#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 4.05 -0.18 1.61 1.04 -1.26 -5.07 113.70 113.89 2di9 s SER 2 Ca 0.00 -0.77 -0.22 0.00 0.48 0.00 0.00 55.95 55.43 2di9 s SER 2 Cb 0.00 -0.58 -0.20 0.00 0.10 0.00 0.00 66.02 65.35 2di9 s SER 2 CO 0.00 0.05 0.35 0.28 0.98 0.00 0.00 173.24 174.90 2di9 h SER 3 N 2.42 0.00 0.00 7.02 0.02 -2.06 -3.50 113.55 117.45 2di9 h SER 3 Ca -0.44 -0.61 0.00 0.00 -0.84 0.00 0.00 61.79 59.90 2di9 h SER 3 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.78 2di9 h SER 3 CO 0.57 1.27 0.00 0.61 -1.14 0.00 0.00 176.83 178.15 2di9 n GLY 4 N 1.51 -1.19 3.43 -3.77 0.00 -1.26 -5.00 105.19 98.91 2di9 n GLY 4 Ca -0.23 0.48 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.69 0.02 1.61 7.64 -1.26 -4.99 113.62 114.96 2di9 n SER 5 Ca 0.00 0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.94 2di9 n SER 5 Cb 0.00 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.01 2di9 n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2di9 n SER 6 N -2.92 0.07 0.00 6.43 7.64 -1.26 -5.12 113.62 118.46 2di9 n SER 6 Ca 0.05 0.08 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2di9 n SER 6 Cb 0.56 0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 2di9 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2di9 n GLY 7 N 2.12 -1.69 2.88 0.23 0.00 -1.26 -5.06 105.19 102.41 2di9 n GLY 7 Ca 0.00 0.65 -0.29 0.00 0.00 0.00 0.00 46.02 46.37 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 4.23 0.06 1.61 1.11 -1.26 -5.09 116.67 113.33 2di9 s ASP 8 Ca 0.00 -3.13 -0.30 0.00 0.18 0.00 0.00 52.55 49.30 2di9 s ASP 8 Cb 0.00 -1.50 -0.05 0.00 1.07 0.00 0.00 42.92 42.44 2di9 s ASP 8 CO 0.00 -0.20 1.07 -0.69 1.18 0.00 0.00 175.17 176.53 2di9 s VAL 9 N -0.42 4.39 0.23 -1.27 1.01 -1.26 -5.05 120.40 118.04 2di9 s VAL 9 Ca 0.19 1.78 0.05 0.00 0.00 0.00 0.00 61.98 64.01 2di9 s VAL 9 Cb -0.20 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 2di9 s VAL 9 CO -0.04 0.18 0.30 0.42 0.00 0.00 0.00 175.10 175.95 2di9 s THR 10 N 0.75 4.99 -0.29 3.92 -4.23 -1.26 -5.12 115.64 114.40 2di9 s THR 10 Ca 0.53 -1.10 -0.16 0.00 -1.18 0.00 0.00 61.69 59.79 2di9 s THR 10 Cb -0.25 -3.69 0.13 0.00 1.34 0.00 0.00 72.50 70.02 2di9 s THR 10 CO 0.30 -0.31 0.89 -0.72 -0.54 0.00 0.00 174.62 174.23 2di9 s TYR 11 N -2.00 -0.73 -0.29 3.99 1.13 -1.26 -5.17 117.35 113.03 2di9 s TYR 11 Ca 0.34 1.44 -0.17 0.00 -1.41 0.00 0.00 57.07 57.27 2di9 s TYR 11 Cb -0.09 0.43 0.16 0.00 -1.10 0.00 0.00 41.96 41.37 2di9 s TYR 11 CO 0.28 -0.36 1.07 0.34 -2.51 0.00 0.00 175.55 174.36 2di9 s ASP 12 N 1.49 -0.38 0.00 -0.18 2.15 -1.26 -5.13 116.67 113.36 2di9 s ASP 12 Ca -0.09 0.61 0.00 0.00 0.43 0.00 0.00 52.55 53.50 2di9 s ASP 12 Cb -0.04 1.10 0.00 0.00 -0.30 0.00 0.00 42.92 43.68 2di9 s ASP 12 CO -0.16 -0.10 0.00 0.61 -0.17 0.00 0.00 175.17 175.35 2di9 n GLY 13 N 3.37 1.01 3.90 2.66 0.00 -1.26 -5.10 105.19 109.77 2di9 n GLY 13 Ca -0.18 -0.99 -0.35 0.00 0.00 0.00 0.00 46.02 44.51 2di9 n GLY 13 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2di9 s HIS 14 N 0.00 3.57 0.11 1.61 -3.43 -1.26 -5.07 115.29 110.82 2di9 s HIS 14 Ca 0.00 0.42 -0.31 0.00 -0.80 0.00 0.00 55.06 54.37 2di9 s HIS 14 Cb 0.00 -1.87 -0.08 0.00 -1.43 0.00 0.00 32.58 29.20 2di9 s HIS 14 CO 0.00 0.68 1.36 -1.25 -2.00 0.00 0.00 174.74 173.53 2di9 s PRO 15 N -1.61 4.34 0.45 -0.38 0.04 -1.26 -4.99 135.00 131.58 2di9 s PRO 15 Ca 0.23 2.03 -0.24 0.00 0.04 0.00 0.00 61.00 63.06 2di9 s PRO 15 Cb -0.12 -3.26 -0.08 0.00 0.04 0.00 0.00 34.50 31.08 2di9 s PRO 15 CO 0.13 -0.41 1.27 0.14 0.04 0.00 0.00 177.00 178.18 2di9 s VAL 16 N 1.06 2.65 0.44 -0.36 -7.23 -1.26 -4.98 120.40 110.72 2di9 s VAL 16 Ca 0.63 0.54 -0.24 0.00 -1.81 0.00 0.00 61.98 61.11 2di9 s VAL 16 Cb -0.36 -3.30 -0.08 0.00 0.56 0.00 0.00 36.38 33.21 2di9 s VAL 16 CO 0.30 0.04 1.17 -2.16 -0.31 0.00 0.00 175.10 174.15 2di9 s PRO 17 N -2.49 3.84 1.04 4.82 0.04 -1.26 -4.99 135.00 136.01 2di9 s PRO 17 Ca 0.61 1.81 -0.20 0.00 0.04 0.00 0.00 61.00 63.26 2di9 s PRO 17 Cb -0.36 -2.49 -0.03 0.00 0.04 0.00 0.00 34.50 31.66 2di9 s PRO 17 CO 0.45 -0.49 -0.48 0.41 0.04 0.00 0.00 177.00 176.93 2di9 n GLY 18 