#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl0 s SER 2 N 0.00 -0.48 -0.07 1.61 0.15 -1.26 -5.18 113.70 108.47 2dl0 s SER 2 Ca 0.00 0.82 -0.31 0.00 0.70 0.00 0.00 55.95 57.16 2dl0 s SER 2 Cb 0.00 1.05 0.08 0.00 -1.71 0.00 0.00 66.02 65.44 2dl0 s SER 2 CO 0.00 -0.13 0.73 -0.55 1.20 0.00 0.00 173.24 174.49 2dl0 s SER 3 N 0.89 -0.61 -0.00 5.45 0.15 -1.26 -5.18 113.70 113.14 2dl0 s SER 3 Ca -0.04 0.68 -0.28 0.00 0.70 0.00 0.00 55.95 57.01 2dl0 s SER 3 Cb -0.04 0.52 0.10 0.00 -1.71 0.00 0.00 66.02 64.88 2dl0 s SER 3 CO -0.12 -0.56 0.84 -0.83 1.20 0.00 0.00 173.24 173.77 2dl0 s GLY 4 N -1.15 -0.47 0.00 9.45 0.00 -1.26 -5.18 107.32 108.70 2dl0 s GLY 4 Ca -0.09 1.08 0.00 0.00 0.00 0.00 0.00 44.72 45.71 2dl0 s GLY 4 CO 0.08 0.44 0.00 1.44 0.00 0.00 0.00 173.10 175.06 2dl0 n SER 5 N -0.06 0.00 -0.08 1.64 7.64 -1.26 -5.09 113.62 116.41 2dl0 n SER 5 Ca -0.11 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.69 2dl0 n SER 5 Cb 0.61 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.79 2dl0 n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dl0 n SER 6 N 0.00 1.74 -1.70 6.43 2.88 -1.26 -5.12 113.62 116.60 2dl0 n SER 6 Ca 0.00 0.32 0.00 0.00 -1.33 0.00 0.00 58.87 57.86 2dl0 n SER 6 Cb 0.00 -0.72 0.00 0.00 -0.75 0.00 0.00 64.21 62.74 2dl0 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dl0 n GLY 7 N 1.47 -4.67 3.86 0.46 0.00 -1.26 -4.94 105.19 100.11 2dl0 n GLY 7 Ca -0.12 -0.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 2dl0 n GLY 7 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dl0 s GLY 8 N -3.81 1.63 0.33 -0.02 0.00 -1.26 -4.91 107.32 99.28 2dl0 s GLY 8 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.42 2dl0 s GLY 8 CO 0.00 0.09 0.00 0.61 0.00 0.00 0.00 173.10 173.80 2dl0 n GLY 9 N -2.70 -2.36 1.22 0.20 0.00 -1.26 -4.95 105.19 95.33 2dl0 n GLY 9 Ca 0.07 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.87 2dl0 n GLY 9 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dl0 n LEU 10 N -3.73 0.14 -3.49 0.99 0.00 -1.26 -5.10 117.00 104.56 2dl0 n LEU 10 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 56.01 56.02 2dl0 n LEU 10 Cb 0.48 -0.03 -0.05 0.00 0.00 0.00 0.00 43.42 43.82 2dl0 n LEU 10 CO 0.02 -0.22 0.60 0.28 0.00 0.00 0.00 177.39 178.07 2dl0 s THR 11 N -2.00 -0.40 -0.27 1.96 -1.32 -1.26 -5.07 115.64 107.28 2dl0 s THR 11 Ca 0.00 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.45 2dl0 s THR 11 Cb 0.00 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 70.00 2dl0 s THR 11 CO 0.00 0.00 0.05 -0.62 -2.21 0.00 0.00 174.62 171.84 2dl0 n GLU 12 N 4.66 -3.65 -3.42 7.08 1.02 -1.26 -4.95 120.64 120.12 2dl0 n GLU 12 Ca -0.12 2.88 -0.43 0.00 -0.02 0.00 0.00 57.16 59.47 2dl0 n GLU 12 Cb 0.54 -5.19 -0.10 0.00 -0.02 0.00 0.00 31.44 26.67 2dl0 n GLU 12 