#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 0.07 0.33 1.61 1.04 -1.26 -5.18 113.70 110.31 2di9 s SER 2 Ca 0.00 -0.56 0.09 0.00 0.48 0.00 0.00 55.95 55.96 2di9 s SER 2 Cb 0.00 0.34 -0.05 0.00 0.10 0.00 0.00 66.02 66.42 2di9 s SER 2 CO 0.00 -0.70 0.09 -0.44 0.98 0.00 0.00 173.24 173.16 2di9 s SER 3 N -2.69 4.52 -1.16 7.02 0.01 -1.26 -5.02 113.70 115.12 2di9 s SER 3 Ca 0.03 -0.82 -0.14 0.00 1.31 0.00 0.00 55.95 56.33 2di9 s SER 3 Cb 0.03 -0.68 -0.06 0.00 0.21 0.00 0.00 66.02 65.52 2di9 s SER 3 CO -0.10 -0.25 2.25 0.61 0.41 0.00 0.00 173.24 176.17 2di9 n GLY 4 N -1.06 3.54 3.90 3.44 0.00 -1.26 -4.92 105.19 108.83 2di9 n GLY 4 Ca -0.04 -1.31 -0.29 0.00 0.00 0.00 0.00 46.02 44.38 2di9 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2di9 s SER 5 N 3.59 4.09 -0.12 1.61 0.15 -1.26 -4.93 113.70 116.82 2di9 s SER 5 Ca 0.53 0.66 -0.38 0.00 0.70 0.00 0.00 55.95 57.46 2di9 s SER 5 Cb 0.14 -1.04 -0.15 0.00 -1.71 0.00 0.00 66.02 63.25 2di9 s SER 5 CO -0.01 -2.16 1.64 -1.54 1.20 0.00 0.00 173.24 172.37 2di9 n SER 6 N -3.46 2.35 0.00 5.45 3.41 -1.26 -4.67 113.62 115.43 2di9 n SER 6 Ca 0.10 1.08 0.00 0.00 -0.26 0.00 0.00 58.87 59.78 2di9 n SER 6 Cb 0.61 -1.20 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 2di9 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2di9 n GLY 7 N 3.69 2.48 3.63 5.00 0.00 -1.26 -5.11 105.19 113.62 2di9 n GLY 7 Ca 0.23 -1.94 -0.11 0.00 0.00 0.00 0.00 46.02 44.20 2di9 n GLY 7 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2di9 s ASP 8 N 0.00 -0.74 -1.21 1.61 2.15 -1.26 -5.05 116.67 112.17 2di9 s ASP 8 Ca 0.00 1.35 -0.20 0.00 0.43 0.00 0.00 52.55 54.13 2di9 s ASP 8 Cb 0.00 1.35 0.06 0.00 -0.30 0.00 0.00 42.92 44.03 2di9 s ASP 8 CO 0.00 -0.23 1.67 0.68 -0.17 0.00 0.00 175.17 177.12 2di9 s VAL 9 N 0.68 4.04 -1.04 1.11 -7.23 -1.26 -4.76 120.40 111.93 2di9 s VAL 9 Ca -0.02 -1.55 0.06 0.00 -1.81 0.00 0.00 61.98 58.66 2di9 s VAL 9 Cb -0.05 -5.12 0.06 0.00 0.56 0.00 0.00 36.38 31.82 2di9 s VAL 9 CO -0.05 -1.96 1.18 1.07 -0.31 0.00 0.00 175.10 175.03 2di9 n THR 10 N 6.60 1.52 -3.72 5.32 5.66 -1.26 -4.85 114.28 123.56 2di9 n THR 10 Ca 0.44 0.38 -0.22 0.00 -3.05 0.00 0.00 64.05 61.61 2di9 n THR 10 Cb 0.47 -1.28 0.03 0.00 -1.55 0.00 0.00 70.33 68.01 2di9 n THR 10 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 2di9 n TYR 11 N -1.48 -1.90 -0.13 1.09 4.01 -1.26 -4.92 117.16 112.57 2di9 n TYR 11 Ca 0.02 0.84 -0.25 0.00 -0.16 0.00 0.00 57.90 58.35 2di9 n TYR 11 Cb 0.07 -4.35 -0.09 0.00 -0.31 0.00 0.00 39.34 34.66 2di9 n TYR 11 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2di9 n ASP 12 N -3.05 1.94 -0.01 7.72 2.03 -1.26 -4.69 116.55 119.23 2di9 n ASP 12 Ca -0.30 0.36 -0.17 0.00 0.52 0.00 0.00 54.79 55.20 2di9 n ASP 12 Cb 0.68 -0.82 -0.13 0.00 -0.72 0.00 0.00 41.12 40.12 2di9 n ASP 12 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2di9 h GLY 13 N -1.00 0.22 -4.82 0.27 0.00 -2.01 -3.46 103.07 92.27 2di9 h GLY 13 Ca -0.52 -0.48 -0.62 0.00 0.00 0.00 0.00 47.33 45.71 2di9 h GLY 13 CO -0.32 0.42 0.39 1.42 0.00 0.00 0.00 176.54 178.46 2di9 n HIS 14 N -4.37 1.64 -1.00 5.60 8.25 -1.26 -4.96 115.22 119.12 2di9 n HIS 14 Ca -0.11 0.59 -0.27 0.00 -0.26 0.00 0.00 57.72 57.66 2di9 n HIS 14 Cb 0.63 -2.35 0.23 0.00 1.12 0.00 0.00 29.99 29.62 2di9 n HIS 14 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2di9 n PRO 15 N 1.74 -2.97 -3.00 -0.41 -0.04 -1.26 -4.99 135.00 124.08 2di9 n PRO 15 Ca 0.13 -1.59 -0.37 0.00 -0.04 0.00 0.00 63.50 61.64 2di9 n PRO 15 Cb 0.28 -1.49 -0.06 0.00 -0.04 0.00 0.00 33.50 32.19 2di9 n PRO 15 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2di9 s VAL 16 N -2.80 4.45 0.70 0.52 -7.23 -1.26 -5.05 120.40 109.73 2di9 s VAL 16 Ca 0.65 1.47 -0.13 0.00 -1.81 0.00 0.00 61.98 62.15 2di9 s VAL 16 Cb -0.06 -3.92 0.02 0.00 0.56 0.00 0.00 36.38 32.98 2di9 s VAL 16 CO 0.50 0.20 1.10 -2.16 -0.31 0.00 0.00 175.10 174.43 2di9 s PRO 17 N -1.96 2.58 -0.13 4.82 0.04 -1.26 -4.47 135.00 134.62 2di9 s PRO 17 Ca 0.45 1.30 -0.01 0.00 0.04 0.00 0.00 61.00 62.78 2di9 s PRO 17 Cb -0.18 -1.93 -0.01 0.00 0.04 0.00 0.00 34.50 32.43 2di9 s PRO 17 CO 0.22 -1.41 0.12 0.41 0.04 0.00 0.00 177.00 176.38 2di9 n GLY 18 N -0.81 0.35 0.47 0.56 0.00 -1.26 -4.90 105.19 99.60 2di9 n GLY 18 Ca 0.10 -0.15 -0.16 0.00 0.00 0.00 0.00 46.02 45.81 2di9 n GLY 18 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2di9 h SER 19 N -0.09 -1.57 0.53 1.61 0.02 -1.99 -0.53 113.55 111.53 2di9 h SER 19 Ca -0.06 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2di9 h SER 19 Cb 1.03 0.58 0.00 0.00 0.14 0.00 0.00 62.40 64.15 2di9 h SER 19 CO 0.06 -0.54 0.00 -0.81 -1.14 0.00 0.00 176.83 174.40 2di9 n PRO 20 N -5.39 0.04 -1.10 3.45 -0.04 -1.26 -3.35 135.00 127.34 2di9 n PRO 20 Ca -0.08 0.29 -0.20 0.00 -0.04 0.00 0.00 63.50 63.47 2di9 n PRO 20 Cb 0.40 -1.58 0.01 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.65 1.59 -3.67 0.54 4.01 -0.21 -4.83 117.16 112.94 2di9 n TYR 21 Ca 0.03 -1.99 -0.13 0.00 -0.16 0.00 0.00 57.90 55.65 2di9 n TYR 21 Cb 0.18 -1.12 -0.08 0.00 -0.31 0.00 0.00 39.34 38.00 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 -2.31 -0.00 -0.41 -0.72 -4.23 -1.21 -4.96 115.64 101.80 2di9 s THR 22 Ca 0.42 0.01 0.04 0.00 -1.18 0.00 0.00 61.69 60.98 2di9 s THR 22 Cb 0.30 -0.81 0.46 0.00 1.34 0.00 0.00 72.50 73.78 2di9 s THR 22 CO -0.07 0.00 1.47 0.52 -0.54 0.00 0.00 174.62 176.00 2di9 n VAL 23 N 3.00 2.87 -0.74 2.29 0.31 -1.26 -4.84 118.33 119.96 2di9 n VAL 23 Ca -0.15 -3.74 -0.08 0.00 -0.01 0.00 0.00 64.34 60.36 2di9 n VAL 23 Cb 0.56 -1.10 -0.12 0.00 -0.91 0.00 0.00 33.84 32.28 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 -0.80 1.48 -1.01 5.55 0.00 -1.26 -4.51 120.64 120.10 2di9 n GLU 24 Ca 0.49 -0.68 -0.21 0.00 0.00 0.00 0.00 57.16 56.76 2di9 n GLU 24 Cb 0.88 -1.78 0.04 0.00 0.00 0.00 0.00 31.44 30.58 2di9 n GLU 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2di9 n ALA 25 N 2.45 5.42 -3.15 -1.84 0.00 -1.26 -4.70 120.51 117.42 2di9 n ALA 25 Ca 0.29 -2.08 0.05 0.00 0.00 0.00 0.00 53.44 51.71 2di9 n ALA 25 Cb 0.69 -1.48 -0.01 0.00 0.00 0.00 0.00 19.45 18.64 2di9 n ALA 25 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2di9 s SER 26 N -0.23 -0.37 -0.07 0.00 0.01 -1.26 -5.17 113.70 106.61 2di9 s SER 26 Ca 0.39 0.19 -0.10 0.00 1.31 0.00 0.00 55.95 57.74 2di9 s SER 26 Cb 0.30 1.29 0.02 0.00 0.21 0.00 0.00 66.02 67.85 2di9 s SER 26 CO -0.01 -0.07 0.25 -0.76 0.41 0.00 0.00 173.24 173.06 2di9 s LEU 27 N 2.96 1.05 0.48 2.44 1.43 -1.26 -5.12 118.68 120.67 2di9 s LEU 27 Ca 0.03 0.36 -0.22 0.00 -1.03 0.00 0.00 54.13 53.26 2di9 s LEU 27 Cb -0.08 0.92 -0.07 0.00 0.03 0.00 0.00 46.19 46.99 2di9 s LEU 27 CO -0.12 -0.19 1.15 -2.16 0.23 0.00 0.00 176.35 175.26 2di9 s PRO 28 N -0.30 3.66 -0.14 1.29 0.04 -1.26 -3.57 135.00 134.71 2di9 s PRO 28 Ca -0.04 1.73 -0.29 0.00 0.04 0.00 0.00 61.00 62.43 2di9 s PRO 28 Cb -0.03 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 2di9 s PRO 28 CO 0.01 -0.62 1.56 -1.25 0.04 0.00 0.00 177.00 176.74 2di9 s PRO 29 N -2.85 4.04 -0.48 0.56 0.04 -1.26 -3.98 135.00 131.08 2di9 s PRO 29 Ca 0.66 1.88 -0.01 0.00 0.04 0.00 0.00 61.00 63.57 2di9 s PRO 29 Cb -0.27 -3.96 0.13 0.00 0.04 0.00 0.00 34.50 30.44 2di9 s PRO 29 CO 0.33 -0.99 0.27 0.34 0.04 0.00 0.00 177.00 176.98 2di9 s ASP 30 N 3.40 5.04 0.30 6.66 -1.08 0.40 -4.94 116.67 126.45 2di9 s ASP 30 Ca 0.69 -2.46 0.08 0.00 -0.52 0.00 0.00 52.55 50.34 2di9 s ASP 30 Cb -0.28 -1.78 0.46 0.00 -1.46 0.00 0.00 42.92 39.86 2di9 s ASP 30 CO 0.26 -0.42 1.69 1.55 0.52 0.00 0.00 175.17 178.77 2di9 h PRO 31 N 7.43 0.14 0.00 4.34 0.13 -1.88 -2.76 132.00 139.41 2di9 h PRO 31 Ca -0.07 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 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 0.68 0.59 0.00 0.77 -0.23 0.00 0.00 178.00 179.81 2di9 h SER 32 N 0.12 0.00 0.77 1.44 0.02 -1.93 -1.87 113.55 112.09 2di9 h SER 32 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2di9 h SER 32 Cb 0.89 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.43 2di9 h SER 32 CO 0.07 0.00 -0.71 0.29 -1.14 0.00 0.00 176.83 175.34 2di9 n LYS 33 N -2.91 0.29 -2.43 3.45 4.76 -1.05 -4.82 118.16 115.46 2di9 n LYS 33 Ca 0.00 0.07 -0.43 0.00 -2.87 0.00 0.00 58.31 55.08 2di9 n LYS 33 Cb 0.24 -1.66 -0.02 0.00 -1.84 0.00 0.00 35.03 31.75 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 -3.17 4.04 -0.09 -0.18 1.01 -0.70 -4.82 120.40 116.49 2di9 s VAL 34 Ca 0.06 1.10 -0.01 0.00 0.00 0.00 0.00 61.98 63.12 2di9 s VAL 34 Cb 0.14 -4.