N 0.51 -2.86 3.76 0.56 0.00 -1.26 -4.86 105.19 101.04 2di9 n GLY 18 Ca 0.06 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 45.10 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 -1.52 5.95 0.00 1.61 0.01 -1.26 -4.89 113.70 113.59 2di9 s SER 19 Ca 0.48 2.67 0.14 0.00 1.31 0.00 0.00 55.95 60.56 2di9 s SER 19 Cb -0.08 -2.63 0.64 0.00 0.21 0.00 0.00 66.02 64.15 2di9 s SER 19 CO 0.69 -1.10 1.44 -0.81 0.41 0.00 0.00 173.24 173.87 2di9 n PRO 20 N -0.33 0.05 -1.02 12.44 -0.04 -1.26 -3.77 135.00 141.07 2di9 n PRO 20 Ca 0.06 0.23 -0.13 0.00 -0.04 0.00 0.00 63.50 63.62 2di9 n PRO 20 Cb 0.44 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.27 2di9 n PRO 20 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2di9 n TYR 21 N -1.45 0.28 -4.17 0.54 4.01 -1.26 -4.84 117.16 110.27 2di9 n TYR 21 Ca 0.04 -1.53 -0.13 0.00 -0.16 0.00 0.00 57.90 56.12 2di9 n TYR 21 Cb 0.16 -1.44 -0.11 0.00 -0.31 0.00 0.00 39.34 37.64 2di9 n TYR 21 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2di9 s THR 22 N 0.32 0.86 -0.00 -0.72 -1.32 -1.25 -5.16 115.64 108.37 2di9 s THR 22 Ca 0.58 -1.71 0.04 0.00 -1.21 0.00 0.00 61.69 59.38 2di9 s THR 22 Cb 0.30 -1.43 -0.01 0.00 -1.51 0.00 0.00 72.50 69.85 2di9 s THR 22 CO -0.03 -0.65 -0.11 -0.69 -2.21 0.00 0.00 174.62 170.92 2di9 s VAL 23 N -2.76 0.88 0.00 5.08 1.01 -1.26 -5.03 120.40 118.32 2di9 s VAL 23 Ca 0.07 -0.54 -0.04 0.00 0.00 0.00 0.00 61.98 61.47 2di9 s VAL 23 Cb -0.01 -0.75 -0.19 0.00 0.00 0.00 0.00 36.38 35.43 2di9 s VAL 23 CO -0.01 0.21 2.82 1.21 0.00 0.00 0.00 175.10 179.32 2di9 n GLU 24 N 2.69 1.49 -3.13 2.72 2.13 -1.26 -4.71 120.64 120.56 2di9 n GLU 24 Ca -0.14 -0.70 -0.45 0.00 0.66 0.00 0.00 57.16 56.53 2di9 n GLU 24 Cb 0.56 -1.81 -0.01 0.00 0.27 0.00 0.00 31.44 30.45 2di9 n GLU 24 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2di9 s ALA 25 N 1.32 4.23 -1.26 4.31 0.00 -1.26 -4.55 121.76 124.56 2di9 s ALA 25 Ca 0.47 -3.48 -0.00 0.00 0.00 0.00 0.00 51.96 48.95 2di9 s ALA 25 Cb 0.23 -3.84 0.00 0.00 0.00 0.00 0.00 23.12 19.50 2di9 s ALA 25 CO 0.00 -2.53 0.85 0.45 0.00 0.00 0.00 175.76 174.54 2di9 n SER 26 N 4.44 -1.68 -4.68 0.00 2.88 -1.26 -4.91 113.62 108.41 2di9 n SER 26 Ca 0.28 -0.72 -0.40 0.00 -1.33 0.00 0.00 58.87 56.70 2di9 n SER 26 Cb 0.42 -4.59 0.02 0.00 -0.75 0.00 0.00 64.21 59.32 2di9 n SER 26 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2di9 n LEU 27 N -4.22 4.00 -4.77 2.46 4.77 -1.26 -4.95 117.00 113.03 2di9 n LEU 27 Ca -0.29 1.04 -0.36 0.00 -0.03 0.00 0.00 56.01 56.37 2di9 n LEU 27 Cb 0.67 -1.48 -0.00 0.00 -2.33 0.00 0.00 43.42 40.28 2di9 n LEU 27 CO 0.65 -0.91 0.80 -2.16 -1.33 0.00 0.00 177.39 174.43 2di9 s PRO 28 N -2.35 3.47 -0.21 3.23 0.04 -1.26 -3.75 135.00 134.17 2di9 s PRO 28 Ca 0.65 1.66 -0.29 0.00 0.04 0.00 0.00 61.00 63.06 2di9 s PRO 28 Cb -0.49 -2.12 -0.03 0.00 0.04 0.00 0.00 34.50 31.90 2di9 s PRO 28 CO 0.55 -0.76 1.60 -1.25 0.04 0.00 0.00 177.00 177.18 2di9 s PRO 29 N -3.12 3.82 -0.53 0.56 0.04 -1.26 -4.09 135.00 130.43 2di9 s PRO 29 Ca 0.70 1.68 -0.05 0.00 0.04 0.00 0.00 61.00 63.37 2di9 s PRO 29 Cb -0.25 -4.02 0.14 0.00 0.04 0.00 0.00 34.50 30.40 2di9 s PRO 29 CO 0.29 -1.26 0.36 -0.51 0.04 0.00 0.00 177.00 175.93 2di9 s ASP 30 N 4.12 5.45 0.31 6.66 1.11 0.14 -4.93 116.67 129.53 2di9 s ASP 30 Ca 0.71 -2.37 0.10 0.00 0.18 0.00 0.00 52.55 51.16 2di9 s ASP 30 Cb -0.25 -1.90 0.49 0.00 1.07 0.00 0.00 42.92 42.33 2di9 s ASP 30 CO 0.29 -0.51 1.70 1.55 1.18 0.00 0.00 175.17 179.38 2di9 h PRO 31 N 7.72 0.08 -0.27 8.23 0.13 -1.86 -2.99 132.00 143.05 2di9 h PRO 31 Ca -0.09 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.98 2di9 h PRO 31 Cb 1.02 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.13 2di9 h PRO 31 CO 0.74 0.55 0.10 0.77 -0.23 0.00 0.00 178.00 179.93 2di9 h SER 32 N 0.07 0.33 1.45 1.44 0.02 -1.93 -0.61 113.55 114.33 2di9 h SER 32 Ca 0.00 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2di9 h SER 32 Cb 0.88 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.33 2di9 h SER 32 CO 0.07 0.32 0.00 0.11 -1.14 0.00 0.00 176.83 176.18 2di9 h LYS 33 N 0.37 0.00 -6.32 3.45 1.79 -1.87 -3.43 116.57 