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2dl0 s ILE 13 N -1.42 5.21 -0.30 -3.67 1.01 -1.26 -4.94 121.20 115.84 2dl0 s ILE 13 Ca -0.06 -0.56 -0.12 0.00 0.00 0.00 0.00 60.65 59.91 2dl0 s ILE 13 Cb 0.00 -3.95 0.20 0.00 0.01 0.00 0.00 42.46 38.72 2dl0 s ILE 13 CO 0.76 -0.33 1.15 0.00 0.00 0.00 0.00 174.94 176.52 2dl0 n ARG 15 N 3.32 0.00 -3.52 0.00 1.74 -1.26 -5.15 116.66 111.79 2dl0 n ARG 15 Ca 0.05 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.78 2dl0 n ARG 15 Cb 0.65 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 32.04 2dl0 n ARG 15 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 2dl0 s LYS 16 N 0.00 3.83 1.00 5.56 -2.85 -1.26 -5.09 119.74 120.93 2dl0 s LYS 16 Ca 0.00 0.27 -0.12 0.00 -1.00 0.00 0.00 55.97 55.12 2dl0 s LYS 16 Cb 0.00 -3.01 0.19 0.00 -2.06 0.00 0.00 37.83 32.95 2dl0 s LYS 16 CO 0.00 0.56 1.09 -1.25 0.10 0.00 0.00 175.35 175.85 2dl0 s PRO 17 N -1.82 0.40 -0.34 1.78 0.04 -1.26 -4.97 135.00 128.84 2dl0 s PRO 17 Ca 0.33 0.52 -0.28 0.00 0.04 0.00 0.00 61.00 61.61 2dl0 s PRO 17 Cb -0.14 -1.73 0.02 0.00 0.04 0.00 0.00 34.50 32.68 2dl0 s PRO 17 CO 0.18 -2.75 1.01 0.14 0.04 0.00 0.00 177.00 175.62 2dl0 s VAL 18 N -2.96 4.55 -0.14 -0.36 -7.23 -1.26 -5.00 120.40 108.00 2dl0 s VAL 18 Ca 0.65 1.53 -0.23 0.00 -1.81 0.00 0.00 61.98 62.12 2dl0 s VAL 18 Cb -0.19 -4.37 0.06 0.00 0.56 0.00 0.00 36.38 32.44 2dl0 s VAL 18 CO 0.58 -0.49 0.59 -0.55 -0.31 0.00 0.00 175.10 174.92 2dl0 s SER 19 N 1.73 -0.58 0.06 4.85 0.15 -1.26 -5.07 113.70 113.59 2dl0 s SER 19 Ca 0.42 0.90 -0.18 0.00 0.70 0.00 0.00 55.95 57.79 2dl0 s SER 19 Cb -0.12 0.89 -0.12 0.00 -1.71 0.00 0.00 66.02 64.95 2dl0 s SER 19 CO 0.16 -0.37 1.37 1.55 1.20 0.00 0.00 173.24 177.16 2dl0 h PRO 20 N 4.30 0.48 0.00 5.44 0.13 -2.00 -3.47 132.00 136.89 2dl0 h PRO 20 Ca -0.28 -0.26 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 2dl0 h PRO 20 Cb 1.16 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2dl0 h PRO 20 CO 0.25 0.83 0.00 0.41 -0.23 0.00 0.00 178.00 179.26 2dl0 n GLY 21 N 0.18 2.94 3.51 1.56 0.00 -1.26 -4.96 105.19 107.16 2dl0 n GLY 21 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 2dl0 n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dl0 s ILE 23 N 3.46 4.77 0.00 0.00 1.01 -1.26 -4.99 121.20 124.19 2dl0 s ILE 23 Ca 0.27 -0.37 0.00 0.00 0.00 0.00 0.00 60.65 60.54 2dl0 s ILE 23 Cb -0.14 -3.17 0.00 0.00 0.01 0.00 0.00 42.46 39.16 2dl0 s ILE 23 CO 0.18 0.37 0.00 -0.24 0.00 0.00 0.00 174.94 175.25 2dl0 n SER 24 N 1.23 1.85 -3.69 3.58 2.88 -1.26 -5.05 113.62 113.16 2dl0 n SER 24 Ca -0.13 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.17 2dl0 n SER 24 Cb 0.53 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.91 2dl0 n SER 24 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dl0 n