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 2di9 s VAL 34 CO 0.74 -0.75 -0.04 -0.54 0.00 0.00 0.00 175.10 174.51 2di9 s LYS 35 N 4.62 3.02 -0.27 2.72 1.02 -1.18 -4.68 119.74 124.98 2di9 s LYS 35 Ca 0.57 -0.50 -0.00 0.00 0.02 0.00 0.00 55.97 56.05 2di9 s LYS 35 Cb -0.13 -2.72 0.05 0.00 -0.52 0.00 0.00 37.83 34.51 2di9 s LYS 35 CO 0.30 0.58 -0.05 0.00 -0.92 0.00 0.00 175.35 175.26 2di9 s ALA 36 N -0.58 2.70 -0.01 5.17 0.00 -1.26 -0.95 121.76 126.83 2di9 s ALA 36 Ca 0.09 -1.68 0.01 0.00 0.00 0.00 0.00 51.96 50.38 2di9 s ALA 36 Cb -0.12 -1.76 0.00 0.00 0.00 0.00 0.00 23.12 21.25 2di9 s ALA 36 CO 0.02 -1.12 -0.01 -3.38 0.00 0.00 0.00 175.76 171.27 2di9 s HIS 37 N 1.23 0.19 0.00 0.00 -3.43 -0.32 -5.01 115.29 107.94 2di9 s HIS 37 Ca -0.05 -0.02 0.00 0.00 -0.80 0.00 0.00 55.06 54.19 2di9 s HIS 37 Cb -0.19 -0.16 0.00 0.00 -1.43 0.00 0.00 32.58 30.80 2di9 s HIS 37 CO -0.03 -0.02 0.00 0.41 -2.00 0.00 0.00 174.74 173.09 2di9 n GLY 38 N 3.24 -0.16 0.14 -1.38 0.00 -1.26 -0.47 105.19 105.29 2di9 n GLY 38 Ca -0.15 -1.24 -0.13 0.00 0.00 0.00 0.00 46.02 44.50 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 0.40 -0.28 1.61 0.13 -1.91 -3.07 132.00 128.89 2di9 h PRO 39 Ca 0.00 -0.21 0.08 0.00 -0.87 0.00 0.00 66.00 65.00 2di9 h PRO 39 Cb 0.00 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.13 2di9 h PRO 39 CO 0.00 0.77 0.59 0.78 -0.23 0.00 0.00 178.00 179.91 2di9 h GLY 40 N 0.04 0.00 1.31 1.56 0.00 -1.55 0.42 103.07 104.85 2di9 h GLY 40 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.03 2di9 h GLY 40 CO 0.04 0.00 -1.46 1.41 0.00 0.00 0.00 176.54 176.53 2di9 h LEU 41 N 0.00 0.71 -0.03 3.11 3.38 -1.81 -3.34 115.31 117.34 2di9 h LEU 41 Ca 0.13 -0.79 -0.26 0.00 0.09 0.00 0.00 57.88 57.05 2di9 h LEU 41 Cb 1.31 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 41.84 2di9 h LEU 41 CO -0.00 1.63 -1.08 -0.33 0.09 0.00 0.00 178.44 178.74 2di9 h GLU 42 N 0.12 0.49 0.00 1.13 5.08 -0.35 -3.21 114.58 117.84 2di9 h GLU 42 Ca -0.24 -0.60 0.00 0.00 -1.00 0.00 0.00 59.36 57.52 2di9 h GLU 42 Cb 2.12 0.19 0.00 0.00 0.50 0.00 0.00 28.75 31.55 2di9 h GLU 42 CO 0.25 1.23 0.00 0.41 -1.00 0.00 0.00 179.01 179.90 2di9 n GLY 43 N 1.16 -0.67 0.00 -3.84 0.00 0.30 -2.05 105.19 100.09 2di9 n GLY 43 Ca -0.09 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.31 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 -0.95 1.22 3.27 -0.02 0.00 -1.21 -4.19 105.19 103.31 2di9 n GLY 44 Ca 0.00 0.39 -0.14 0.00 0.00 0.00 0.00 46.02 46.27 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 0.65 0.43 0.99 1.43 -1.26 -3.27 118.68 117.65 2di9 s LEU 45 Ca 0.00 0.28 -0.26 0.00 -1.03 0.00 0.00 54.13 53.12 2di9 s LEU 45 Cb 0.00 1.39 -0.09 0.00 0.03 0.00 0.00 46.19 47.53 2di9 s LEU 45 CO 0.00 -0.40 1.39 -0.69 0.23 0.00 0.00 176.35 176.88 2di9 s VAL 46 N -1.02 2.24 -0.78 -1.59 1.01 -0.95 -1.89 120.40 117.42 2di9 s VAL 46 Ca -0.11 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.09 2di9 s VAL 46 Cb -0.04 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.21 2di9 s VAL 46 CO 0.04 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.78 2di9 n GLY 47 N 0.60 0.71 3.50 4.51 0.00 -1.05 -4.78 105.19 108.69 2di9 n GLY 47 Ca 0.04 -0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.59 1.93 0.13 1.61 1.02 -0.79 -4.97 119.74 116.08 2di9 s LYS 48 Ca 0.00 -1.09 -0.31 0.00 0.02 0.00 0.00 55.97 54.59 2di9 s LYS 48 Cb 0.00 -2.18 -0.08 0.00 -0.52 0.00 0.00 37.83 35.05 2di9 s LYS 48 CO 0.00 0.50 1.35 -1.25 -0.92 0.00 0.00 175.35 175.03 2di9 s PRO 49 N -1.98 4.35 -0.14 -1.68 0.04 -1.26 -4.37 135.00 129.95 2di9 s PRO 49 Ca 0.18 2.04 -0.04 0.00 0.04 0.00 0.00 61.00 63.22 2di9 s PRO 49 Cb -0.11 -3.24 0.05 0.00 0.04 0.00 0.00 34.50 31.24 2di9 s PRO 49 CO 0.10 -0.37 0.07 0.00 0.04 0.00 0.00 177.00 176.84 2di9 s ALA 50 N 0.82 0.49 0.36 8.56 0.00 -0.78 -4.90 121.76 126.30 2di9 s ALA 50 Ca 0.62 -0.24 0.06 0.00 0.00 0.00 0.00 51.96 52.40 2di9 s ALA 50 Cb -0.36 -0.94 -0.07 0.00 0.00 0.00 0.00 23.12 21.75 2di9 s ALA 50 CO 0.32 -0.97 0.01 -1.83 0.00 0.00 0.00 175.76 173.28 2di9 s GLU 51 N 2.09 1.78 0.33 0.00 -1.05 -1.26 -1.03 118.70 119.56 2di9 s GLU 51 Ca 0.02 -1.98 0.06 0.00 -0.15 0.00 0.00 54.97 52.93 2di9 s GLU 51 Cb -0.15 -1.32 -0.03 0.00 -0.44 0.00 0.00 34.13 32.19 2di9 s GLU 51 CO -0.07 -0.06 0.25 -0.59 0.95 0.00 0.00 175.26 175.74 2di9 s PHE 52 N -2.94 1.72 -0.17 4.83 -0.71 -1.23 -1.94 117.98 117.54 2di9 s PHE 52 Ca 0.34 -1.61 -0.03 0.00 -1.04 0.00 0.00 56.93 54.60 2di9 s PHE 52 Cb 0.08 -0.75 -0.01 0.00 -1.21 0.00 0.00 43.02 41.13 2di9 s PHE 52 CO 0.16 -0.80 -0.07 0.99 -1.34 0.00 0.00 175.22 174.16 2di9 s THR 53 N -3.48 3.38 -0.09 -4.49 2.01 0.38 -4.07 115.64 109.27 2di9 s THR 53 Ca 0.39 -0.52 0.02 0.00 0.31 0.00 0.00 61.69 61.89 2di9 s THR 53 Cb 0.03 -2.48 -0.02 0.00 0.01 0.00 0.00 72.50 70.04 2di9 s THR 53 CO 0.25 0.47 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.86 2di9 s ILE 54 N 0.83 2.79 -0.51 1.82 1.01 -1.09 -1.17 121.20 124.88 2di9 s ILE 54 Ca -0.02 -0.78 -0.17 0.00 0.00 0.00 0.00 60.65 59.68 2di9 s ILE 54 Cb -0.15 -2.12 0.09 0.00 0.01 0.00 0.00 42.46 40.29 2di9 s ILE 54 CO 0.01 0.55 0.49 -0.62 0.00 0.00 0.00 174.94 175.38 2di9 s ASP 55 N -0.02 6.17 -0.12 3.58 2.15 -0.13 -2.78 116.67 125.52 2di9 s ASP 55 Ca -0.05 -1.37 0.17 0.00 0.43 0.00 0.00 52.55 51.74 2di9 s ASP 55 Cb -0.14 -2.22 0.40 0.00 -0.30 0.00 0.00 42.92 40.66 2di9 s ASP 55 CO 0.04 -0.79 1.19 0.35 -0.17 0.00 0.00 175.17 175.80 2di9 n THR 56 N 5.32 1.27 -0.05 1.71 -2.24 -0.79 -3.09 114.28 116.41 2di9 n THR 56 Ca -0.11 -2.23 -0.17 0.00 -2.27 0.00 0.00 64.05 59.27 2di9 n THR 56 Cb 0.43 0.26 -0.13 0.00 -2.10 0.00 0.00 70.33 68.79 2di9 n THR 56 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2di9 h LYS 57 N 0.92 0.07 -0.79 -0.78 2.10 -1.53 -3.35 116.57 113.20 2di9 h LYS 57 Ca -0.09 -0.11 -0.18 0.00 -2.00 0.00 0.00 60.65 58.27 2di9 h LYS 57 Cb 1.36 0.04 -0.11 0.00 -0.90 0.00 0.00 32.23 32.62 2di9 h LYS 57 CO 0.04 1.05 0.23 0.41 -2.00 0.00 0.00 179.45 179.18 2di9 n GLY 58 N 1.60 3.32 0.13 0.07 0.00 -1.26 -4.26 105.19 104.79 2di9 n GLY 58 Ca -0.15 -0.84 -0.22 0.00 0.00 0.00 0.00 46.02 44.81 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 -0.06 1.18 0.00 4.61 0.00 -1.26 -4.87 120.51 120.12 2di9 n ALA 59 Ca 0.35 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.86 2di9 n ALA 59 Cb 1.24 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 20.47 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 1.84 0.45 3.03 0.00 0.00 -1.26 0.15 105.19 109.40 2di9 n GLY 60 Ca -0.44 -1.28 -0.07 0.00 0.00 0.00 0.00 46.02 44.24 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 -2.52 -0.68 0.00 2.61 2.01 -1.23 -4.92 115.64 110.90 2di9 s THR 61 Ca 0.00 -0.01 0.00 0.00 0.31 0.00 0.00 61.69 61.99 2di9 s THR 61 Cb 0.00 -0.82 0.00 0.00 0.01 0.00 0.00 72.50 71.69 2di9 s THR 61 CO 0.00 -0.07 0.00 0.61 -0.69 0.00 0.00 174.62 174.47 2di9 n GLY 62 N 5.38 3.57 3.16 4.40 0.00 -1.26 -4.63 105.19 115.81 2di9 n GLY 62 Ca -0.04 -0.36 -0.34 0.00 0.00 0.00 0.00 46.02 45.28 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 1.59 -0.18 -0.02 0.00 -1.26 -5.00 107.32 102.45 2di9 s GLY 63 Ca 0.00 -1.49 -0.13 0.00 0.00 0.00 0.00 44.72 43.11 2di9 s GLY 63 CO 0.00 0.50 0.25 -2.27 0.00 0.00 0.00 173.10 171.57 2di9 s LEU 64 N 1.27 4.22 -0.21 0.66 2.96 -1.26 -0.46 118.68 125.86 2di9 s LEU 64 Ca -0.01 0.41 -0.06 0.00 -0.22 0.00 0.00 54.13 54.25 2di9 s LEU 64 Cb -0.17 -2.29 -0.03 0.00 0.50 0.00 0.00 46.19 44.21 2di9 s LEU 64 CO -0.06 0.11 0.03 -0.83 -1.32 0.00 0.00 176.35 174.28 2di9 s GLY 65 N 0.50 1.77 -0.18 7.98 0.00 0.37 -4.98 107.32 112.79 2di9 s GLY 65 Ca 0.14 -0.98 0.01 0.00 0.00 0.00 0.00 44.72 43.89 2di9 s GLY 65 CO 0.02 0.28 -0.17 -2.27 0.00 0.00 