110.57 2di9 h LYS 33 Ca 0.09 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 58.03 2di9 h LYS 33 Cb 0.10 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.67 2di9 h LYS 33 CO -0.01 0.00 1.09 0.08 -1.08 0.00 0.00 179.45 179.53 2di9 s VAL 34 N -3.20 3.68 -0.07 0.50 1.01 -0.24 -4.63 120.40 117.46 2di9 s VAL 34 Ca 0.08 0.39 0.02 0.00 0.00 0.00 0.00 61.98 62.47 2di9 s VAL 34 Cb 0.10 -4.81 -0.02 0.00 0.00 0.00 0.00 36.38 31.64 2di9 s VAL 34 CO 0.58 -1.75 -0.13 -0.54 0.00 0.00 0.00 175.10 173.26 2di9 s LYS 35 N 5.88 2.69 -0.23 2.72 3.01 -1.17 -4.58 119.74 128.07 2di9 s LYS 35 Ca 0.39 -0.67 -0.05 0.00 -1.01 0.00 0.00 55.97 54.63 2di9 s LYS 35 Cb -0.08 -2.46 -0.02 0.00 -1.01 0.00 0.00 37.83 34.26 2di9 s LYS 35 CO 0.16 0.56 0.01 0.00 0.51 0.00 0.00 175.35 176.59 2di9 s ALA 36 N -0.57 2.98 -0.03 5.17 0.00 -1.26 -1.05 121.76 126.99 2di9 s ALA 36 Ca 0.08 -1.15 0.00 0.00 0.00 0.00 0.00 51.96 50.89 2di9 s ALA 36 Cb -0.11 -1.88 0.03 0.00 0.00 0.00 0.00 23.12 21.15 2di9 s ALA 36 CO 0.01 -0.46 0.01 -3.38 0.00 0.00 0.00 175.76 171.95 2di9 s HIS 37 N 1.54 0.26 -4.73 0.00 -3.43 -0.50 -5.00 115.29 103.43 2di9 s HIS 37 Ca 0.06 0.04 0.00 0.00 -0.80 0.00 0.00 55.06 54.36 2di9 s HIS 37 Cb -0.15 -0.41 0.00 0.00 -1.43 0.00 0.00 32.58 30.60 2di9 s HIS 37 CO -0.00 -0.14 0.00 0.41 -2.00 0.00 0.00 174.74 173.01 2di9 n GLY 38 N 4.31 -2.41 0.09 -1.38 0.00 -1.26 -1.86 105.19 102.69 2di9 n GLY 38 Ca -0.24 -1.28 -0.13 0.00 0.00 0.00 0.00 46.02 44.37 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 0.18 -1.40 1.61 0.13 -1.91 -3.13 132.00 127.49 2di9 h PRO 39 Ca 0.00 -0.09 0.40 0.00 -0.87 0.00 0.00 66.00 65.44 2di9 h PRO 39 Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.08 2di9 h PRO 39 CO 0.00 0.62 1.17 0.78 -0.23 0.00 0.00 178.00 180.34 2di9 h GLY 40 N -0.25 0.00 0.12 1.56 0.00 -0.48 0.40 103.07 104.41 2di9 h GLY 40 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.29 2di9 h GLY 40 CO 0.02 0.00 -0.27 1.41 0.00 0.00 0.00 176.54 177.70 2di9 h LEU 41 N 0.00 0.08 -1.04 3.11 3.38 -1.78 -3.34 115.31 115.72 2di9 h LEU 41 Ca 0.66 -0.95 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2di9 h LEU 41 Cb 2.99 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 43.67 2di9 h LEU 41 CO -0.01 1.12 0.57 -0.33 0.09 0.00 0.00 178.44 179.88 2di9 h GLU 42 N -0.88 1.22 0.00 1.13 4.39 -0.35 -3.09 114.58 116.99 2di9 h GLU 42 Ca -0.06 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.55 2di9 h GLU 42 Cb 1.15 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.53 2di9 h GLU 42 CO 0.01 0.84 0.00 0.41 -1.16 0.00 0.00 179.01 179.10 2di9 n GLY 43 N -1.31 -0.17 0.00 -3.84 0.00 0.27 -1.67 105.19 98.47 2di9 n GLY 43 Ca 0.10 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.52 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 -0.16 2.96 2.97 -0.02 0.00 -1.22 -4.21 105.19 105.51 2di9 n GLY 44 Ca 0.00 -0.18 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 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 2.03 0.23 0.99 1.43 -1.26 -1.97 118.68 120.13 2di9 s LEU 45 Ca 0.00 -0.13 -0.31 0.00 -1.03 0.00 0.00 54.13 52.65 2di9 s LEU 45 Cb 0.00 -0.25 -0.13 0.00 0.03 0.00 0.00 46.19 45.83 2di9 s LEU 45 CO 0.00 0.04 1.43 0.52 0.23 0.00 0.00 176.35 178.57 2di9 n VAL 46 N 2.82 0.85 0.00 -1.59 0.31 -1.16 -1.18 118.33 118.38 2di9 n VAL 46 Ca -0.14 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 2di9 n VAL 46 Cb 0.58 -1.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.01 2di9 n VAL 46 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2di9 n GLY 47 N 2.28 2.62 3.82 2.92 0.00 -0.84 -4.76 105.19 111.23 2di9 n GLY 47 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 2di9 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2di9 s LYS 48 N -0.01 4.16 0.66 1.61 1.02 -0.33 -4.85 119.74 122.01 2di9 s LYS 48 Ca 0.00 0.73 -0.15 0.00 0.02 0.00 0.00 55.97 56.57 2di9 s LYS 48 Cb 0.00 -2.95 0.00 0.00 -0.52 0.00 0.00 37.83 34.36 2di9 s LYS 48 CO 0.00 0.46 1.11 -1.25 -0.92 0.00 0.00 175.35 174.75 2di9 s PRO 49 N -1.85 2.78 -0.18 -1.68 0.04 -1.26 -4.26 135.00 128.59 2di9 s PRO 49 Ca 0.39 1.38 -0.08 0.00 0.04 0.00 