SER 25 N -2.35 0.62 -0.09 -3.46 7.64 -1.26 -4.93 113.62 109.79 2dl0 n SER 25 Ca 0.00 -3.20 -0.07 0.00 1.01 0.00 0.00 58.87 56.62 2dl0 n SER 25 Cb 0.33 1.24 -0.00 0.00 -1.01 0.00 0.00 64.21 64.77 2dl0 n SER 25 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2dl0 h VAL 26 N 1.81 0.41 -0.27 0.44 2.07 -1.89 -2.18 116.25 116.64 2dl0 h VAL 26 Ca -0.29 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.28 2dl0 h VAL 26 Cb 1.22 0.41 -0.08 0.00 -1.52 0.00 0.00 31.29 31.32 2dl0 h VAL 26 CO 0.46 0.00 -0.44 0.77 0.02 0.00 0.00 177.57 178.37 2dl0 h SER 27 N -0.17 -1.44 -0.84 0.57 4.64 -1.93 0.42 113.55 114.81 2dl0 h SER 27 Ca 0.17 0.20 0.24 0.00 -0.47 0.00 0.00 61.79 61.93 2dl0 h SER 27 Cb 0.43 0.60 -0.03 0.00 -0.31 0.00 0.00 62.40 63.09 2dl0 h SER 27 CO -0.44 -0.41 0.62 0.44 -0.87 0.00 0.00 176.83 176.17 2dl0 h ASP 28 N -0.42 0.00 0.24 4.97 3.32 -1.83 0.11 116.42 122.81 2dl0 h ASP 28 Ca 0.10 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.82 2dl0 h ASP 28 Cb 0.61 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.20 2dl0 h ASP 28 CO -0.49 0.00 -1.46 -0.25 -1.72 0.00 0.00 179.24 175.32 2dl0 h TRP 29 N 0.00 0.91 -0.15 4.55 7.01 0.17 -2.76 115.95 125.68 2dl0 h TRP 29 Ca 0.40 -0.66 -0.06 0.00 2.11 0.00 0.00 58.89 60.68 2dl0 h TRP 29 Cb 1.63 -0.04 -0.01 0.00 -2.10 0.00 0.00 29.16 28.64 2dl0 h TRP 29 CO 0.00 1.56 -0.15 -0.07 -2.79 0.00 0.00 178.44 176.99 2dl0 h LEU 30 N 0.09 0.24 -0.02 0.65 3.38 0.20 -2.70 115.31 117.15 2dl0 h LEU 30 Ca -0.26 -0.05 -0.26 0.00 0.09 0.00 0.00 57.88 57.40 2dl0 h LEU 30 Cb 2.11 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 42.81 2dl0 h LEU 30 CO 0.25 0.41 -1.11 0.40 0.09 0.00 0.00 178.44 178.49 2dl0 h ILE 31 N 0.23 1.42 0.00 1.22 2.04 -1.11 0.18 117.51 121.50 2dl0 h ILE 31 Ca 0.05 -2.69 0.00 0.00 1.00 0.00 0.00 64.86 63.21 2dl0 h ILE 31 Cb 0.42 2.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.17 2dl0 h ILE 31 CO 0.03 0.80 0.00 -1.28 0.00 0.00 0.00 178.15 177.69 2dl0 h SER 32 N 0.17 0.00 0.00 1.72 0.87 -1.18 -1.56 113.55 113.57 2dl0 h SER 32 Ca -0.12 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2dl0 h SER 32 Cb 1.78 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.74 2dl0 h SER 32 CO 0.19 0.00 -1.24 2.30 -0.53 0.00 0.00 176.83 177.55 2dl0 n ILE 33 N -2.50 0.00 -1.02 2.23 -5.35 -1.10 -4.99 119.36 106.63 2dl0 n ILE 33 Ca -0.00 -0.21 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 2dl0 n ILE 33 Cb 0.15 0.64 0.00 0.00 -1.74 0.00 0.00 39.64 38.69 2dl0 n ILE 33 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dl0 n GLY 34 N 1.43 0.93 2.59 3.28 0.00 -0.59 -5.00 105.19 107.84 2dl0 n GLY 34 Ca 0.01 -0.56 -0.14 0.00 0.00 0.00 0.00 46.02 45.33 2dl0 n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dl0 n LEU 35 N 0.00 2.62 0.02 0.99 