0.00 173.10 170.96 2di9 s LEU 66 N 1.04 2.19 -0.02 0.66 2.96 -1.25 -2.34 118.68 121.93 2di9 s LEU 66 Ca 0.03 -0.71 0.02 0.00 -0.22 0.00 0.00 54.13 53.25 2di9 s LEU 66 Cb -0.14 -1.41 0.01 0.00 0.50 0.00 0.00 46.19 45.14 2di9 s LEU 66 CO 0.02 -0.04 -0.07 0.42 -1.32 0.00 0.00 176.35 175.37 2di9 s THR 67 N 1.31 0.61 -0.49 3.68 -4.23 -1.07 -4.96 115.64 110.49 2di9 s THR 67 Ca 0.03 -0.26 -0.20 0.00 -1.18 0.00 0.00 61.69 60.08 2di9 s THR 67 Cb -0.14 -0.56 0.04 0.00 1.34 0.00 0.00 72.50 73.18 2di9 s THR 67 CO -0.11 0.20 0.67 -0.69 -0.54 0.00 0.00 174.62 174.15 2di9 s VAL 68 N 0.28 4.80 -1.18 2.29 1.01 -1.26 -0.84 120.40 125.50 2di9 s VAL 68 Ca -0.04 -0.19 -0.09 0.00 0.00 0.00 0.00 61.98 61.66 2di9 s VAL 68 Cb -0.08 -4.29 0.23 0.00 0.00 0.00 0.00 36.38 32.23 2di9 s VAL 68 CO 0.00 -0.77 1.49 -0.62 0.00 0.00 0.00 175.10 175.20 2di9 n GLU 69 N 6.36 3.72 -2.69 2.72 -0.58 -0.48 -4.84 120.64 124.84 2di9 n GLU 69 Ca -0.04 -4.06 -0.09 0.00 -0.42 0.00 0.00 57.16 52.55 2di9 n GLU 69 Cb 0.46 -2.78 -0.02 0.00 -0.57 0.00 0.00 31.44 28.54 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 2.83 3.99 0.05 0.62 0.00 -1.26 -3.44 105.19 107.98 2di9 n GLY 70 Ca 0.32 -2.25 0.09 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.36 0.07 -4.09 1.61 -0.04 -1.26 -4.81 135.00 126.12 2di9 n PRO 71 Ca -0.05 0.32 -0.12 0.00 -0.04 0.00 0.00 63.50 63.61 2di9 n PRO 71 Cb 0.17 -1.64 -0.07 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 -3.85 3.38 -0.07 0.00 2.12 -1.26 -4.93 118.70 114.08 2di9 s GLU 73 Ca 0.30 -1.58 -0.21 0.00 0.36 0.00 0.00 54.97 53.84 2di9 s GLU 73 Cb 0.02 -4.57 -0.04 0.00 0.26 0.00 0.00 34.13 29.80 2di9 s GLU 73 CO 0.13 -1.66 0.61 0.00 -0.54 0.00 0.00 175.26 173.80 2di9 s ALA 74 N 2.60 3.41 0.61 6.30 0.00 -1.26 -4.96 121.76 128.45 2di9 s ALA 74 Ca 0.24 0.02 -0.19 0.00 0.00 0.00 0.00 51.96 52.02 2di9 s ALA 74 Cb -0.12 -2.82 -0.03 0.00 0.00 0.00 0.00 23.12 20.15 2di9 s ALA 74 CO -0.02 -0.01 1.29 1.17 0.00 0.00 0.00 175.76 178.19 2di9 n LYS 75 N 3.50 1.29 -3.94 0.00 4.81 -1.23 -4.82 118.16 117.77 2di9 n LYS 75 Ca -0.04 0.49 -0.24 0.00 -0.87 0.00 0.00 58.31 57.65 2di9 n LYS 75 Cb 0.51 -2.52 -0.17 0.00 0.02 0.00 0.00 35.03 32.88 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 -1.36 0.68 -0.44 3.15 1.01 -1.26 -2.18 121.20 120.80 2di9 s ILE 76 Ca 0.79 -0.10 -0.08 0.00 0.00 0.00 0.00 60.65 61.26 2di9 s ILE 76 Cb -0.40 -0.75 0.11 0.00 0.01 0.00 0.00 42.46 41.43 2di9 s ILE 76 CO 0.44 0.30 0.29 -1.61 0.00 0.00 0.00 174.94 174.35 2di9 s GLU 77 N 1.62 2.41 -0.16 2.79 8.01 0.73 -4.98 118.70 129.11 2di9 s GLU 77 Ca 0.01 -1.69 -0.18 0.00 0.01 0.00 0.00 54.97 53.12 2di9 s GLU 77 Cb -0.13 -3.80 -0.04 0.00 -4.31 0.00 0.00 34.13 25.85 2di9 s GLU 77 CO -0.05 -1.09 0.51 0.00 0.01 0.00 0.00 175.26 174.63 2di9 s SER 79 N 0.91 0.55 0.19 0.00 0.15 -1.12 -5.02 113.70 109.36 2di9 s SER 79 Ca 0.25 -0.44 0.01 0.00 0.70 0.00 0.00 55.95 56.47 2di9 s SER 79 Cb -0.15 0.04 -0.04 0.00 -1.71 0.00 0.00 66.02 64.16 2di9 s SER 79 CO 0.10 -0.19 0.35 -1.81 1.20 0.00 0.00 173.24 172.89 2di9 s ASP 80 N -1.26 6.36 -0.22 5.45 1.01 -1.26 -2.01 116.67 124.74 2di9 s ASP 80 Ca -0.10 0.30 -0.08 0.00 0.71 0.00 0.00 52.55 53.37 2di9 s ASP 80 Cb -0.08 -1.96 -0.11 0.00 1.01 0.00 0.00 42.92 41.78 2di9 s ASP 80 CO -0.00 -0.02 -0.26 0.59 0.21 0.00 0.00 175.17 175.69 2di9 n ASN 81 N -0.70 1.76 0.00 0.27 3.02 -1.23 -4.90 115.26 113.48 2di9 n ASN 81 Ca -0.06 0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 2di9 n ASN 81 Cb 0.54 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 39.13 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 1.81 0.76 0.93 7.41 0.00 -1.26 -4.94 105.19 109.89 2di9 n GLY 82 Ca -0.42 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.70 2di9 n GLY 82 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2di9 n ASP 83 N 0.00 2.99 0.00 1.61 8.00 -1.26 -4.92 116.55 122.97 2di9 n ASP 83 Ca 0.00 -1.91 0.00 0.00 0.71 0.00 0.00 54.79 53.59 2di9 n ASP 83 Cb 0.00 -0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 2di9 n ASP 83 