0.00 61.00 62.73 2di9 s PRO 49 Cb -0.17 -1.95 0.07 0.00 0.04 0.00 0.00 34.50 32.50 2di9 s PRO 49 CO 0.20 -1.27 0.41 0.00 0.04 0.00 0.00 177.00 176.38 2di9 s ALA 50 N -2.36 -1.06 0.33 8.56 0.00 -0.04 -4.81 121.76 122.38 2di9 s ALA 50 Ca 0.67 1.49 0.04 0.00 0.00 0.00 0.00 51.96 54.16 2di9 s ALA 50 Cb -0.20 -1.06 -0.03 0.00 0.00 0.00 0.00 23.12 21.83 2di9 s ALA 50 CO 0.42 -0.43 0.18 -1.83 0.00 0.00 0.00 175.76 174.09 2di9 s GLU 51 N 1.82 1.70 0.33 0.00 -1.05 -1.26 -0.37 118.70 119.88 2di9 s GLU 51 Ca -0.07 -1.99 -0.00 0.00 -0.15 0.00 0.00 54.97 52.76 2di9 s GLU 51 Cb -0.10 -0.13 -0.01 0.00 -0.44 0.00 0.00 34.13 33.46 2di9 s GLU 51 CO -0.13 -0.50 0.41 -0.59 0.95 0.00 0.00 175.26 175.41 2di9 s PHE 52 N -3.48 1.22 -0.19 4.83 -0.71 -1.21 0.13 117.98 118.57 2di9 s PHE 52 Ca 0.34 -1.38 -0.02 0.00 -1.04 0.00 0.00 56.93 54.83 2di9 s PHE 52 Cb 0.04 -0.26 -0.01 0.00 -1.21 0.00 0.00 43.02 41.58 2di9 s PHE 52 CO 0.19 -1.04 -0.08 0.99 -1.34 0.00 0.00 175.22 173.94 2di9 s THR 53 N -3.23 3.25 -0.10 -4.49 2.01 -0.77 -4.29 115.64 108.02 2di9 s THR 53 Ca 0.33 -0.55 -0.03 0.00 0.31 0.00 0.00 61.69 61.75 2di9 s THR 53 Cb 0.01 -2.44 -0.03 0.00 0.01 0.00 0.00 72.50 70.04 2di9 s THR 53 CO 0.21 0.47 0.03 -0.63 -0.69 0.00 0.00 174.62 174.01 2di9 s ILE 54 N 1.04 4.52 -0.46 1.82 1.01 -1.18 -1.42 121.20 126.54 2di9 s ILE 54 Ca 0.00 -0.16 -0.11 0.00 0.00 0.00 0.00 60.65 60.37 2di9 s ILE 54 Cb -0.15 -2.93 0.09 0.00 0.01 0.00 0.00 42.46 39.49 2di9 s ILE 54 CO -0.01 0.59 0.33 -0.62 0.00 0.00 0.00 174.94 175.24 2di9 s ASP 55 N -0.75 5.81 -0.08 3.58 -1.08 -0.22 -3.72 116.67 120.21 2di9 s ASP 55 Ca 0.12 -1.60 0.12 0.00 -0.52 0.00 0.00 52.55 50.67 2di9 s ASP 55 Cb -0.12 -2.05 0.19 0.00 -1.46 0.00 0.00 42.92 39.47 2di9 s ASP 55 CO 0.02 -0.63 1.09 0.35 0.52 0.00 0.00 175.17 176.52 2di9 n THR 56 N 5.01 1.54 -1.69 1.71 -2.24 -0.90 -3.04 114.28 114.66 2di9 n THR 56 Ca -0.10 -1.79 -0.43 0.00 -2.27 0.00 0.00 64.05 59.46 2di9 n THR 56 Cb 0.42 0.03 -0.03 0.00 -2.10 0.00 0.00 70.33 68.65 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 -2.18 3.54 0.00 -0.78 3.01 -1.19 -1.80 119.74 120.34 2di9 s LYS 57 Ca 0.20 2.16 0.00 0.00 -1.01 0.00 0.00 55.97 57.33 2di9 s LYS 57 Cb 0.18 -4.27 0.00 0.00 -1.01 0.00 0.00 37.83 32.73 2di9 s LYS 57 CO 0.02 -1.64 0.00 0.41 0.51 0.00 0.00 175.35 174.65 2di9 n GLY 58 N 5.24 2.73 0.27 -3.33 0.00 -1.26 -4.85 105.19 103.99 2di9 n GLY 58 Ca 0.25 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.50 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 -0.07 0.74 0.00 4.61 0.00 -0.75 -4.85 120.51 120.19 2di9 n ALA 59 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 53.44 54.31 2di9 n ALA 59 Cb 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 -1.28 0.25 3.06 0.00 0.00 -1.26 0.27 105.19 106.24 2di9 n GLY 60 Ca 0.28 -1.79 -0.08 0.00 0.00 0.00 0.00 46.02 44.43 2di9 n GLY 60 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2di9 s THR 61 N -1.15 0.21 0.00 2.61 -1.32 -1.25 -4.97 115.64 109.78 2di9 s THR 61 Ca 0.00 -1.57 0.00 0.00 -1.21 0.00 0.00 61.69 58.91 2di9 s THR 61 Cb 0.00 -1.19 0.00 0.00 -1.51 0.00 0.00 72.50 69.80 2di9 s THR 61 CO 0.00 -0.86 0.00 0.61 -2.21 0.00 0.00 174.62 172.16 2di9 n GLY 62 N 0.51 -0.40 3.12 6.08 0.00 -1.26 -4.25 105.19 109.00 2di9 n GLY 62 Ca -0.17 -0.45 -0.21 0.00 0.00 0.00 0.00 46.02 45.19 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 0.73 -0.07 -0.02 0.00 -1.26 -5.02 107.32 101.68 2di9 s GLY 63 Ca 0.00 -0.69 0.05 0.00 0.00 0.00 0.00 44.72 44.08 2di9 s GLY 63 CO 0.00 -0.62 -0.25 -2.27 0.00 0.00 0.00 173.10 169.97 2di9 s LEU 64 N -0.64 2.08 -0.25 0.66 2.96 -1.26 0.42 118.68 122.65 2di9 s LEU 64 Ca 0.04 -0.53 -0.04 0.00 -0.22 0.00 0.00 54.13 53.38 2di9 s LEU 64 Cb -0.06 -1.38 0.00 0.00 0.50 0.00 0.00 46.19 45.25 2di9 s LEU 64 CO 0.00 0.21 -0.01 -0.83 -1.32 0.00 0.00 176.35 174.41 2di9 s GLY 65 N 0.02 1.67 -0.24 7.98 0.00 -0.24 -5.00 107.32 111.51 2di9 s GLY 65 Ca -0.09 -1.31 -0.00 0.00 0.00 0.00 0.00 44.72 43.32 2di9 s GLY 65 CO 0.06 0.51 -0.10 -2.27 0.00 0.00 0.00 173.10 171.30 2di9 s LEU 66 N 1.46 3.02 -0.05 0.66 2.96 -1.25 -2.71 118.68 122.77 2di9 