02 -1.27 1.01 -1.26 -5.06 120.40 116.39 2di9 s VAL 9 Ca -0.00 0.86 0.00 0.00 0.00 0.00 0.00 61.98 62.84 2di9 s VAL 9 Cb -0.01 -3.81 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 2di9 s VAL 9 CO -0.05 0.13 -0.03 -0.89 0.00 0.00 0.00 175.10 174.26 2di9 s THR 10 N 2.04 0.16 0.15 3.92 2.01 -1.26 -5.16 115.64 117.51 2di9 s THR 10 Ca 0.21 -0.61 -0.05 0.00 0.31 0.00 0.00 61.69 61.54 2di9 s THR 10 Cb -0.15 -0.24 -0.06 0.00 0.01 0.00 0.00 72.50 72.05 2di9 s THR 10 CO 0.09 -0.29 0.39 -0.72 -0.69 0.00 0.00 174.62 173.41 2di9 s TYR 11 N -0.91 3.47 0.00 4.92 -0.85 -1.26 -5.00 117.35 117.72 2di9 s TYR 11 Ca -0.09 0.60 0.00 0.00 -0.52 0.00 0.00 57.07 57.06 2di9 s TYR 11 Cb -0.06 -2.04 0.00 0.00 0.38 0.00 0.00 41.96 40.24 2di9 s TYR 11 CO -0.00 0.42 0.00 -0.40 -1.52 0.00 0.00 175.55 174.05 2di9 n ASP 12 N 0.10 0.10 0.00 -0.18 5.75 -1.26 -5.17 116.55 115.90 2di9 n ASP 12 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.76 2di9 n ASP 12 Cb 0.52 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.61 2di9 n ASP 12 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2di9 n GLY 13 N 2.26 1.21 3.60 6.12 0.00 -1.26 -4.99 105.19 112.12 2di9 n GLY 13 Ca 0.00 -1.54 -0.41 0.00 0.00 0.00 0.00 46.02 44.07 2di9 n GLY 13 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2di9 n HIS 14 N 1.43 1.03 -2.10 1.61 8.25 -1.26 -4.86 115.22 119.32 2di9 n HIS 14 Ca 0.00 0.56 -0.43 0.00 -0.26 0.00 0.00 57.72 57.59 2di9 n HIS 14 Cb 0.00 -2.21 -0.03 0.00 1.12 0.00 0.00 29.99 28.88 2di9 n HIS 14 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2di9 s PRO 15 N -2.02 3.59 0.40 -0.41 0.04 -1.26 -4.95 135.00 130.39 2di9 s PRO 15 Ca 0.64 1.47 -0.23 0.00 0.04 0.00 0.00 61.00 62.91 2di9 s PRO 15 Cb -0.55 -4.10 -0.12 0.00 0.04 0.00 0.00 34.50 29.77 2di9 s PRO 15 CO 0.56 -1.55 0.68 1.33 0.04 0.00 0.00 177.00 178.07 2di9 n VAL 16 N 6.90 1.97 0.72 -0.36 0.24 -1.26 -4.82 118.33 121.72 2di9 n VAL 16 Ca 0.20 -0.50 0.07 0.00 -2.04 0.00 0.00 64.34 62.07 2di9 n VAL 16 Cb 0.46 -0.68 0.38 0.00 -1.47 0.00 0.00 33.84 32.53 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 0.51 0.23 -3.55 7.34 -0.04 -1.26 -4.25 135.00 133.98 2di9 n PRO 17 Ca 0.11 0.13 -0.29 0.00 -0.04 0.00 0.00 63.50 63.42 2di9 n PRO 17 Cb 0.38 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.21 2di9 n PRO 17 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2di9 s GLY 18 N -2.53 0.90 -0.80 0.55 0.00 -1.26 -5.06 107.32 99.12 2di9 s GLY 18 Ca 0.15 -1.74 -0.07 0.00 0.00 0.00 0.00 44.72 43.05 2di9 s GLY 18 CO 0.22 1.95 0.69 -0.56 0.00 0.00 0.00 173.10 175.41 2di9 s SER 19 N 1.30 6.14 0.00 1.64 0.01 -1.26 -4.89 113.70 116.65 2di9 s SER 19 Ca 0.15 -3.03 0.11 0.00 1.31 0.00 0.00 55.95 54.48 2di9 s SER 19 Cb -0.21 -2.03 0.67 0.00 0.21 0.00 0.00 66.02 64.66 2di9 s SER 19 CO -0.12 -0.40 1.10 -0.81 0.41 0.00 0.00 173.24 173.42 2di9 n PRO 20 N 3.37 0.49 -0.60 12.44 -0.04 -1.26 -3.78 135.00 145.61 2di9 n PRO 20 Ca 0.14 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.56 2di9 n PRO 20 Cb 0.41 -1.36 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 2di9 n PRO 20 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2di9 n TYR 21 N -0.86 0.33 -4.01 0.54 4.11 -1.26 -4.76 117.16 111.25 2di9 n TYR 21 Ca 0.08 -1.22 -0.33 0.00 -0.00 0.00 0.00 57.90 56.44 2di9 n TYR 21 Cb 0.04 -0.62 -0.15 0.00 -0.00 0.00 0.00 39.34 38.61 2di9 n TYR 21 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.86 177.81 2di9 s THR 22 N -0.48 2.49 0.09 -3.48 -4.23 -1.25 -5.08 115.64 103.70 2di9 s THR 22 Ca 0.08 -1.46 -0.31 0.00 -1.18 0.00 0.00 61.69 58.83 2di9 s THR 22 Cb 0.06 -2.41 -0.10 0.00 1.34 0.00 0.00 72.50 71.39 2di9 s THR 22 CO -0.00 0.00 1.86 0.68 -0.54 0.00 0.00 174.62 176.62 2di9 s VAL 23 N 1.18 2.72 -0.50 2.29 -7.23 -1.26 -4.89 120.40 112.71 2di9 s VAL 23 Ca -0.06 0.08 0.02 0.00 -1.81 0.00 0.00 61.98 60.21 2di9 s VAL 23 Cb -0.19 -3.05 0.45 0.00 0.56 0.00 0.00 36.38 34.15 2di9 s VAL 23 CO -0.04 -0.00 1.63 -0.62 -0.31 0.00 0.00 175.10 175.76 2di9 n GLU 24 N 6.24 3.13 -0.71 4.82 1.02 -1.26 -4.71 120.64 129.17 2di9 n GLU 24 Ca 0.18 -3.73 -0.14 0.00 -0.02 0.00 0.00 57.16 53.46 2di9 n GLU 24 Cb 0.39 -2.28 0.09 0.00 -0.02 0.00 0.00 31.44 29.62 2di9 n GLU 24 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2di9 n ALA 25 N -0.80 4.36 -3.49 0.62 0.00 -1.26 -4.77 120.51 115.17 2di9 n ALA 25 Ca 0.54 -1.61 0.01 0.00 0.00 0.00 0.00 53.44 52.37 2di9 n ALA 25 Cb 0.78 -1.27 -0.05 0.00 0.00 0.00 0.00 19.45 18.91 2di9 n ALA 25 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2di9 s SER 26 N -0.20 -0.43 -0.03 0.00 0.15 -1.26 -5.18 113.70 106.75 2di9 s SER 26 Ca 0.31 0.63 -0.08 0.00 0.70 0.00 0.00 55.95 57.51 2di9 s SER 26 Cb 0.26 1.36 0.01 0.00 -1.71 0.00 0.00 66.02 65.94 2di9 s SER 26 CO 0.05 -0.09 0.18 -0.76 1.20 0.00 0.00 173.24 173.82 2di9 s LEU 27 N 1.86 1.35 0.50 3.45 1.43 -1.26 -5.12 118.68 120.88 2di9 s LEU 27 Ca -0.05 0.05 -0.21 0.00 -1.03 0.00 0.00 54.13 52.89 2di9 s LEU 27 Cb -0.04 0.76 -0.07 0.00 0.03 0.00 0.00 46.19 46.87 2di9 s LEU 27 CO -0.15 -0.27 1.15 -2.16 0.23 0.00 0.00 176.35 175.14 2di9 s PRO 28 N -0.84 3.55 -0.27 1.29 0.04 -1.26 -3.73 135.00 133.79 2di9 s PRO 28 Ca -0.09 1.69 -0.29 0.00 0.04 0.00 0.00 61.00 62.35 2di9 s PRO 28 Cb -0.05 -2.20 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 2di9 s PRO 28 CO 0.01 -0.70 1.65 -1.25 0.04 0.00 0.00 177.00 176.75 2di9 s PRO 29 N -3.00 3.65 -0.75 0.56 0.04 -1.26 -4.15 135.00 130.08 2di9 s PRO 29 Ca 0.68 1.53 -0.09 0.00 0.04 0.00 0.00 61.00 63.16 2di9 s PRO 29 Cb -0.26 -4.08 0.20 0.00 0.04 0.00 0.00 34.50 30.40 2di9 s PRO 29 CO 0.31 -1.48 0.63 -0.51 0.04 0.00 0.00 177.00 175.99 2di9 s ASP 30 N 4.71 6.08 0.51 6.66 1.01 0.11 -4.89 116.67 130.86 2di9 s ASP 30 Ca 0.73 -2.82 0.30 0.00 0.71 0.00 0.00 52.55 51.46 2di9 s ASP 30 Cb -0.23 -2.05 1.25 0.00 1.01 0.00 0.00 42.92 42.91 2di9 s ASP 30 CO 0.31 -0.46 1.95 1.55 0.21 0.00 0.00 175.17 178.73 2di9 h PRO 31 N 7.36 0.00 0.00 8.23 0.13 -1.89 -2.63 132.00 143.20 2di9 h PRO 31 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 2di9 h PRO 31 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 2di9 h PRO 31 CO 0.74 0.10 0.00 0.43 -0.23 0.00 0.00 178.00 179.03 2di9 n SER 32 N -3.26 0.00 -0.05 1.44 7.64 -1.26 -2.32 113.62 115.81 2di9 n SER 32 Ca 0.00 -0.19 -0.01 0.00 1.01 0.00 0.00 58.87 59.68 2di9 n SER 32 Cb 0.33 -0.18 -0.13 0.00 -1.01 0.00 0.00 64.21 63.22 2di9 n SER 32 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2di9 n LYS 33 N -1.18 1.04 -1.55 1.43 4.76 -0.99 -4.92 118.16 116.75 2di9 n LYS 33 Ca 0.10 -0.07 -0.42 0.00 -2.87 0.00 0.00 58.31 55.06 2di9 n LYS 33 Cb 0.11 -1.41 -0.04 0.00 -1.84 0.00 0.00 35.03 31.85 2di9 n LYS 33 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2di9 n VAL 34 N -2.38 0.14 -3.80 -0.18 0.31 -0.98 -4.89 118.33 106.55 2di9 n VAL 34 Ca -0.16 -0.53 -0.36 0.00 -0.01 0.00 0.00 64.34 63.27 2di9 n VAL 34 Cb 0.78 -2.38 -0.11 0.00 -0.91 0.00 0.00 33.84 31.22 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 7.21 3.81 -0.25 5.55 1.02 -1.13 -4.83 119.74 131.12 2di9 s LYS 35 Ca 1.03 -0.41 -0.05 0.00 0.02 0.00 0.00 55.97 56.57 2di9 s LYS 35 Cb -0.42 -3.36 -0.00 0.00 -0.52 0.00 0.00 37.83 33.52 2di9 s LYS 35 CO 0.35 -0.06 0.02 0.00 -0.92 0.00 0.00 175.35 174.74 2di9 s ALA 36 N 1.30 2.95 -0.07 5.17 0.00 -1.26 -1.53 121.76 128.32 2di9 s ALA 36 Ca 0.05 -1.28 -0.03 0.00 0.00 0.00 0.00 51.96 50.70 2di9 s ALA 36 Cb -0.15 -1.92 0.04 0.00 0.00 0.00 0.00 23.12 21.10 2di9 s ALA 36 CO 0.04 -0.63 0.16 -3.38 0.00 0.00 0.00 175.76 171.95 2di9 s HIS 37 N 1.50 -0.19 0.00 0.00 -3.43 -0.76 -5.03 115.29 107.38 2di9 s HIS 37 Ca 0.04 0.53 0.00 0.00 -0.80 0.00 0.00 55.06 54.84 2di9 s HIS 37 Cb -0.16 -0.09 0.00 0.00 -1.43 0.00 0.00 32.58 30.91 2di9 s HIS 37 CO -0.00 -0.19 0.00 0.41 -2.00 0.00 0.00 174.74 172.96 2di9 n GLY 38 N 4.32 0.04 0.17 -1.38 0.00 -1.26 -1.32 105.19 105.75 2di9 n GLY 38 Ca -0.24 -0.98 0.01 0.00 0.00 0.00 0.00 46.02 44.81 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 0.00 0.00 1.61 0.13 -1.90 -2.82 132.00 129.02 2di9 h PRO 39 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2di9 h PRO 39 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2di9 h PRO 39 CO 0.00 0.47 0.00 0.78 -0.23 0.00 0.00 178.00 179.02 2di9 h GLY 40 N 1.48 0.00 0.18 1.56 0.00 -1.43 -2.36 103.07 102.49 2di9 h GLY 40 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 2di9 h GLY 40 CO 0.06 0.00 -0.61 1.41 0.00 0.00 0.00 176.54 177.40 2di9 h LEU 41 N 0.00 0.12 -1.40 3.11 3.38 -1.76 -3.34 115.31 115.42 2di9 h LEU 41 Ca 0.00 -0.86 -0.06 0.00 0.09 0.00 0.00 57.88 57.05 2di9 h LEU 41 Cb 0.42 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2di9 h LEU 41 CO 0.00 1.26 -0.30 1.05 0.09 0.00 0.00 178.44 180.54 2di9 h GLU 42 N -0.81 0.00 0.00 1.13 4.11 -1.56 -3.20 114.58 114.24 2di9 h GLU 42 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.29 2di9 h GLU 42 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2di9 h GLU 42 CO -0.02 0.30 0.00 0.41 0.07 0.00 0.00 179.01 179.77 2di9 n GLY 43 N -0.64 -1.02 0.00 1.06 0.00 -0.90 -1.99 105.19 101.70 2di9 n GLY 43 Ca -0.02 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.69 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 2.16 3.04 -0.02 0.00 -0.82 -3.88 105.19 105.68 2di9 n GLY 44 Ca 0.00 -0.19 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 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 1.90 0.46 0.99 1.43 -1.26 -1.38 118.68 120.83 2di9 s LEU 45 Ca 0.00 -0.35 -0.24 0.00 -1.03 0.00 0.00 54.13 52.51 2di9 s LEU 45 Cb 0.00 0.38 -0.07 0.00 0.03 0.00 0.00 46.19 46.53 2di9 s LEU 45 CO 0.00 -0.33 1.33 -0.69 0.23 0.00 0.00 176.35 176.89 2di9 s VAL 46 N -1.40 2.40 -1.51 -1.59 1.01 -1.11 -2.18 120.40 116.02 2di9 s VAL 46 Ca -0.15 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.16 2di9 s VAL 46 Cb -0.09 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.11 2di9 s VAL 46 CO 0.00 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.74 2di9 n GLY 47 N 0.63 1.35 3.29 4.51 0.00 -0.95 -4.74 105.19 109.28 2di9 n GLY 47 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.16 1.40 0.30 1.61 1.02 -0.93 -5.01 119.74 114.97 2di9 s LYS 48 Ca 0.00 -1.05 -0.29 0.00 0.02 0.00 0.00 55.97 54.65 2di9 s LYS 48 Cb 0.00 -1.59 -0.10 0.00 -0.52 0.00 0.00 37.83 35.62 2di9 s LYS 48 CO 0.00 0.40 1.24 -1.25 -0.92 0.00 0.00 175.35 174.81 2di9 s PRO 49 N -1.42 4.46 -0.16 -1.68 0.04 -1.26 -4.33 135.00 130.64 2di9 s PRO 49 Ca 0.08 2.06 -0.04 0.00 0.04 0.00 0.00 61.00 63.14 2di9 s PRO 49 Cb -0.09 -3.13 0.08 0.00 0.04 0.00 0.00 34.50 31.40 2di9 s PRO 49 CO 0.03 -0.06 0.24 0.00 0.04 0.00 0.00 177.00 177.24 2di9 s ALA 50 N -0.97 -0.41 0.37 8.56 0.00 -0.66 -4.86 121.76 123.79 2di9 s ALA 50 Ca 0.48 0.59 0.04 0.00 0.00 0.00 0.00 51.96 53.07 2di9 s ALA 50 Cb -0.37 -1.16 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 2di9 s ALA 50 CO 0.47 -0.91 0.09 -1.83 0.00 0.00 0.00 175.76 173.58 2di9 s GLU 51 N 2.37 1.78 0.33 0.00 -1.05 -1.25 -1.07 118.70 119.81 2di9 s GLU 51 Ca 0.05 -2.04 -0.00 0.00 -0.15 0.00 0.00 54.97 52.82 2di9 s GLU 51 Cb -0.14 -0.77 -0.01 0.00 -0.44 0.00 0.00 34.13 32.78 2di9 s GLU 51 CO -0.10 -0.32 0.41 -0.59 0.95 0.00 0.00 175.26 175.61 2di9 s PHE 52 N -3.26 1.21 -0.19 4.83 -0.12 -1.17 -1.67 117.98 117.62 2di9 s PHE 52 Ca 0.30 -1.37 -0.04 0.00 -0.05 0.00 0.00 56.93 55.77 2di9 s PHE 52 Cb 0.06 -0.25 -0.02 0.00 -0.63 0.00 0.00 43.02 42.18 2di9 s PHE 52 CO 0.14 -1.04 -0.03 0.99 -0.05 0.00 0.00 175.22 175.23 2di9 s THR 53 N -3.23 3.72 -0.13 -4.49 2.01 -0.44 -4.03 115.64 109.06 2di9 s THR 53 Ca 0.33 -0.40 -0.01 0.00 0.31 0.00 0.00 61.69 61.92 2di9 s THR 53 