4.77 0.61 -4.86 117.00 121.15 2dl0 n LEU 35 Ca 0.00 -4.08 0.08 0.00 -0.03 0.00 0.00 56.01 51.97 2dl0 n LEU 35 Cb 0.22 0.14 0.33 0.00 -2.33 0.00 0.00 43.42 41.78 2dl0 n LEU 35 CO 0.00 1.70 0.74 -0.81 -1.33 0.00 0.00 177.39 177.69 2dl0 n PRO 36 N -0.32 0.03 0.00 3.23 -0.04 -1.12 -2.72 135.00 134.06 2dl0 n PRO 36 Ca 0.20 0.28 0.06 0.00 -0.04 0.00 0.00 63.50 64.00 2dl0 n PRO 36 Cb 0.79 -1.56 0.31 0.00 -0.04 0.00 0.00 33.50 33.00 2dl0 n PRO 36 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dl0 n MET 37 N -1.61 0.24 0.00 0.54 0.00 -1.26 -1.36 117.12 113.67 2dl0 n MET 37 Ca 0.03 0.11 0.04 0.00 0.00 0.00 0.00 57.70 57.89 2dl0 n MET 37 Cb 0.17 -1.50 -0.05 0.00 0.00 0.00 0.00 33.22 31.85 2dl0 n MET 37 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 2dl0 n TYR 38 N -1.18 0.00 -0.28 3.17 4.01 -1.10 -4.57 117.16 117.21 2dl0 n TYR 38 Ca 0.07 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.74 2dl0 n TYR 38 Cb 0.07 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.08 2dl0 n TYR 38 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dl0 h ALA 39 N 1.37 -0.22 0.00 -0.72 0.00 -1.40 0.26 119.26 118.55 2dl0 h ALA 39 Ca 0.00 0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.90 2dl0 h ALA 39 Cb 0.24 1.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2dl0 h ALA 39 CO 0.00 -0.79 -0.79 0.78 0.00 0.00 0.00 179.25 178.46 2dl0 h GLY 40 N -0.13 0.00 0.97 0.00 0.00 -1.83 -2.05 103.07 100.02 2dl0 h GLY 40 Ca 0.22 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.52 2dl0 h GLY 40 CO -0.80 0.00 -0.29 -0.84 0.00 0.00 0.00 176.54 174.61 2dl0 h THR 41 N 0.00 0.40 -0.14 4.70 2.02 -1.17 -1.47 112.91 117.25 2dl0 h THR 41 Ca -0.01 -0.07 -0.07 0.00 0.77 0.00 0.00 66.41 67.04 2dl0 h THR 41 Cb 1.40 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 68.24 2dl0 h THR 41 CO 0.10 0.01 -0.17 -0.07 0.37 0.00 0.00 175.52 175.76 2dl0 h LEU 42 N -0.85 0.39 -1.30 2.58 3.38 -0.71 -2.99 115.31 115.82 2dl0 h LEU 42 Ca -0.08 -0.50 0.23 0.00 0.09 0.00 0.00 57.88 57.62 2dl0 h LEU 42 Cb 0.64 -0.11 -0.09 0.00 0.09 0.00 0.00 40.66 41.18 2dl0 h LEU 42 CO 0.14 0.81 0.63 -1.28 0.09 0.00 0.00 178.44 178.83 2dl0 h SER 43 N -0.02 0.54 -0.13 -0.43 0.87 -1.38 0.20 113.55 113.20 2dl0 h SER 43 Ca 0.02 0.08 -0.16 0.00 -1.23 0.00 0.00 61.79 60.50 2dl0 h SER 43 Cb 0.71 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.65 2dl0 h SER 43 CO 0.04 0.16 -0.47 0.74 -0.53 0.00 0.00 176.83 176.77 2dl0 h THR 44 N 0.51 1.30 0.00 2.23 2.02 -1.19 -2.84 112.91 114.93 2dl0 h THR 44 Ca 0.56 -1.67 0.00 0.00 0.77 0.00 0.00 66.41 66.07 2dl0 h THR 44 Cb 1.24 1.60 0.00 0.00 -1.74 0.00 0.00 68.15 69.25 2dl0 h THR 44 CO -0.29 0.53 0.00 0.00 0.37 0.00 0.00 175.52 176.13 2dl0 h ALA 45 N 0.92 1.00 0.00 6.16 0.00 -0.51 -3.45 119.26 123.38 2dl0 h