s LEU 66 Ca 0.04 -0.93 0.02 0.00 -0.22 0.00 0.00 54.13 53.03 2di9 s LEU 66 Cb -0.16 -1.60 0.02 0.00 0.50 0.00 0.00 46.19 44.95 2di9 s LEU 66 CO -0.02 -0.11 -0.07 0.42 -1.32 0.00 0.00 176.35 175.25 2di9 s THR 67 N 1.27 0.72 -0.50 3.68 -4.23 -1.11 -4.96 115.64 110.51 2di9 s THR 67 Ca -0.01 -0.25 -0.23 0.00 -1.18 0.00 0.00 61.69 60.02 2di9 s THR 67 Cb -0.17 -0.70 0.03 0.00 1.34 0.00 0.00 72.50 73.01 2di9 s THR 67 CO -0.06 0.26 0.85 -0.69 -0.54 0.00 0.00 174.62 174.43 2di9 s VAL 68 N 0.74 4.55 -1.37 2.29 1.01 -1.26 -1.07 120.40 125.29 2di9 s VAL 68 Ca -0.12 0.32 -0.08 0.00 0.00 0.00 0.00 61.98 62.10 2di9 s VAL 68 Cb -0.14 -4.42 0.10 0.00 0.00 0.00 0.00 36.38 31.92 2di9 s VAL 68 CO 0.01 -0.89 2.29 -0.62 0.00 0.00 0.00 175.10 175.89 2di9 n GLU 69 N 7.01 4.01 -3.76 2.72 -0.58 0.51 -4.88 120.64 125.66 2di9 n GLU 69 Ca 0.02 -3.23 -0.23 0.00 -0.42 0.00 0.00 57.16 53.30 2di9 n GLU 69 Cb 0.48 -2.81 -0.03 0.00 -0.57 0.00 0.00 31.44 28.52 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 1.02 2.25 0.45 0.62 0.00 -1.26 -3.60 107.32 106.80 2di9 s GLY 70 Ca 0.51 -1.70 0.30 0.00 0.00 0.00 0.00 44.72 43.83 2di9 s GLY 70 CO -0.06 -1.83 1.90 -0.56 0.00 0.00 0.00 173.10 172.55 2di9 h PRO 71 N 0.96 0.00 -5.24 2.90 0.13 -1.93 -3.45 132.00 125.38 2di9 h PRO 71 Ca -0.39 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.10 2di9 h PRO 71 Cb 1.28 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.28 2di9 h PRO 71 CO 0.59 0.00 -0.53 0.00 -0.23 0.00 0.00 178.00 177.82 2di9 s GLU 73 N -3.82 3.42 -0.04 0.00 2.12 -1.26 -4.99 118.70 114.12 2di9 s GLU 73 Ca 0.16 -2.53 -0.17 0.00 0.36 0.00 0.00 54.97 52.78 2di9 s GLU 73 Cb 0.04 -4.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.09 2di9 s GLU 73 CO 0.08 -1.26 0.47 0.00 -0.54 0.00 0.00 175.26 174.01 2di9 s ALA 74 N 0.01 3.57 0.72 6.30 0.00 -1.26 -4.95 121.76 126.16 2di9 s ALA 74 Ca 0.19 -0.16 -0.15 0.00 0.00 0.00 0.00 51.96 51.83 2di9 s ALA 74 Cb -0.12 -2.55 0.03 0.00 0.00 0.00 0.00 23.12 20.48 2di9 s ALA 74 CO -0.08 0.24 1.21 0.21 0.00 0.00 0.00 175.76 177.34 2di9 s LYS 75 N -0.28 2.20 -0.09 0.00 2.47 -1.24 -4.85 119.74 117.95 2di9 s LYS 75 Ca 0.26 1.76 -0.02 0.00 -1.56 0.00 0.00 55.97 56.41 2di9 s LYS 75 Cb -0.16 -1.84 0.04 0.00 -1.46 0.00 0.00 37.83 34.40 2di9 s LYS 75 CO 0.13 -1.79 0.04 0.42 0.16 0.00 0.00 175.35 174.31 2di9 s ILE 76 N -1.96 0.18 -0.45 5.43 1.01 -1.26 -2.88 121.20 121.28 2di9 s ILE 76 Ca 0.75 0.09 -0.08 0.00 0.00 0.00 0.00 60.65 61.40 2di9 s ILE 76 Cb -0.29 -0.49 0.11 0.00 0.01 0.00 0.00 42.46 41.80 2di9 s ILE 76 CO 0.44 0.10 0.30 -1.61 0.00 0.00 0.00 174.94 174.17 2di9 s GLU 77 N 2.04 2.45 -0.94 2.79 0.41 -0.09 -4.98 118.70 120.37 2di9 s GLU 77 Ca 0.04 -1.68 -0.22 0.00 -0.41 0.00 0.00 54.97 52.70 2di9 s GLU 77 Cb -0.13 -3.83 0.08 0.00 -1.78 0.00 0.00 34.13 28.46 2di9 s GLU 77 CO -0.05 -1.11 1.30 0.00 -0.49 0.00 0.00 175.26 174.91 2di9 s SER 79 N 4.35 6.79 -0.06 0.00 0.01 -1.24 -4.96 113.70 118.59 2di9 s SER 79 Ca 0.39 1.21 0.03 0.00 1.31 0.00 0.00 55.95 58.89 2di9 s SER 79 Cb -0.03 -2.34 -0.02 0.00 0.21 0.00 0.00 66.02 63.83 2di9 s SER 79 CO -0.07 -0.11 -0.14 -1.81 0.41 0.00 0.00 173.24 171.53 2di9 s ASP 80 N -2.14 4.05 -0.23 2.44 1.11 -1.26 -2.45 116.67 118.19 2di9 s ASP 80 Ca 0.49 -0.21 -0.12 0.00 0.18 0.00 0.00 52.55 52.89 2di9 s ASP 80 Cb -0.12 -0.97 -0.17 0.00 1.07 0.00 0.00 42.92 42.72 2di9 s ASP 80 CO 0.19 0.32 -0.05 0.59 1.18 0.00 0.00 175.17 177.40 2di9 n ASN 81 N 2.49 1.96 0.00 0.27 3.02 -1.18 -4.95 115.26 116.86 2di9 n ASN 81 Ca -0.17 0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.64 2di9 n ASN 81 Cb 0.52 -0.80 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 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 1.60 1.93 1.74 7.41 0.00 -1.26 -4.92 105.19 111.68 2di9 n GLY 82 Ca -0.43 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.58 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 4.56 -0.03 1.61 -0.08 -1.26 -4.85 116.55 116.50 2di9 n ASP 83 Ca 0.00 -2.90 0.00 0.00 -1.51 0.00 0.00 54.79 50.38 2di9 n ASP 83 Cb 0.00 -0.69 0.00 0.00 2.34 0.00 0.00 41.12 42.77 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 