Cb 0.01 -2.66 -0.02 0.00 0.01 0.00 0.00 72.50 69.83 2di9 s THR 53 CO 0.21 0.45 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.86 2di9 s ILE 54 N 0.90 3.34 -0.35 1.82 1.01 -1.14 -1.84 121.20 124.94 2di9 s ILE 54 Ca -0.00 -0.56 -0.10 0.00 0.00 0.00 0.00 60.65 59.99 2di9 s ILE 54 Cb -0.14 -2.42 0.02 0.00 0.01 0.00 0.00 42.46 39.93 2di9 s ILE 54 CO 0.01 0.52 0.18 -0.62 0.00 0.00 0.00 174.94 175.03 2di9 s ASP 55 N 0.23 5.62 -0.24 3.58 -1.08 -0.58 -3.28 116.67 120.92 2di9 s ASP 55 Ca -0.07 -0.89 0.10 0.00 -0.52 0.00 0.00 52.55 51.18 2di9 s ASP 55 Cb -0.15 -2.00 0.45 0.00 -1.46 0.00 0.00 42.92 39.76 2di9 s ASP 55 CO 0.04 -0.33 1.29 0.35 0.52 0.00 0.00 175.17 177.05 2di9 n THR 56 N 4.97 2.32 -2.75 1.71 -2.24 -1.26 -2.85 114.28 114.19 2di9 n THR 56 Ca -0.12 -3.17 -0.43 0.00 -2.27 0.00 0.00 64.05 58.06 2di9 n THR 56 Cb 0.47 -0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 68.36 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 -3.26 3.78 0.00 -0.78 1.02 -1.26 -3.68 119.74 115.55 2di9 s LYS 57 Ca 0.40 0.54 0.00 0.00 0.02 0.00 0.00 55.97 56.94 2di9 s LYS 57 Cb 0.38 -3.84 0.00 0.00 -0.52 0.00 0.00 37.83 33.85 2di9 s LYS 57 CO -0.05 -1.09 0.00 0.41 -0.92 0.00 0.00 175.35 173.70 2di9 n GLY 58 N 4.54 2.79 0.35 -3.33 0.00 -1.26 -4.93 105.19 103.35 2di9 n GLY 58 Ca 0.08 -0.48 -0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 0.00 -0.07 0.00 4.61 0.00 -1.24 -4.81 120.51 119.00 2di9 n ALA 59 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 53.44 54.37 2di9 n ALA 59 Cb 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.02 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 -1.45 0.47 3.52 0.00 0.00 -1.26 0.04 105.19 106.51 2di9 n GLY 60 Ca 0.10 -0.67 -0.06 0.00 0.00 0.00 0.00 46.02 45.40 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 0.00 -0.48 -0.04 2.61 2.01 -1.24 -4.96 115.64 113.53 2di9 s THR 61 Ca 0.00 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.04 2di9 s THR 61 Cb 0.00 -0.88 0.00 0.00 0.01 0.00 0.00 72.50 71.63 2di9 s THR 61 CO 0.00 0.02 0.00 0.61 -0.69 0.00 0.00 174.62 174.56 2di9 n GLY 62 N 4.91 -1.00 3.40 4.40 0.00 -1.26 -4.56 105.19 111.08 2di9 n GLY 62 Ca -0.16 -0.01 -0.22 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 1.64 -0.05 -0.02 0.00 -1.26 -5.00 107.32 102.63 2di9 s GLY 63 Ca 0.00 -1.72 0.02 0.00 0.00 0.00 0.00 44.72 43.02 2di9 s GLY 63 CO 0.00 -1.79 -0.07 -2.27 0.00 0.00 0.00 173.10 168.96 2di9 s LEU 64 N -3.20 1.51 -0.20 0.66 2.96 -1.26 -0.22 118.68 118.93 2di9 s LEU 64 Ca 0.24 -0.18 -0.06 0.00 -0.22 0.00 0.00 54.13 53.91 2di9 s LEU 64 Cb -0.04 -0.56 -0.03 0.00 0.50 0.00 0.00 46.19 46.05 2di9 s LEU 64 CO 0.10 -0.01 0.03 -0.83 -1.32 0.00 0.00 176.35 174.33 2di9 s GLY 65 N 0.69 1.79 -0.21 7.98 0.00 0.12 -4.98 107.32 112.72 2di9 s GLY 65 Ca -0.11 -0.93 0.01 0.00 0.00 0.00 0.00 44.72 43.69 2di9 s GLY 65 CO 0.01 0.22 -0.12 -2.27 0.00 0.00 0.00 173.10 170.95 2di9 s LEU 66 N 0.90 2.48 -0.06 0.66 2.96 -1.25 -2.50 118.68 121.86 2di9 s LEU 66 Ca 0.02 -0.96 0.00 0.00 -0.22 0.00 0.00 54.13 52.98 2di9 s LEU 66 Cb -0.14 -1.32 0.02 0.00 0.50 0.00 0.00 46.19 45.25 2di9 s LEU 66 CO 0.02 -0.14 -0.04 0.42 -1.32 0.00 0.00 176.35 175.30 2di9 s THR 67 N 1.33 0.55 -0.61 3.68 -4.23 -1.12 -4.96 115.64 110.27 2di9 s THR 67 Ca -0.02 -0.09 -0.23 0.00 -1.18 0.00 0.00 61.69 60.17 2di9 s THR 67 Cb -0.17 -0.60 0.06 0.00 1.34 0.00 0.00 72.50 73.13 2di9 s THR 67 CO -0.08 0.25 0.95 -0.69 -0.54 0.00 0.00 174.62 174.51 2di9 s VAL 68 N 1.22 4.35 -1.11 2.29 1.01 -1.26 -1.12 120.40 125.78 2di9 s VAL 68 Ca -0.06 -0.08 -0.14 0.00 0.00 0.00 0.00 61.98 61.70 2di9 s VAL 68 Cb -0.14 -4.62 0.19 0.00 0.00 0.00 0.00 36.38 31.81 2di9 s VAL 68 CO -0.02 -1.30 1.27 -1.61 0.00 0.00 0.00 175.10 173.44 2di9 s GLU 69 N 4.01 3.98 0.00 2.72 0.41 0.11 -4.73 118.70 125.20 2di9 s GLU 69 Ca 0.26 -2.53 0.00 0.00 -0.41 0.00 0.00 54.97 52.28 2di9 