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2di9 n GLY 84 N 1.24 1.17 3.69 0.44 0.00 -1.26 -4.90 105.19 105.56 2di9 n GLY 84 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 0.93 -0.09 2.61 -4.23 -1.26 -1.31 115.64 110.29 2di9 s THR 85 Ca 0.00 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.44 2di9 s THR 85 Cb 0.00 -2.18 0.03 0.00 1.34 0.00 0.00 72.50 71.69 2di9 s THR 85 CO 0.00 0.00 0.23 0.00 -0.54 0.00 0.00 174.62 174.31 2di9 s SER 87 N 0.60 4.82 -0.31 0.00 0.01 -0.85 -2.69 113.70 115.28 2di9 s SER 87 Ca -0.04 -1.79 -0.10 0.00 1.31 0.00 0.00 55.95 55.33 2di9 s SER 87 Cb -0.05 -1.67 -0.01 0.00 0.21 0.00 0.00 66.02 64.50 2di9 s SER 87 CO -0.03 -0.35 0.15 -0.69 0.41 0.00 0.00 173.24 172.73 2di9 s VAL 88 N 1.06 4.61 -0.22 3.43 1.01 -1.26 -2.78 120.40 126.26 2di9 s VAL 88 Ca 0.03 -0.39 -0.08 0.00 0.00 0.00 0.00 61.98 61.53 2di9 s VAL 88 Cb -0.20 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 2di9 s VAL 88 CO -0.05 0.08 0.10 -0.94 0.00 0.00 0.00 175.10 174.29 2di9 s SER 89 N 1.62 5.67 0.14 3.32 1.04 -0.28 -3.50 113.70 121.70 2di9 s SER 89 Ca 0.05 0.02 0.09 0.00 0.48 0.00 0.00 55.95 56.59 2di9 s SER 89 Cb -0.17 -2.00 -0.04 0.00 0.10 0.00 0.00 66.02 63.91 2di9 s SER 89 CO 0.06 0.09 -0.19 -0.72 0.98 0.00 0.00 173.24 173.46 2di9 s TYR 90 N 0.90 2.50 -0.30 5.02 1.13 -0.20 -0.20 117.35 126.20 2di9 s TYR 90 Ca 0.05 -0.28 0.02 0.00 -1.41 0.00 0.00 57.07 55.45 2di9 s TYR 90 Cb -0.13 -1.30 0.09 0.00 -1.10 0.00 0.00 41.96 39.51 2di9 s TYR 90 CO 0.03 0.41 0.01 -0.51 -2.51 0.00 0.00 175.55 172.98 2di9 s LEU 91 N -2.29 3.64 1.03 -3.49 1.43 -0.93 -1.86 118.68 116.22 2di9 s LEU 91 Ca 0.19 -1.74 -0.13 0.00 -1.03 0.00 0.00 54.13 51.41 2di9 s LEU 91 Cb -0.10 -1.38 0.21 0.00 0.03 0.00 0.00 46.19 44.95 2di9 s LEU 91 CO 0.10 -0.33 1.10 -2.16 0.23 0.00 0.00 176.35 175.29 2di9 s PRO 92 N 1.17 0.17 -0.08 1.29 0.04 -1.26 -3.53 135.00 132.79 2di9 s PRO 92 Ca 0.04 0.42 -0.02 0.00 0.04 0.00 0.00 61.00 61.49 2di9 s PRO 92 Cb -0.19 -1.71 -0.04 0.00 0.04 0.00 0.00 34.50 32.60 2di9 s PRO 92 CO -0.10 -2.89 -0.09 0.25 0.04 0.00 0.00 177.00 174.21 2di9 n THR 93 N -4.27 0.44 -4.19 1.26 -2.24 -1.26 -2.52 114.28 101.50 2di9 n THR 93 Ca 0.06 -0.14 -0.18 0.00 -2.27 0.00 0.00 64.05 61.51 2di9 n THR 93 Cb 0.58 -1.21 -0.12 0.00 -2.10 0.00 0.00 70.33 67.48 2di9 n THR 93 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2di9 s LYS 94 N -2.15 0.89 -0.34 -0.78 -2.85 -1.26 -4.57 119.74 108.68 2di9 s LYS 94 Ca -0.11 -1.05 -0.29 0.00 -1.00 0.00 0.00 55.97 53.53 2di9 s LYS 94 Cb 0.04 -0.86 -0.01 0.00 -2.06 0.00 0.00 37.83 34.93 2di9 s LYS 94 CO 0.16 0.18 1.69 -1.25 0.10 0.00 0.00 175.35 176.24 2di9 s PRO 95 N -2.03 3.44 0.00 1.78 0.04 -1.26 -4.78 135.00 132.19 2di9 s PRO 95 Ca 0.01 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.40 2di9 s PRO 95 Cb -0.08 -4.14 0.00 0.00 0.04 0.00 0.00 34.50 30.31 2di9 s PRO 95 CO 0.02 -1.73 0.00 0.41 0.04 0.00 0.00 177.00 175.74 2di9 n GLY 96 N 5.28 2.02 3.08 0.56 0.00 -1.24 -4.99 105.19 109.89 2di9 n GLY 96 Ca 0.21 0.16 -0.11 0.00 0.00 0.00 0.00 46.02 46.29 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 2.49 0.27 -0.22 1.61 8.01 -1.26 -3.61 118.70 125.99 2di9 s GLU 97 Ca 0.00 0.79 -0.05 0.00 0.01 0.00 0.00 54.97 55.71 2di9 s GLU 97 Cb 0.00 -0.05 -0.02 0.00 -4.31 0.00 0.00 34.13 29.75 2di9 s GLU 97 CO 0.00 -0.38 0.01 0.71 0.01 0.00 0.00 175.26 175.61 2di9 s TYR 98 N 2.53 3.03 -0.43 1.61 1.51 -1.13 -4.31 117.35 120.14 2di9 s TYR 98 Ca 0.03 -0.61 -0.15 0.00 -1.01 0.00 0.00 57.07 55.34 2di9 s TYR 98 Cb -0.13 -2.14 0.04 0.00 -0.11 0.00 0.00 41.96 39.62 2di9 s TYR 98 CO -0.12 -0.38 0.33 -0.06 -1.11 0.00 0.00 175.55 174.20 2di9 s PHE 99 N 1.36 3.25 -0.61 2.71 0.40 -1.22 -1.68 117.98 122.18 2di9 s PHE 99 Ca 0.05 -0.78 -0.28 0.00 -0.60 0.00 0.00 56.93 55.31 2di9 s PHE 99 Cb -0.15 -2.82 0.03 0.00 0.51 0.00 0.00 43.02 40.60 2di9 s PHE 99 CO 0.01 -0.68 1.23 0.08 0.70 0.00 0.00 175.22 176.56 2di9 s VAL 100 N 1.65 3.93 -0.55 -0.44 1.01 -1.22 -1.39 120.40 123.39 2di9 s VAL 100 Ca 0.04 0.79 -0.28 0.00 0.00 0.00 0.00 61.98 