0.17 0.60 3.09 0.27 0.00 -1.26 -4.86 105.19 103.20 2di9 n GLY 84 Ca 0.29 -0.77 -0.07 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.06 0.23 -0.04 2.61 -4.23 -1.26 -2.12 115.64 108.77 2di9 s THR 85 Ca 0.00 -1.79 0.04 0.00 -1.18 0.00 0.00 61.69 58.76 2di9 s THR 85 Cb 0.00 -1.49 -0.00 0.00 1.34 0.00 0.00 72.50 72.35 2di9 s THR 85 CO 0.00 -0.98 -0.15 0.00 -0.54 0.00 0.00 174.62 172.94 2di9 n SER 87 N 3.20 3.72 -4.72 0.00 7.64 -1.02 -3.07 113.62 119.36 2di9 n SER 87 Ca -0.18 -3.44 -0.42 0.00 1.01 0.00 0.00 58.87 55.84 2di9 n SER 87 Cb 0.53 -0.67 -0.04 0.00 -1.01 0.00 0.00 64.21 63.03 2di9 n SER 87 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2di9 s VAL 88 N -2.52 4.24 -0.09 0.44 1.01 -1.26 -3.64 120.40 118.58 2di9 s VAL 88 Ca 0.40 1.74 0.03 0.00 0.00 0.00 0.00 61.98 64.16 2di9 s VAL 88 Cb 0.15 -4.11 0.01 0.00 0.00 0.00 0.00 36.38 32.43 2di9 s VAL 88 CO -0.02 0.21 -0.20 -0.94 0.00 0.00 0.00 175.10 174.16 2di9 s SER 89 N 0.48 2.64 0.17 3.32 1.04 -0.40 -3.34 113.70 117.61 2di9 s SER 89 Ca 0.52 -0.47 0.11 0.00 0.48 0.00 0.00 55.95 56.59 2di9 s SER 89 Cb -0.27 -1.21 -0.04 0.00 0.10 0.00 0.00 66.02 64.60 2di9 s SER 89 CO 0.31 0.11 -0.23 -0.72 0.98 0.00 0.00 173.24 173.69 2di9 s TYR 90 N 0.49 2.35 -0.29 5.02 -0.85 0.50 -0.92 117.35 123.65 2di9 s TYR 90 Ca -0.16 -0.35 0.01 0.00 -0.52 0.00 0.00 57.07 56.05 2di9 s TYR 90 Cb -0.17 -1.20 0.08 0.00 0.38 0.00 0.00 41.96 41.06 2di9 s TYR 90 CO 0.06 0.45 0.02 -0.51 -1.52 0.00 0.00 175.55 174.06 2di9 s LEU 91 N -2.48 3.24 1.03 -3.49 1.43 -1.14 -0.86 118.68 116.41 2di9 s LEU 91 Ca 0.19 -1.64 -0.13 0.00 -1.03 0.00 0.00 54.13 51.52 2di9 s LEU 91 Cb -0.09 -1.25 0.20 0.00 0.03 0.00 0.00 46.19 45.09 2di9 s LEU 91 CO 0.09 -0.33 1.09 -2.16 0.23 0.00 0.00 176.35 175.27 2di9 s PRO 92 N 1.28 0.19 0.00 1.29 0.04 -1.26 -3.68 135.00 132.87 2di9 s PRO 92 Ca 0.04 0.44 0.00 0.00 0.04 0.00 0.00 61.00 61.52 2di9 s PRO 92 Cb -0.18 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.64 2di9 s PRO 92 CO -0.12 -2.87 0.00 -2.37 0.04 0.00 0.00 177.00 171.68 2di9 n THR 93 N -4.26 0.00 -4.02 1.26 5.66 -1.26 -1.99 114.28 109.67 2di9 n THR 93 Ca 0.06 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.93 2di9 n THR 93 Cb 0.58 -0.64 -0.13 0.00 -1.55 0.00 0.00 70.33 68.59 2di9 n THR 93 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 2di9 s LYS 94 N -1.64 0.33 0.05 1.09 -2.85 -1.26 -4.70 119.74 110.76 2di9 s LYS 94 Ca 0.00 -0.43 -0.31 0.00 -1.00 0.00 0.00 55.97 54.24 2di9 s LYS 94 Cb 0.00 -0.14 -0.07 0.00 -2.06 0.00 0.00 37.83 35.56 2di9 s LYS 94 CO 0.00 0.02 1.41 -1.25 0.10 0.00 0.00 175.35 175.63 2di9 s PRO 95 N -0.89 4.30 0.00 1.78 0.04 -1.26 -4.82 135.00 134.15 2di9 s PRO 95 Ca -0.07 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.00 2di9 s PRO 95 Cb -0.06 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 31.04 2di9 s PRO 95 CO -0.00 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 176.93 2di9 n GLY 96 N 3.59 -0.10 3.13 0.56 0.00 -1.22 -5.00 105.19 106.15 2di9 n GLY 96 Ca 0.12 0.57 -0.11 0.00 0.00 0.00 0.00 46.02 46.60 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 2.89 0.24 -0.19 1.61 8.01 -1.26 -2.63 118.70 127.37 2di9 s GLU 97 Ca 0.00 0.83 -0.01 0.00 0.01 0.00 0.00 54.97 55.80 2di9 s GLU 97 Cb 0.00 0.08 0.01 0.00 -4.31 0.00 0.00 34.13 29.91 2di9 s GLU 97 CO 0.00 -0.25 -0.14 0.71 0.01 0.00 0.00 175.26 175.59 2di9 s TYR 98 N 2.25 2.85 -0.38 1.61 1.51 -1.04 -4.34 117.35 119.81 2di9 s TYR 98 Ca -0.02 -1.36 -0.18 0.00 -1.01 0.00 0.00 57.07 54.50 2di9 s TYR 98 Cb -0.11 -1.99 0.01 0.00 -0.11 0.00 0.00 41.96 39.75 2di9 s TYR 98 CO -0.10 -0.70 0.49 -0.06 -1.11 0.00 0.00 175.55 174.07 2di9 s PHE 99 N 1.34 3.16 -0.54 2.71 0.08 -1.24 -1.61 117.98 121.88 2di9 s PHE 99 Ca 0.05 -0.05 -0.25 0.00 0.12 0.00 0.00 56.93 56.80 2di9 s PHE 99 Cb -0.14 -2.95 0.04 0.00 -0.57 0.00 0.00 43.02 39.40 2di9 s PHE 99 CO -0.09 -0.62 0.99 0.08 -0.10 0.00 0.00 175.22 175.48 2di9 s VAL 100 N 2.34 4.33 -0.42 -0.44 1.01 -1.20 -0.36 120.40 125.66 2di9 s VAL 100 Ca 0.16 0.49 -0.29 0.00 0.00 0.00 0.00 61.98 62.34 2di9 s VAL 100 Cb -0.16 -4.56 0.03 0.00 