ALA 45 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2dl0 h ALA 45 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2dl0 h ALA 45 CO 0.10 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.76 2dl0 n GLY 46 N -0.09 1.21 3.57 0.00 0.00 -0.61 -5.06 105.19 104.22 2dl0 n GLY 46 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 2dl0 n GLY 46 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dl0 s PHE 47 N -1.14 1.84 -0.01 1.61 0.08 -0.47 -4.45 117.98 115.43 2dl0 s PHE 47 Ca 0.00 0.66 0.02 0.00 0.12 0.00 0.00 56.93 57.73 2dl0 s PHE 47 Cb 0.00 -3.98 -0.03 0.00 -0.57 0.00 0.00 43.02 38.44 2dl0 s PHE 47 CO 0.00 -1.44 0.04 -1.13 -0.10 0.00 0.00 175.22 172.59 2dl0 n SER 48 N 14.54 4.43 -4.86 1.36 3.41 -1.26 -3.39 113.62 127.85 2dl0 n SER 48 Ca 0.43 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.67 2dl0 n SER 48 Cb 0.47 0.91 -0.06 0.00 -0.26 0.00 0.00 64.21 65.26 2dl0 n SER 48 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2dl0 s THR 49 N -2.13 5.41 -1.98 6.66 -4.23 -1.26 -4.40 115.64 113.71 2dl0 s THR 49 Ca -0.01 0.33 0.20 0.00 -1.18 0.00 0.00 61.69 61.03 2dl0 s THR 49 Cb 0.01 -3.47 0.56 0.00 1.34 0.00 0.00 72.50 70.94 2dl0 s THR 49 CO 0.10 0.60 1.57 0.18 -0.54 0.00 0.00 174.62 176.53 2dl0 n LEU 50 N 2.08 0.00 0.20 4.79 4.77 -1.26 -2.48 117.00 125.10 2dl0 n LEU 50 Ca -0.18 0.01 0.10 0.00 -0.03 0.00 0.00 56.01 55.90 2dl0 n LEU 50 Cb 0.54 -0.01 0.13 0.00 -2.33 0.00 0.00 43.42 41.75 2dl0 n LEU 50 CO 0.33 -0.00 0.71 0.28 -1.33 0.00 0.00 177.39 177.37 2dl0 h SER 51 N 0.00 0.00 0.00 -1.43 0.02 -2.01 -3.23 113.55 106.90 2dl0 h SER 51 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2dl0 h SER 51 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 2dl0 h SER 51 CO 0.00 0.13 -1.21 0.00 -1.14 0.00 0.00 176.83 174.61 2dl0 n GLN 52 N -3.12 0.56 0.45 3.45 10.64 -1.03 -4.46 117.38 123.87 2dl0 n GLN 52 Ca 0.03 -0.05 -0.20 0.00 -1.83 0.00 0.00 57.00 54.96 2dl0 n GLN 52 Cb 0.58 -1.44 -0.10 0.00 -0.86 0.00 0.00 30.24 28.43 2dl0 n GLN 52 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.06 175.51 2dl0 h VAL 53 N 0.00 0.13 0.00 -0.39 2.07 -1.61 -2.24 116.25 114.21 2dl0 h VAL 53 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2dl0 h VAL 53 Cb 0.59 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2dl0 h VAL 53 CO 0.00 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.78 2dl0 n PRO 54 N -5.59 0.49 -0.20 1.57 -0.04 -1.25 -1.99 135.00 127.98 2dl0 n PRO 54 Ca -0.15 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.38 2dl0 n PRO 54 Cb 0.47 -1.36 0.16 0.00 -0.04 0.00 0.00 33.50 32.73 2dl0 n PRO 54 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dl0 n SER 55 N -0.86 2.89 -3.60 3.54 2.88 -0.86 -4.38 113.62 113.22 2dl0 n SER 55 Ca 0.08 -2.80 -0.24 0.00 -1.33 0.00 0.00 