s GLU 69 Cb -0.15 -4.90 0.00 0.00 -1.78 0.00 0.00 34.13 27.30 2di9 s GLU 69 CO 0.14 -1.64 0.00 0.41 -0.49 0.00 0.00 175.26 173.68 2di9 n GLY 70 N 4.11 5.57 0.00 -1.39 0.00 -1.26 -3.27 105.19 108.95 2di9 n GLY 70 Ca 0.30 -1.93 0.07 0.00 0.00 0.00 0.00 46.02 44.46 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 0.00 0.04 -3.62 1.61 -0.04 -1.26 -4.78 135.00 126.95 2di9 n PRO 71 Ca 0.00 0.23 -0.11 0.00 -0.04 0.00 0.00 63.50 63.59 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 -3.81 3.18 -0.02 0.00 2.12 -1.26 -4.92 118.70 113.99 2di9 s GLU 73 Ca 0.04 -0.51 -0.15 0.00 0.36 0.00 0.00 54.97 54.70 2di9 s GLU 73 Cb 0.01 -4.18 -0.05 0.00 0.26 0.00 0.00 34.13 30.16 2di9 s GLU 73 CO -0.10 -1.88 0.41 0.00 -0.54 0.00 0.00 175.26 173.14 2di9 s ALA 74 N 4.66 3.67 0.63 6.30 0.00 -1.26 -4.94 121.76 130.82 2di9 s ALA 74 Ca 0.28 -0.22 -0.19 0.00 0.00 0.00 0.00 51.96 51.83 2di9 s ALA 74 Cb -0.13 -2.42 -0.02 0.00 0.00 0.00 0.00 23.12 20.55 2di9 s ALA 74 CO 0.14 0.40 1.30 0.21 0.00 0.00 0.00 175.76 177.81 2di9 s LYS 75 N -0.80 2.66 -0.11 0.00 2.47 -1.24 -4.83 119.74 117.89 2di9 s LYS 75 Ca 0.24 2.08 -0.02 0.00 -1.56 0.00 0.00 55.97 56.71 2di9 s LYS 75 Cb -0.16 -1.91 0.04 0.00 -1.46 0.00 0.00 37.83 34.33 2di9 s LYS 75 CO 0.13 -1.52 -0.01 0.42 0.16 0.00 0.00 175.35 174.53 2di9 s ILE 76 N -1.39 0.56 -0.40 5.43 1.01 -1.26 -2.54 121.20 122.61 2di9 s ILE 76 Ca 0.81 -0.16 -0.08 0.00 0.00 0.00 0.00 60.65 61.22 2di9 s ILE 76 Cb -0.38 -0.78 0.07 0.00 0.01 0.00 0.00 42.46 41.38 2di9 s ILE 76 CO 0.41 0.15 0.22 -0.70 0.00 0.00 0.00 174.94 175.01 2di9 s GLU 77 N 1.88 2.54 -0.32 2.79 2.56 0.79 -4.96 118.70 123.97 2di9 s GLU 77 Ca 0.03 -1.44 -0.12 0.00 0.00 0.00 0.00 54.97 53.45 2di9 s GLU 77 Cb -0.14 -3.68 -0.02 0.00 2.00 0.00 0.00 34.13 32.29 2di9 s GLU 77 CO -0.07 -0.90 0.21 0.00 -0.56 0.00 0.00 175.26 173.94 2di9 s SER 79 N 1.71 0.88 0.59 0.00 0.15 -1.22 -5.00 113.70 110.81 2di9 s SER 79 Ca 0.06 -0.12 -0.16 0.00 0.70 0.00 0.00 55.95 56.42 2di9 s SER 79 Cb -0.17 -0.36 -0.04 0.00 -1.71 0.00 0.00 66.02 63.74 2di9 s SER 79 CO 0.10 -0.02 1.06 -0.62 1.20 0.00 0.00 173.24 174.96 2di9 s ASP 80 N 0.66 5.79 -0.12 5.45 -1.08 -1.26 -1.21 116.67 124.90 2di9 s ASP 80 Ca -0.09 1.85 -0.14 0.00 -0.52 0.00 0.00 52.55 53.65 2di9 s ASP 80 Cb -0.12 -2.54 -0.26 0.00 -1.46 0.00 0.00 42.92 38.54 2di9 s ASP 80 CO 0.00 -1.16 0.46 0.78 0.52 0.00 0.00 175.17 175.77 2di9 h ASN 81 N 0.53 0.34 0.00 -0.34 2.35 -1.84 -3.45 115.58 113.17 2di9 h ASN 81 Ca -0.47 -0.83 0.00 0.00 -0.55 0.00 0.00 56.30 54.45 2di9 h ASN 81 Cb 1.22 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.48 2di9 h ASN 81 CO 0.57 1.67 0.00 0.61 -1.65 0.00 0.00 177.43 178.63 2di9 n GLY 82 N 1.76 2.35 0.05 2.83 0.00 -1.26 -4.92 105.19 106.00 2di9 n GLY 82 Ca -0.28 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.86 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 0.56 0.00 1.61 -0.08 -1.26 -4.92 116.55 112.46 2di9 n ASP 83 Ca 0.00 -0.06 0.00 0.00 -1.51 0.00 0.00 54.79 53.22 2di9 n ASP 83 Cb 0.00 0.93 0.00 0.00 2.34 0.00 0.00 41.12 44.39 2di9 n ASP 83 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2di9 n GLY 84 N 1.31 1.04 2.33 0.27 0.00 -1.26 -5.12 105.19 103.76 2di9 n GLY 84 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 2di9 n GLY 84 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2di9 n THR 85 N 0.00 0.00 -3.75 2.61 -2.24 -1.26 -4.01 114.28 105.64 2di9 n THR 85 Ca 0.00 -1.70 -0.14 0.00 -2.27 0.00 0.00 64.05 59.93 2di9 n THR 85 Cb 0.00 0.71 -0.15 0.00 -2.10 0.00 0.00 70.33 68.80 2di9 n THR 85 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2di9 s SER 87 N 1.25 5.09 -0.02 0.00 0.01 -0.35 -2.90 113.70 116.79 2di9 s SER 87 Ca -0.08 -2.72 -0.18 0.00 1.31 0.00 0.00 55.95 54.28 2di9 s SER 87 Cb -0.12 -1.81 -0.05 0.00 0.21 0.00 0.00 66.02 64.24 2di9 s SER 87 CO -0.05 -0.38 0.51 -0.69 0.41 0.00 0.00 