62.53 2di9 s VAL 100 Cb -0.21 -4.73 0.03 0.00 0.00 0.00 0.00 36.38 31.46 2di9 s VAL 100 CO 0.08 -1.42 1.17 0.20 0.00 0.00 0.00 175.10 175.13 2di9 s ASN 101 N 3.27 6.49 -0.33 3.32 0.01 -0.02 -2.46 114.94 125.23 2di9 s ASN 101 Ca 0.42 0.19 -0.07 0.00 -0.71 0.00 0.00 52.86 52.70 2di9 s ASN 101 Cb -0.08 -2.55 0.03 0.00 0.41 0.00 0.00 41.25 39.06 2di9 s ASN 101 CO 0.23 -1.42 0.10 -0.63 -1.51 0.00 0.00 177.10 173.88 2di9 s ILE 102 N 4.81 3.93 -0.04 0.60 1.01 -1.26 -2.61 121.20 127.64 2di9 s ILE 102 Ca 0.44 -0.94 0.02 0.00 0.00 0.00 0.00 60.65 60.17 2di9 s ILE 102 Cb -0.07 -3.14 0.01 0.00 0.01 0.00 0.00 42.46 39.26 2di9 s ILE 102 CO 0.27 -0.08 -0.07 -1.48 0.00 0.00 0.00 174.94 173.57 2di9 s LEU 103 N 1.45 1.57 -0.36 2.97 0.05 -0.99 -1.81 118.68 121.57 2di9 s LEU 103 Ca 0.00 -0.17 -0.11 0.00 0.05 0.00 0.00 54.13 53.90 2di9 s LEU 103 Cb -0.19 -0.53 0.02 0.00 -2.05 0.00 0.00 46.19 43.45 2di9 s LEU 103 CO 0.03 0.01 0.20 0.12 -0.55 0.00 0.00 176.35 176.15 2di9 s PHE 104 N 0.57 3.23 -1.25 3.48 5.36 0.99 -0.47 117.98 129.88 2di9 s PHE 104 Ca -0.09 -0.87 -0.03 0.00 -0.96 0.00 0.00 56.93 54.98 2di9 s PHE 104 Cb -0.12 -2.43 0.00 0.00 -0.34 0.00 0.00 43.02 40.14 2di9 s PHE 104 CO 0.01 -0.61 1.06 0.39 -1.46 0.00 0.00 175.22 174.62 2di9 n GLU 105 N 5.00 -7.10 -2.26 10.12 1.02 0.39 -2.03 120.64 125.78 2di9 n GLU 105 Ca -0.12 0.84 -0.12 0.00 -0.02 0.00 0.00 57.16 57.74 2di9 n GLU 105 Cb 0.47 -5.87 -0.00 0.00 -0.02 0.00 0.00 31.44 26.01 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 -4.44 -1.09 -3.80 3.49 1.02 -1.26 -5.00 120.64 109.56 2di9 n GLU 106 Ca -0.18 0.59 -0.29 0.00 -0.02 0.00 0.00 57.16 57.26 2di9 n GLU 106 Cb 0.63 -4.76 -0.16 0.00 -0.02 0.00 0.00 31.44 27.13 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 -2.63 0.87 0.02 2.62 1.01 -0.86 -5.10 120.40 116.32 2di9 s VAL 107 Ca 0.01 -0.83 -0.30 0.00 0.00 0.00 0.00 61.98 60.87 2di9 s VAL 107 Cb -0.00 -1.32 -0.08 0.00 0.00 0.00 0.00 36.38 34.98 2di9 s VAL 107 CO 0.01 -0.21 1.88 -1.00 0.00 0.00 0.00 175.10 175.78 2di9 s HIS 108 N 1.69 1.51 0.61 5.22 3.76 -1.26 -0.01 115.29 126.82 2di9 s HIS 108 Ca -0.02 -0.26 -0.18 0.00 -0.15 0.00 0.00 55.06 54.45 2di9 s HIS 108 Cb -0.18 -4.15 -0.02 0.00 1.11 0.00 0.00 32.58 29.34 2di9 s HIS 108 CO -0.08 -5.08 1.16 0.96 -0.85 0.00 0.00 174.74 170.85 2di9 s ILE 109 N 4.26 2.88 -1.11 0.60 -4.36 -0.75 -4.88 121.20 117.83 2di9 s ILE 109 Ca 0.84 0.50 -0.23 0.00 -0.26 0.00 0.00 60.65 61.49 2di9 s ILE 109 Cb -0.40 -3.12 -0.08 0.00 1.25 0.00 0.00 42.46 40.11 2di9 s ILE 109 CO 0.38 -0.17 1.94 -2.16 0.24 0.00 0.00 174.94 175.17 2di9 s PRO 110 N -3.57 2.50 0.00 0.37 0.04 -1.26 -2.31 135.00 130.77 2di9 s PRO 110 Ca 0.73 -0.94 0.00 0.00 0.04 0.00 0.00 61.00 60.83 2di9 s PRO 110 Cb -0.26 -5.20 0.00 0.00 0.04 0.00 0.00 34.50 29.08 2di9 s PRO 110 CO 0.35 -3.84 0.00 0.41 0.04 0.00 0.00 177.00 173.96 2di9 n GLY 111 N 6.07 0.23 3.84 0.56 0.00 -1.26 -4.98 105.19 109.65 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 5.76 1.08 1.61 1.04 -0.98 -4.23 113.70 117.99 2di9 s SER 112 Ca 0.00 -0.05 -0.15 0.00 0.48 0.00 0.00 55.95 56.23 2di9 s SER 112 Cb 0.00 -1.58 0.23 0.00 0.10 0.00 0.00 66.02 64.77 2di9 s SER 112 CO 0.00 0.06 1.10 -2.16 0.98 0.00 0.00 173.24 173.21 2di9 s PRO 113 N -3.19 -0.23 -0.44 4.02 0.04 -1.26 -4.83 135.00 129.11 2di9 s PRO 113 Ca 0.32 0.29 0.02 0.00 0.04 0.00 0.00 61.00 61.67 2di9 s PRO 113 Cb -0.10 -1.68 0.12 0.00 0.04 0.00 0.00 34.50 32.88 2di9 s PRO 113 CO 0.25 -3.12 0.19 -0.06 0.04 0.00 0.00 177.00 174.30 2di9 s PHE 114 N -2.98 3.51 0.03 0.56 0.40 -1.03 -4.85 117.98 113.63 2di9 s PHE 114 Ca 0.67 -2.92 -0.30 0.00 -0.60 0.00 0.00 56.93 53.78 2di9 s PHE 114 Cb -0.16 -2.98 -0.09 0.00 0.51 0.00 0.00 43.02 40.30 2di9 s PHE 114 CO 0.57 -0.88 1.97 0.21 0.70 0.00 0.00 175.22 177.79 2di9 s LYS 115 N 0.45 4.13 -0.20 0.44 2.36 -1.26 -3.40 119.74 122.27 2di9 s LYS 115 Ca 0.13 2.61 -0.01 0.00 -2.55 0.00 0.00 55.97 56.14 2di9 s LYS 115 Cb -0.22 -4.16 0.01 0.00 -1.05 0.00 0.00 37.83 32.40 2di9 s LYS 115 CO -0.04 -0.96 -0.12 0.00 1.55 0.00 0.00 