0.00 0.00 0.00 36.38 31.69 2di9 s VAL 100 CO 0.14 -1.11 1.11 0.20 0.00 0.00 0.00 175.10 175.44 2di9 s ASN 101 N 2.76 6.73 -0.30 3.32 0.01 -0.23 -2.22 114.94 125.00 2di9 s ASN 101 Ca 0.34 0.65 -0.03 0.00 -0.71 0.00 0.00 52.86 53.11 2di9 s ASN 101 Cb -0.11 -2.54 0.04 0.00 0.41 0.00 0.00 41.25 39.05 2di9 s ASN 101 CO 0.22 -1.12 0.03 -0.63 -1.51 0.00 0.00 177.10 174.09 2di9 s ILE 102 N 4.15 3.28 -0.05 0.60 1.01 -1.26 -2.75 121.20 126.18 2di9 s ILE 102 Ca 0.47 -1.21 0.01 0.00 0.00 0.00 0.00 60.65 59.92 2di9 s ILE 102 Cb -0.09 -2.83 0.02 0.00 0.01 0.00 0.00 42.46 39.57 2di9 s ILE 102 CO 0.26 -0.08 -0.07 -1.48 0.00 0.00 0.00 174.94 173.57 2di9 s LEU 103 N 1.32 1.42 -0.39 2.97 0.05 -1.10 -1.76 118.68 121.20 2di9 s LEU 103 Ca -0.03 -0.19 -0.13 0.00 0.05 0.00 0.00 54.13 53.84 2di9 s LEU 103 Cb -0.19 -0.58 0.03 0.00 -2.05 0.00 0.00 46.19 43.39 2di9 s LEU 103 CO -0.00 -0.03 0.25 0.12 -0.55 0.00 0.00 176.35 176.14 2di9 s PHE 104 N 0.86 3.24 -1.13 3.48 5.36 0.75 -1.08 117.98 129.46 2di9 s PHE 104 Ca -0.12 -0.82 -0.04 0.00 -0.96 0.00 0.00 56.93 55.00 2di9 s PHE 104 Cb -0.15 -2.50 0.00 0.00 -0.34 0.00 0.00 43.02 40.03 2di9 s PHE 104 CO 0.01 -0.63 0.97 0.39 -1.46 0.00 0.00 175.22 174.50 2di9 n GLU 105 N 5.06 -6.47 -2.34 10.12 -0.58 0.17 -2.32 120.64 124.28 2di9 n GLU 105 Ca -0.11 0.75 -0.12 0.00 -0.42 0.00 0.00 57.16 57.25 2di9 n GLU 105 Cb 0.46 -5.50 0.00 0.00 -0.57 0.00 0.00 31.44 25.83 2di9 n GLU 105 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2di9 n GLU 106 N -4.13 -1.41 -3.78 3.49 1.02 -1.26 -5.01 120.64 109.56 2di9 n GLU 106 Ca -0.13 0.56 -0.28 0.00 -0.02 0.00 0.00 57.16 57.28 2di9 n GLU 106 Cb 0.61 -4.68 -0.16 0.00 -0.02 0.00 0.00 31.44 27.18 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 -2.67 0.74 -0.07 2.62 1.01 -0.98 -5.10 120.40 115.95 2di9 s VAL 107 Ca 0.04 -0.68 -0.29 0.00 0.00 0.00 0.00 61.98 61.05 2di9 s VAL 107 Cb -0.02 -1.18 -0.06 0.00 0.00 0.00 0.00 36.38 35.11 2di9 s VAL 107 CO 0.05 -0.17 1.90 -1.00 0.00 0.00 0.00 175.10 175.89 2di9 s HIS 108 N 1.76 1.52 0.64 5.22 3.76 -1.26 -0.17 115.29 126.75 2di9 s HIS 108 Ca -0.02 0.01 -0.17 0.00 -0.15 0.00 0.00 55.06 54.73 2di9 s HIS 108 Cb -0.17 -4.08 -0.01 0.00 1.11 0.00 0.00 32.58 29.43 2di9 s HIS 108 CO -0.07 -4.55 1.20 0.96 -0.85 0.00 0.00 174.74 171.43 2di9 s ILE 109 N 5.25 2.59 -1.08 0.60 -4.36 -0.72 -4.87 121.20 118.60 2di9 s ILE 109 Ca 0.85 0.33 -0.23 0.00 -0.26 0.00 0.00 60.65 61.34 2di9 s ILE 109 Cb -0.36 -3.02 -0.07 0.00 1.25 0.00 0.00 42.46 40.25 2di9 s ILE 109 CO 0.36 -0.11 1.94 -2.16 0.24 0.00 0.00 174.94 175.21 2di9 s PRO 110 N -3.58 2.52 0.00 0.37 0.04 -1.26 -2.32 135.00 130.77 2di9 s PRO 110 Ca 0.76 -0.84 0.00 0.00 0.04 0.00 0.00 61.00 60.96 2di9 s PRO 110 Cb -0.29 -5.18 0.00 0.00 0.04 0.00 0.00 34.50 29.07 2di9 s PRO 110 CO 0.38 -3.75 0.00 0.41 0.04 0.00 0.00 177.00 174.07 2di9 n GLY 111 N 6.20 0.24 3.84 0.56 0.00 -1.26 -4.95 105.19 109.82 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 -1.35 0.00 0.00 0.00 173.32 171.97 2di9 s SER 112 N 0.00 5.74 1.07 1.61 1.04 -0.98 -4.21 113.70 117.97 2di9 s SER 112 Ca 0.00 -0.05 -0.14 0.00 0.48 0.00 0.00 55.95 56.24 2di9 s SER 112 Cb 0.00 -1.57 0.22 0.00 0.10 0.00 0.00 66.02 64.78 2di9 s SER 112 CO 0.00 0.06 1.10 -2.16 0.98 0.00 0.00 173.24 173.22 2di9 s PRO 113 N -3.13 -0.14 -0.39 4.02 0.04 -1.26 -4.84 135.00 129.30 2di9 s PRO 113 Ca 0.32 0.32 -0.01 0.00 0.04 0.00 0.00 61.00 61.67 2di9 s PRO 113 Cb -0.10 -1.69 0.11 0.00 0.04 0.00 0.00 34.50 32.86 2di9 s PRO 113 CO 0.25 -3.07 0.16 -0.06 0.04 0.00 0.00 177.00 174.31 2di9 s PHE 114 N -2.98 3.65 -0.09 0.56 0.40 -0.94 -4.85 117.98 113.73 2di9 s PHE 114 Ca 0.67 -2.61 -0.32 0.00 -0.60 0.00 0.00 56.93 54.08 2di9 s PHE 114 Cb -0.16 -3.13 -0.09 0.00 0.51 0.00 0.00 43.02 40.14 2di9 s PHE 114 CO 0.57 -0.97 2.01 1.17 0.70 0.00 0.00 175.22 178.70 2di9 n LYS 115 N 4.48 2.30 -3.83 0.44 4.81 -1.26 -3.24 118.16 121.87 2di9 n LYS 115 Ca -0.00 0.80 -0.36 0.00 -0.87 0.00 0.00 58.31 57.88 2di9 n LYS 115 Cb 0.42 -2.88 -0.12 0.00 0.02 0.00 0.00 35.03 32.46 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 5.32 3.02 -0.38 3.14 0.00 -0.63 -4.50 121.76 127.72 2di9 s ALA 116 Ca 0.94 -2.19 -0.29 0.00 0.00 0.00 0.00 51.96 50.42 2di9 s ALA 116 Cb -0.54 -2.22 0.01 0.00 0.00 0.00 0.00 23.12 20.37 2di9 s ALA 116 CO 0.45 -1.57 1.34 0.34 0.00 0.00 0.00 175.76 176.32 2di9 s ASP 117 N 1.56 6.48 0.00 0.00 2.15 -0.67 -2.50 116.67 123.69 2di9 s ASP 117 Ca 0.03 0.90 -0.17 0.00 0.43 0.00 0.00 52.55 53.74 2di9 s ASP 117 Cb -0.21 -2.54 -0.06 0.00 -0.30 0.00 0.00 42.92 39.81 2di9 s ASP 117 CO -0.03 -1.30 0.46 -0.63 -0.17 0.00 0.00 175.17 173.51 2di9 s ILE 118 N 4.98 4.97 0.20 4.11 -1.09 -1.08 -3.43 121.20 129.88 2di9 s ILE 118 Ca 0.58 0.96 0.10 0.00 -2.23 0.00 0.00 60.65 60.06 2di9 s ILE 118 Cb -0.14 -3.78 -0.04 0.00 -1.58 0.00 0.00 42.46 36.92 2di9 s ILE 118 CO 0.29 0.53 -0.21 -1.61 -1.23 0.00 0.00 174.94 172.72 2di9 s GLU 119 N -0.81 1.46 0.10 2.79 2.02 -0.83 -3.45 118.70 119.97 2di9 s GLU 119 Ca 0.25 -1.55 -0.30 0.00 0.02 0.00 0.00 54.97 53.40 2di9 s GLU 119 Cb -0.17 -1.61 -0.06 0.00 0.10 0.00 0.00 34.13 32.39 2di9 s GLU 119 CO 0.14 0.33 1.11 -1.64 0.02 0.00 0.00 175.26 175.22 2di9 s MET 120 N -2.97 4.53 0.83 1.61 -1.94 -1.26 -2.99 119.30 117.12 2di9 s MET 120 Ca 0.21 1.67 -0.11 0.00 -1.71 0.00 0.00 55.69 55.75 2di9 s MET 120 Cb -0.06 -3.34 0.09 0.00 2.01 0.00 0.00 34.83 33.53 2di9 s MET 120 CO 0.10 -0.07 1.09 -1.25 -0.01 0.00 0.00 175.02 174.88 2di9 s PRO 121 N 0.44 1.77 -0.23 2.03 0.04 -1.26 -4.97 135.00 132.83 2di9 s PRO 121 Ca 0.53 1.00 -0.16 0.00 0.04 0.00 0.00 61.00 62.42 2di9 s PRO 121 Cb -0.28 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 2di9 s PRO 121 CO 0.31 -1.93 0.40 -0.06 0.04 0.00 0.00 177.00 175.76 2di9 s PHE 122 N -2.92 3.33 0.46 0.56 0.40 -1.26 -5.04 117.98 113.52 2di9 s PHE 122 Ca 0.62 0.56 -0.20 0.00 -0.60 0.00 0.00 56.93 57.31 2di9 s PHE 122 Cb -0.18 -2.55 -0.13 0.00 0.51 0.00 0.00 43.02 40.67 2di9 s PHE 122 CO 0.56 -0.09 0.30 -0.25 0.70 0.00 0.00 175.22 176.45 2di9 n ASP 123 N 4.79 -1.93 0.17 1.36 8.00 -1.26 -4.86 116.55 122.83 2di9 n ASP 123 Ca -0.08 0.80 0.02 0.00 0.71 0.00 0.00 54.79 56.25 2di9 n ASP 123 Cb 0.51 -1.02 0.32 0.00 -0.02 0.00 0.00 41.12 40.90 2di9 n ASP 123 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2di9 h PRO 124 N 0.41 0.00 -6.12 -0.24 0.13 -2.07 -3.46 132.00 120.66 2di9 h PRO 124 Ca -0.41 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.11 2di9 h PRO 124 Cb 1.42 0.00 0.15 0.00 0.13 0.00 0.00 31.00 32.70 2di9 h PRO 124 CO 0.48 0.44 -0.76 0.43 -0.23 0.00 0.00 178.00 178.35 2di9 n SER 125 N -3.88 -2.19 -1.93 1.44 7.64 -1.26 -4.91 113.62 108.53 2di9 n SER 125 Ca -0.01 0.84 -0.13 0.00 1.01 0.00 0.00 58.87 60.58 2di9 n SER 125 Cb 0.48 -0.96 0.06 0.00 -1.01 0.00 0.00 64.21 62.77 2di9 n SER 125 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2di9 n SER 126 N 1.95 3.56 0.00 6.43 3.41 -1.26 -5.09 113.62 122.61 2di9 n SER 126 Ca 0.11 -3.35 0.00 0.00 -0.26 0.00 0.00 58.87 55.38 2di9 n SER 126 Cb 0.40 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2di9 n SER 126 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2di9 n GLY 127 N -0.69 -0.72 0.20 5.00 0.00 -1.26 -4.71 105.19 103.01 2di9 n GLY 127 Ca 0.31 -1.58 0.07 0.00 0.00 0.00 0.00 46.02 44.82 2di9 n GLY 127 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2di9 h PRO 128 N 0.00 0.00 -6.20 1.61 0.13 -2.05 -3.43 132.00 122.06 2di9 h PRO 128 Ca 0.00 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.57 2di9 h PRO 128 Cb 0.00 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.14 2di9 h PRO 128 CO 0.00 0.32 1.33 -1.54 -0.23 0.00 0.00 178.00 177.87 2di9 s SER 129 N -6.46 6.05 0.10 1.44 1.04 -1.26 -4.97 113.70 109.64 2di9 s SER 129 Ca -0.01 2.26 0.07 0.00 0.48 0.00 0.00 55.95 58.76 2di9 s SER 129 Cb 0.12 -2.52 -0.03 0.00 0.10 0.00 0.00 66.02 63.68 2di9 s SER 129 CO 0.67 -1.43 -0.18 -0.44 0.98 0.00 0.00 173.24 172.84 2di9 s SER 130 N 5.95 2.26 0.00 7.02 0.01 -1.26 -5.05 113.70 122.63 2di9 s SER 130 Ca 0.92 -0.70 0.00 0.00 1.31 0.00 0.00 55.95 57.48 2di9 s SER 130 Cb -0.37 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 65.75 2di9 s SER 130 CO 0.38 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.63