58.87 54.58 2dl0 n SER 55 Cb 0.04 -0.39 0.21 0.00 -0.75 0.00 0.00 64.21 63.32 2dl0 n SER 55 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2dl0 n LEU 56 N -0.78 -1.11 -3.64 2.46 4.77 -0.84 -5.03 117.00 112.82 2dl0 n LEU 56 Ca 0.15 -0.52 -0.08 0.00 -0.03 0.00 0.00 56.01 55.53 2dl0 n LEU 56 Cb 0.65 -0.91 -0.07 0.00 -2.33 0.00 0.00 43.42 40.76 2dl0 n LEU 56 CO 0.06 -3.74 0.68 -0.55 -1.33 0.00 0.00 177.39 172.52 2dl0 s SER 57 N -2.39 -0.51 0.27 -1.43 0.15 -1.26 -4.96 113.70 103.56 2dl0 s SER 57 Ca 0.51 0.94 0.07 0.00 0.70 0.00 0.00 55.95 58.17 2dl0 s SER 57 Cb -0.10 1.02 0.77 0.00 -1.71 0.00 0.00 66.02 66.00 2dl0 s SER 57 CO 0.47 -0.16 1.27 1.57 1.20 0.00 0.00 173.24 177.59 2dl0 n HIS 58 N 2.70 0.65 0.01 3.44 -0.00 -1.26 0.22 115.22 120.99 2dl0 n HIS 58 Ca -0.14 0.96 -0.15 0.00 0.46 0.00 0.00 57.72 58.85 2dl0 n HIS 58 Cb 0.56 -1.19 -0.04 0.00 -0.12 0.00 0.00 29.99 29.20 2dl0 n HIS 58 CO 0.00 0.00 0.00 1.15 0.46 0.00 0.00 176.34 177.95 2dl0 h THR 59 N 0.00 1.31 -0.39 3.57 2.02 -1.98 -2.59 112.91 114.85 2dl0 h THR 59 Ca 0.55 -2.08 0.07 0.00 0.77 0.00 0.00 66.41 65.72 2dl0 h THR 59 Cb 1.27 2.09 -0.06 0.00 -1.74 0.00 0.00 68.15 69.71 2dl0 h THR 59 CO -0.71 0.65 0.04 0.00 0.37 0.00 0.00 175.52 175.86 2dl0 h LEU 61 N 0.15 0.99 -1.47 0.00 3.38 -1.30 -3.00 115.31 114.06 2dl0 h LEU 61 Ca 0.19 -0.44 0.06 0.00 0.09 0.00 0.00 57.88 57.79 2dl0 h LEU 61 Cb 0.26 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 2dl0 h LEU 61 CO -0.29 1.22 0.43 1.56 0.09 0.00 0.00 178.44 181.45 2dl0 h GLN 62 N 0.76 0.63 -0.41 1.13 4.20 -0.98 -0.89 115.11 119.55 2dl0 h GLN 62 Ca 0.08 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.69 2dl0 h GLN 62 Cb 0.90 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.52 2dl0 h GLN 62 CO 0.08 0.41 0.02 0.93 -0.67 0.00 0.00 178.83 179.61 2dl0 h GLU 63 N 0.64 0.64 0.00 1.46 5.08 -0.96 -2.26 114.58 119.18 2dl0 h GLU 63 Ca 0.28 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 58.41 2dl0 h GLU 63 Cb 0.29 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2dl0 h GLU 63 CO -0.09 0.64 -0.42 0.00 -1.00 0.00 0.00 179.01 178.15 2dl0 h ALA 64 N 1.42 1.01 0.00 3.43 0.00 -1.17 -3.46 119.26 120.47 2dl0 h ALA 64 Ca 0.13 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2dl0 h ALA 64 Cb 0.35 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2dl0 h ALA 64 CO 0.01 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.20 2dl0 n GLY 65 N 0.21 1.12 3.69 0.00 0.00 -0.85 -4.98 105.19 104.38 2dl0 n GLY 65 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2dl0 n GLY 65 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dl0 s ILE 66 N -1.15 3.82 0.00 -0.61 1.01 -0.93 -4.86 121.20 118.48 2dl0 s ILE 66 Ca 0.00 1.18 0.00 0.00 0.00 0.00 0.00 60.65 61.83 2dl0 s ILE 66 Cb 0.00 