175.35 175.77 2di9 s ALA 116 N 4.49 2.56 -0.42 3.13 0.00 -0.68 -4.67 121.76 126.18 2di9 s ALA 116 Ca 0.88 -1.19 -0.27 0.00 0.00 0.00 0.00 51.96 51.38 2di9 s ALA 116 Cb -0.42 -1.43 0.02 0.00 0.00 0.00 0.00 23.12 21.29 2di9 s ALA 116 CO 0.41 -0.39 1.01 -0.51 0.00 0.00 0.00 175.76 176.29 2di9 s ASP 117 N 1.38 6.65 -0.20 0.00 1.01 -0.87 -2.85 116.67 121.80 2di9 s ASP 117 Ca 0.05 0.49 -0.12 0.00 0.71 0.00 0.00 52.55 53.68 2di9 s ASP 117 Cb -0.14 -2.50 -0.05 0.00 1.01 0.00 0.00 42.92 41.25 2di9 s ASP 117 CO -0.08 -1.03 0.22 -0.63 0.21 0.00 0.00 175.17 173.86 2di9 s ILE 118 N 3.87 5.34 0.34 0.77 -1.09 -1.24 -3.36 121.20 125.83 2di9 s ILE 118 Ca 0.42 0.37 0.08 0.00 -2.23 0.00 0.00 60.65 59.28 2di9 s ILE 118 Cb -0.10 -3.56 -0.03 0.00 -1.58 0.00 0.00 42.46 37.19 2di9 s ILE 118 CO 0.24 0.38 0.29 -1.61 -1.23 0.00 0.00 174.94 173.01 2di9 s GLU 119 N 0.67 2.68 0.16 2.79 2.02 -1.20 -3.73 118.70 122.09 2di9 s GLU 119 Ca 0.12 -1.33 -0.25 0.00 0.02 0.00 0.00 54.97 53.52 2di9 s GLU 119 Cb -0.13 -2.44 -0.08 0.00 0.10 0.00 0.00 34.13 31.58 2di9 s GLU 119 CO 0.03 0.07 0.77 -1.64 0.02 0.00 0.00 175.26 174.51 2di9 s MET 120 N -3.99 4.56 0.55 1.61 -1.94 -1.26 -2.23 119.30 116.60 2di9 s MET 120 Ca 0.41 1.15 -0.19 0.00 -1.71 0.00 0.00 55.69 55.35 2di9 s MET 120 Cb -0.05 -3.26 -0.05 0.00 2.01 0.00 0.00 34.83 33.47 2di9 s MET 120 CO 0.26 0.57 1.13 -1.25 -0.01 0.00 0.00 175.02 175.72 2di9 s PRO 121 N -1.14 3.32 -0.07 2.03 0.04 -1.26 -4.93 135.00 132.98 2di9 s PRO 121 Ca 0.36 1.60 -0.30 0.00 0.04 0.00 0.00 61.00 62.70 2di9 s PRO 121 Cb -0.23 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 2di9 s PRO 121 CO 0.26 -0.88 1.39 -0.06 0.04 0.00 0.00 177.00 177.75 2di9 s PHE 122 N -1.81 2.70 0.45 0.56 0.40 -1.26 -4.97 117.98 114.05 2di9 s PHE 122 Ca 0.72 0.79 -0.25 0.00 -0.60 0.00 0.00 56.93 57.60 2di9 s PHE 122 Cb -0.24 -3.64 -0.08 0.00 0.51 0.00 0.00 43.02 39.57 2di9 s PHE 122 CO 0.28 -2.37 1.37 -0.40 0.70 0.00 0.00 175.22 174.80 2di9 n ASP 123 N 6.12 3.01 -0.09 1.36 5.75 -1.26 -4.93 116.55 126.51 2di9 n ASP 123 Ca 0.14 1.10 -0.12 0.00 -0.01 0.00 0.00 54.79 55.90 2di9 n ASP 123 Cb 0.44 -1.57 0.01 0.00 -1.03 0.00 0.00 41.12 38.97 2di9 n ASP 123 CO 0.00 0.00 0.00 1.55 -0.11 0.00 0.00 177.20 178.64 2di9 h PRO 124 N 2.13 0.84 -6.46 0.11 0.13 -2.06 -3.45 132.00 123.24 2di9 h PRO 124 Ca -0.50 -0.44 -0.60 0.00 -0.87 0.00 0.00 66.00 63.59 2di9 h PRO 124 Cb 1.28 0.02 0.14 0.00 0.13 0.00 0.00 31.00 32.57 2di9 h PRO 124 CO 0.60 1.08 -0.18 -1.13 -0.23 0.00 0.00 178.00 178.15 2di9 n SER 125 N -4.04 -0.04 -4.99 1.44 3.41 -1.26 -4.99 113.62 103.15 2di9 n SER 125 Ca -0.02 0.96 -0.22 0.00 -0.26 0.00 0.00 58.87 59.33 2di9 n SER 125 Cb 0.54 -1.21 0.03 0.00 -0.26 0.00 0.00 64.21 63.32 2di9 n SER 125 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2di9 s SER 126 N -0.89 4.97 1.08 4.04 1.04 -1.26 -5.12 113.70 117.56 2di9 s SER 126 Ca 0.64 -0.96 -0.05 0.00 0.48 0.00 0.00 55.95 56.06 2di9 s SER 126 Cb -0.59 0.27 0.08 0.00 0.10 0.00 0.00 66.02 65.89 2di9 s SER 126 CO 0.57 -1.22 0.26 0.61 0.98 0.00 0.00 173.24 174.43 2di9 n GLY 127 N -2.05 -2.95 0.00 7.32 0.00 -1.26 -4.85 105.19 101.40 2di9 n GLY 127 Ca 0.09 -1.39 0.08 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.55 0.35 -3.36 1.61 -0.04 -1.26 -4.85 135.00 124.90 2di9 n PRO 128 Ca 0.04 0.07 -0.24 0.00 -0.04 0.00 0.00 63.50 63.33 2di9 n PRO 128 Cb 0.15 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.13 2di9 n PRO 128 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2di9 n SER 129 N -1.14 -4.93 -4.80 3.54 3.41 -1.26 -4.95 113.62 103.49 2di9 n SER 129 Ca 0.09 -0.44 -0.37 0.00 -0.26 0.00 0.00 58.87 57.90 2di9 n SER 129 Cb 0.09 -4.00 -0.06 0.00 -0.26 0.00 0.00 64.21 59.97 2di9 n SER 129 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2di9 s SER 130 N -2.86 6.57 0.00 4.04 1.04 -1.26 -5.30 113.70 115.93 2di9 s SER 130 Ca 0.43 0.68 0.00 0.00 0.48 0.00 0.00 55.95 57.54 2di9 s SER 130 Cb -0.21 -2.19 0.00 0.00 0.10 0.00 0.00 66.02 63.72 2di9 s SER 130 CO 0.53 0.25 0.27 0.61 0.98 0.00 0.00 173.24 175.88