173.24 173.04 2di9 s VAL 88 N 0.14 4.98 -0.10 3.43 1.01 -1.26 -3.41 120.40 125.19 2di9 s VAL 88 Ca 0.15 1.05 0.03 0.00 0.00 0.00 0.00 61.98 63.21 2di9 s VAL 88 Cb -0.21 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.34 2di9 s VAL 88 CO -0.03 0.46 -0.18 -0.94 0.00 0.00 0.00 175.10 174.41 2di9 s SER 89 N -0.39 2.59 0.23 3.32 1.04 0.80 -3.02 113.70 118.28 2di9 s SER 89 Ca 0.27 -0.47 0.11 0.00 0.48 0.00 0.00 55.95 56.35 2di9 s SER 89 Cb -0.17 -1.18 -0.05 0.00 0.10 0.00 0.00 66.02 64.72 2di9 s SER 89 CO 0.15 0.07 -0.17 -0.72 0.98 0.00 0.00 173.24 173.55 2di9 s TYR 90 N 0.70 2.41 -0.27 5.02 -0.85 -0.23 -0.15 117.35 123.97 2di9 s TYR 90 Ca -0.12 -0.31 -0.01 0.00 -0.52 0.00 0.00 57.07 56.11 2di9 s TYR 90 Cb -0.16 -1.13 0.08 0.00 0.38 0.00 0.00 41.96 41.14 2di9 s TYR 90 CO 0.03 0.59 0.06 -0.51 -1.52 0.00 0.00 175.55 174.19 2di9 s LEU 91 N -3.08 2.14 0.81 -3.49 1.43 -1.05 -1.66 118.68 113.78 2di9 s LEU 91 Ca 0.26 -1.40 -0.11 0.00 -1.03 0.00 0.00 54.13 51.85 2di9 s LEU 91 Cb -0.07 -0.88 0.08 0.00 0.03 0.00 0.00 46.19 45.35 2di9 s LEU 91 CO 0.14 -0.36 1.09 -2.16 0.23 0.00 0.00 176.35 175.29 2di9 s PRO 92 N 1.61 1.94 -0.15 1.29 0.04 -1.26 -3.62 135.00 134.85 2di9 s PRO 92 Ca 0.05 1.06 -0.01 0.00 0.04 0.00 0.00 61.00 62.14 2di9 s PRO 92 Cb -0.17 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 32.41 2di9 s PRO 92 CO -0.18 -1.84 -0.15 0.25 0.04 0.00 0.00 177.00 175.13 2di9 n THR 93 N -3.64 0.84 -4.33 1.26 -2.24 -1.26 -2.23 114.28 102.68 2di9 n THR 93 Ca 0.08 -0.30 -0.22 0.00 -2.27 0.00 0.00 64.05 61.35 2di9 n THR 93 Cb 0.54 -1.18 -0.13 0.00 -2.10 0.00 0.00 70.33 67.46 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 -2.29 1.03 0.02 -0.78 1.02 -1.26 -4.60 119.74 112.88 2di9 s LYS 94 Ca -0.20 -0.95 -0.30 0.00 0.02 0.00 0.00 55.97 54.53 2di9 s LYS 94 Cb 0.06 -1.13 -0.06 0.00 -0.52 0.00 0.00 37.83 36.18 2di9 s LYS 94 CO 0.32 0.27 1.43 -1.25 -0.92 0.00 0.00 175.35 175.20 2di9 s PRO 95 N -1.52 4.28 0.00 -1.68 0.04 -1.26 -4.79 135.00 130.07 2di9 s PRO 95 Ca 0.03 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.09 2di9 s PRO 95 Cb -0.09 -3.54 0.00 0.00 0.04 0.00 0.00 34.50 30.91 2di9 s PRO 95 CO 0.02 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 176.89 2di9 n GLY 96 N 3.67 -0.75 3.03 0.56 0.00 -1.24 -5.02 105.19 105.43 2di9 n GLY 96 Ca 0.13 0.65 -0.13 0.00 0.00 0.00 0.00 46.02 46.68 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 2.38 0.18 -0.28 1.61 2.02 -1.26 -3.07 118.70 120.28 2di9 s GLU 97 Ca 0.00 0.61 -0.02 0.00 0.02 0.00 0.00 54.97 55.58 2di9 s GLU 97 Cb 0.00 -0.10 0.03 0.00 0.10 0.00 0.00 34.13 34.17 2di9 s GLU 97 CO 0.00 -0.21 -0.02 0.71 0.02 0.00 0.00 175.26 175.76 2di9 s TYR 98 N 1.73 3.17 -0.46 1.61 1.51 -1.14 -4.23 117.35 119.53 2di9 s TYR 98 Ca -0.05 -1.63 -0.23 0.00 -1.01 0.00 0.00 57.07 54.16 2di9 s TYR 98 Cb -0.11 -2.11 0.03 0.00 -0.11 0.00 0.00 41.96 39.66 2di9 s TYR 98 CO -0.08 -0.75 0.77 -0.06 -1.11 0.00 0.00 175.55 174.32 2di9 s PHE 99 N 1.31 2.98 -0.58 2.71 0.08 -1.20 -2.84 117.98 120.44 2di9 s PHE 99 Ca -0.02 0.07 -0.25 0.00 0.12 0.00 0.00 56.93 56.85 2di9 s PHE 99 Cb -0.18 -3.66 0.04 0.00 -0.57 0.00 0.00 43.02 38.65 2di9 s PHE 99 CO -0.02 -1.02 1.02 0.08 -0.10 0.00 0.00 175.22 175.18 2di9 s VAL 100 N 3.26 4.27 -0.57 -0.44 1.01 -1.21 -0.71 120.40 126.00 2di9 s VAL 100 Ca 0.28 0.37 -0.28 0.00 0.00 0.00 0.00 61.98 62.34 2di9 s VAL 100 Cb -0.13 -4.61 0.03 0.00 0.00 0.00 0.00 36.38 31.67 2di9 s VAL 100 CO 0.21 -1.23 1.22 0.20 0.00 0.00 0.00 175.10 175.50 2di9 s ASN 101 N 2.99 6.42 -0.33 3.32 0.01 -0.28 -2.43 114.94 124.64 2di9 s ASN 101 Ca 0.33 0.15 -0.08 0.00 -0.71 0.00 0.00 52.86 52.55 2di9 s ASN 101 Cb -0.12 -2.55 0.03 0.00 0.41 0.00 0.00 41.25 39.02 2di9 s ASN 101 CO 0.20 -1.50 0.12 -0.63 -1.51 0.00 0.00 177.10 173.78 2di9 s ILE 102 N 5.07 4.04 -0.04 0.60 1.01 -1.26 -2.81 121.20 127.80 2di9 s ILE 102 Ca 0.45 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 60.20 2di9 s ILE 102 Cb -0.08 -3.21 0.02 0.00 0.01 0.00 0.00 42.46 39.20 2di9 s ILE 102 CO 0.26 -0.10 -0.07 -1.48 0.00 0.00 0.00 174.94 173.54 2di9 s LEU 103 N 1.47 1.52 -0.35 2.97 0.05 -1.04 -1.51 118.68 121.80 2di9 s LEU 103 Ca 0.01 -0.18 -0.12 0.00 0.05 0.00 0.00 54.13 53.89 2di9 s LEU 103 Cb -0.19 -0.56 -0.00 0.00 -2.05 0.00 0.00 46.19 43.40 2di9 s LEU 103 CO 0.04 -0.00 0.21 0.12 -0.55 0.00 0.00 176.35 176.16 2di9 s PHE 104 N 0.67 3.22 -1.22 3.48 5.36 0.17 -0.70 117.98 128.95 2di9 s PHE 104 Ca -0.11 -0.53 -0.06 0.00 -0.96 0.00 0.00 56.93 55.27 2di9 s PHE 104 Cb -0.13 -2.44 0.01 0.00 -0.34 0.00 0.00 43.02 40.11 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 5.05 -7.12 -1.98 10.12 1.02 0.69 -1.99 120.64 126.44 2di9 n GLU 105 Ca -0.13 0.77 -0.09 0.00 -0.02 0.00 0.00 57.16 57.70 2di9 n GLU 105 Cb 0.48 -5.64 -0.01 0.00 -0.02 0.00 0.00 31.44 26.26 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 -0.68 -3.87 3.49 1.02 -1.26 -5.01 120.64 109.83 2di9 n GLU 106 Ca -0.06 0.50 -0.28 0.00 -0.02 0.00 0.00 57.16 57.30 2di9 n GLU 106 Cb 0.58 -4.46 -0.16 0.00 -0.02 0.00 0.00 31.44 27.38 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 -2.41 1.03 0.01 2.62 1.01 -0.84 -5.10 120.40 116.71 2di9 s VAL 107 Ca 0.00 -0.65 -0.30 0.00 0.00 0.00 0.00 61.98 61.03 2di9 s VAL 107 Cb 0.00 -1.27 -0.07 0.00 0.00 0.00 0.00 36.38 35.04 2di9 s VAL 107 CO 0.00 0.05 1.79 -1.00 0.00 0.00 0.00 175.10 175.95 2di9 s HIS 108 N 1.66 1.75 0.59 5.22 3.76 -1.26 0.44 115.29 127.45 2di9 s HIS 108 Ca -0.00 -0.07 -0.17 0.00 -0.15 0.00 0.00 55.06 54.66 2di9 s HIS 108 Cb -0.16 -4.07 -0.03 0.00 1.11 0.00 0.00 32.58 29.43 2di9 s HIS 108 CO -0.07 -4.61 1.12 0.96 -0.85 0.00 0.00 174.74 171.28 2di9 s ILE 109 N 3.99 3.23 -1.07 0.60 -4.36 -0.57 -4.90 121.20 118.13 2di9 s ILE 109 Ca 0.80 0.68 -0.23 0.00 -0.26 0.00 0.00 60.65 61.63 2di9 s ILE 109 Cb -0.38 -3.22 -0.07 0.00 1.25 0.00 0.00 42.46 40.04 2di9 s ILE 109 CO 0.35 -0.25 1.94 -2.16 0.24 0.00 0.00 174.94 175.06 2di9 s PRO 110 N -3.65 2.52 0.00 0.37 0.04 -1.26 -2.42 135.00 130.59 2di9 s PRO 110 Ca 0.70 -0.80 0.00 0.00 0.04 0.00 0.00 61.00 60.94 2di9 s PRO 110 Cb -0.22 -5.17 0.00 0.00 0.04 0.00 0.00 34.50 29.15 2di9 s PRO 110 CO 0.33 -3.74 0.00 0.41 0.04 0.00 0.00 177.00 174.05 2di9 n GLY 111 N 6.25 0.17 3.81 0.56 0.00 -1.26 -5.04 105.19 109.68 2di9 n GLY 111 Ca 0.43 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.19 2di9 n GLY 111 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2di9 s SER 112 N 0.00 5.58 0.68 1.61 0.15 -1.02 -3.97 113.70 116.74 2di9 s SER 112 Ca 0.00 -0.11 -0.14 0.00 0.70 0.00 0.00 55.95 56.40 2di9 s SER 112 Cb 0.00 -1.47 0.01 0.00 -1.71 0.00 0.00 66.02 62.85 2di9 s SER 112 CO 0.00 0.07 1.11 -2.16 1.20 0.00 0.00 173.24 173.45 2di9 s PRO 113 N -3.12 2.69 -0.48 5.44 0.04 -1.26 -4.85 135.00 133.46 2di9 s PRO 113 Ca 0.31 1.34 -0.15 0.00 0.04 0.00 0.00 61.00 62.54 2di9 s PRO 113 Cb -0.10 -1.94 0.08 0.00 0.04 0.00 0.00 34.50 32.58 2di9 s PRO 113 CO 0.24 -1.33 0.40 -0.06 0.04 0.00 0.00 177.00 176.29 2di9 s PHE 114 N -2.46 3.25 0.01 0.56 0.40 -1.02 -4.81 117.98 113.90 2di9 s PHE 114 Ca 0.66 -0.96 -0.30 0.00 -0.60 0.00 0.00 56.93 55.73 2di9 s PHE 114 Cb -0.20 -3.22 -0.08 0.00 0.51 0.00 0.00 43.02 40.04 2di9 s PHE 114 CO 0.45 -0.81 1.86 0.21 0.70 0.00 0.00 175.22 177.62 2di9 s LYS 115 N 1.64 4.16 -0.25 0.44 2.20 -1.26 -3.35 119.74 123.30 2di9 s LYS 115 Ca 0.04 2.47 0.01 0.00 -0.36 0.00 0.00 55.97 58.13 2di9 s LYS 115 Cb -0.25 -4.09 0.05 0.00 -1.51 0.00 0.00 37.83 32.03 2di9 s LYS 115 CO 0.06 -0.91 -0.10 0.00 -0.36 0.00 0.00 175.35 174.04 2di9 s ALA 116 N 4.27 2.60 -0.35 3.13 0.00 -1.13 -4.54 121.76 125.74 2di9 s ALA 116 Ca 0.83 -1.62 -0.29 0.00 0.00 0.00 0.00 51.96 50.88 2di9 s ALA 116 Cb -0.40 -1.60 0.01 0.00 0.00 0.00 0.00 23.12 21.13 2di9 s ALA 116 CO 0.37 -1.00 1.19 -0.51 0.00 0.00 0.00 175.76 175.81 2di9 s ASP 117 N 1.20 6.74 -0.24 0.00 1.01 -0.84 -2.89 116.67 121.65 2di9 s ASP 117 Ca -0.04 0.97 -0.12 0.00 0.71 0.00 0.00 52.55 54.07 2di9 s ASP 117 Cb -0.18 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.16 2di9 s ASP 117 CO -0.05 -1.07 0.24 -0.63 0.21 0.00 0.00 175.17 173.86 2di9 s ILE 118 N 4.20 5.30 0.37 0.77 -1.09 -1.17 -1.94 121.20 127.64 2di9 s ILE 118 Ca 0.51 0.33 0.08 0.00 -2.23 0.00 0.00 60.65 59.34 2di9 s ILE 118 Cb -0.13 -3.57 -0.03 0.00 -1.58 0.00 0.00 42.46 37.15 2di9 s ILE 118 CO 0.23 0.30 0.32 -1.61 -1.23 0.00 0.00 174.94 172.94 2di9 s GLU 119 N 1.27 2.61 0.17 2.79 2.02 -0.48 -3.62 118.70 123.46 2di9 s GLU 119 Ca 0.11 -1.43 -0.30 0.00 0.02 0.00 0.00 54.97 53.37 2di9 s GLU 119 Cb -0.14 -2.40 -0.07 0.00 0.10 0.00 0.00 34.13 31.61 2di9 s GLU 119 CO 0.06 -0.03 0.99 -1.64 0.02 0.00 0.00 175.26 174.66 2di9 s MET 120 N -4.04 4.73 0.67 1.61 -1.94 -1.26 -2.76 119.30 116.30 2di9 s MET 120 Ca 0.44 1.53 -0.15 0.00 -1.71 0.00 0.00 55.69 55.80 2di9 s MET 120 Cb -0.04 -3.32 0.00 0.00 2.01 0.00 0.00 34.83 33.48 2di9 s MET 120 CO 0.27 0.28 1.11 -1.25 -0.01 0.00 0.00 175.02 175.42 2di9 s PRO 121 N -0.49 2.76 -0.14 2.03 0.04 -1.26 -4.95 135.00 132.98 2di9 s PRO 121 Ca 0.45 1.37 -0.29 0.00 0.04 0.00 0.00 61.00 62.57 2di9 s PRO 121 Cb -0.26 -1.95 -0.00 0.00 0.04 0.00 0.00 34.50 32.33 2di9 s PRO 121 CO 0.32 -1.28 1.02 -0.06 0.04 0.00 0.00 177.00 177.04 2di9 s PHE 122 N -2.39 3.46 -0.90 0.56 0.08 -1.26 -4.99 117.98 112.54 2di9 s PHE 122 Ca 0.66 1.55 -0.05 0.00 0.12 0.00 0.00 56.93 59.22 2di9 s PHE 122 Cb -0.20 -3.21 0.23 0.00 -0.57 0.00 0.00 43.02 39.26 2di9 s PHE 122 CO 0.43 -0.31 0.81 0.34 -0.10 0.00 0.00 175.22 176.39 2di9 s ASP 123 N 1.13 6.28 1.08 1.36 2.15 -1.26 -5.06 116.67 122.35 2di9 s ASP 123 Ca 0.47 -3.47 -0.07 0.00 0.43 0.00 0.00 52.55 49.92 2di9 s ASP 123 Cb -0.17 -2.00 0.10 0.00 -0.30 0.00 0.00 42.92 40.54 2di9 s ASP 123 CO 0.14 -0.27 0.36 -0.81 -0.17 0.00 0.00 175.17 174.41 2di9 n PRO 124 N 2.75 -1.72 -3.77 4.34 -0.04 -1.26 -5.10 135.00 130.19 2di9 n PRO 124 Ca 0.19 -0.57 -0.04 0.00 -0.04 0.00 0.00 63.50 63.05 2di9 n PRO 124 Cb 0.39 -0.53 -0.01 0.00 -0.04 0.00 0.00 33.50 33.30 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 -2.47 -0.16 -1.39 3.54 0.15 -1.26 -4.99 113.70 107.13 2di9 s SER 125 Ca 0.23 -0.46 -0.06 0.00 0.70 0.00 0.00 55.95 56.36 2di9 s SER 125 Cb -0.02 0.51 0.03 0.00 -1.71 0.00 0.00 66.02 64.84 2di9 s SER 125 CO 0.18 -0.96 0.90 -0.24 1.20 0.00 0.00 173.24 174.32 2di9 n SER 126 N -0.55 -3.31 -4.80 5.45 2.88 -1.26 -4.95 113.62 107.08 2di9 n SER 126 Ca -0.06 -0.75 -0.36 0.00 -1.33 0.00 0.00 58.87 56.38 2di9 n SER 126 Cb 0.60 -4.23 -0.06 0.00 -0.75 0.00 0.00 64.21 59.77 2di9 n SER 126 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2di9 s GLY 127 N -3.83 2.65 0.05 0.46 0.00 -1.26 -4.99 107.32 100.40 2di9 s GLY 127 Ca 0.33 0.41 -0.19 0.00 0.00 0.00 0.00 44.72 45.27 2di9 s GLY 127 CO 0.80 0.79 1.36 -0.56 0.00 0.00 0.00 173.10 175.49 2di9 h PRO 128 N 2.87 0.42 -6.28 2.90 0.13 -2.06 -3.46 132.00 126.52 2di9 h PRO 128 Ca -0.48 -0.22 -0.45 0.00 -0.87 0.00 0.00 66.00 63.98 2di9 h PRO 128 Cb 1.19 0.01 0.24 0.00 0.13 0.00 0.00 31.00 32.56 2di9 h PRO 128 CO 0.64 0.78 -1.87 0.43 -0.23 0.00 0.00 178.00 177.76 2di9 n SER 129 N -4.50 -2.70 0.12 1.44 7.64 -1.26 -4.86 113.62 109.50 2di9 n SER 129 Ca -0.06 -0.08 -0.02 0.00 1.01 0.00 0.00 58.87 59.72 2di9 n SER 129 Cb 0.38 -0.71 0.17 0.00 -1.01 0.00 0.00 64.21 63.04 2di9 n SER 129 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2di9 h SER 130 N -1.57 0.12 0.00 6.43 4.64 -2.06 -3.53 113.55 117.59 2di9 h SER 130 Ca -0.44 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 2di9 h SER 130 Cb 1.33 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2di9 h SER 130 CO 0.28 0.67 0.00 0.61 -0.87 0.00 0.00 176.83 177.52