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.71 2dl0 s ILE 66 CO 0.00 -0.01 0.00 0.35 0.00 0.00 0.00 174.94 175.28 2dl0 n THR 67 N 4.71 0.00 -1.50 2.92 -2.24 -1.26 -3.44 114.28 113.48 2dl0 n THR 67 Ca 0.13 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.50 2dl0 n THR 67 Cb 0.44 -0.69 -0.10 0.00 -2.10 0.00 0.00 70.33 67.88 2dl0 n THR 67 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2dl0 n GLU 68 N -1.66 0.51 0.25 -0.78 0.00 -1.26 -4.73 120.64 112.97 2dl0 n GLU 68 Ca 0.00 0.04 0.18 0.00 0.00 0.00 0.00 57.16 57.37 2dl0 n GLU 68 Cb 0.37 -2.32 0.83 0.00 0.00 0.00 0.00 31.44 30.32 2dl0 n GLU 68 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 2dl0 h GLU 69 N 14.62 0.00 -0.13 3.44 5.08 -1.98 0.15 114.58 135.75 2dl0 h GLU 69 Ca -0.15 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 57.98 2dl0 h GLU 69 Cb 1.30 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.56 2dl0 h GLU 69 CO 1.25 0.00 -0.80 0.00 -1.00 0.00 0.00 179.01 178.45 2dl0 h ARG 70 N 0.00 0.78 0.19 2.33 2.47 -2.00 -2.81 114.38 115.34 2dl0 h ARG 70 Ca 0.07 -0.66 -0.27 0.00 -1.26 0.00 0.00 59.98 57.86 2dl0 h ARG 70 Cb 0.70 0.15 0.02 0.00 -1.65 0.00 0.00 29.97 29.19 2dl0 h ARG 70 CO -0.00 1.26 -1.22 0.45 0.56 0.00 0.00 179.97 181.02 2dl0 h HIS 71 N 0.51 0.72 -0.48 3.04 3.86 -1.22 -3.13 115.15 118.44 2dl0 h HIS 71 Ca -0.06 -0.52 0.07 0.00 -1.16 0.00 0.00 60.37 58.70 2dl0 h HIS 71 Cb 1.44 -0.03 -0.06 0.00 1.06 0.00 0.00 27.41 29.82 2dl0 h HIS 71 CO 0.09 1.47 0.13 0.82 0.86 0.00 0.00 177.93 181.30 2dl0 h ILE 72 N -0.13 0.78 -0.72 2.45 2.04 -0.93 0.56 117.51 121.57 2dl0 h ILE 72 Ca -0.22 -0.10 -0.06 0.00 1.00 0.00 0.00 64.86 65.48 2dl0 h ILE 72 Cb 1.90 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 38.42 2dl0 h ILE 72 CO 0.19 0.05 0.22 0.03 0.00 0.00 0.00 178.15 178.65 2dl0 h ARG 73 N 0.28 1.12 0.09 2.37 3.08 -1.62 -0.67 114.38 119.03 2dl0 h ARG 73 Ca 0.24 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 2dl0 h ARG 73 Cb 0.28 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.17 2dl0 h ARG 73 CO -0.28 0.95 -0.04 -0.22 -1.07 0.00 0.00 179.97 179.31 2dl0 h LYS 74 N 1.08 -0.12 -0.64 0.04 3.64 -1.25 0.11 116.57 119.42 2dl0 h LYS 74 Ca 0.23 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.61 2dl0 h LYS 74 Cb 0.30 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.12 2dl0 h LYS 74 CO -0.01 0.06 0.36 -0.07 -2.27 0.00 0.00 179.45 177.52 2dl0 h LEU 75 N -0.28 0.80 -0.92 5.20 3.38 -0.82 0.27 115.31 122.93 2dl0 h LEU 75 Ca -0.01 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 2dl0 h LEU 75 Cb 0.24 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2dl0 h LEU 75 CO 0.02 0.65 -0.03 -0.07 0.09 0.00 0.00 178.44 179.11 2dl0 h LEU 76 N 0.88 0.73 -0.09 1.67 3.38 -1.02 0.21 115.31 121.08 2dl0 h LEU 76 Ca 0.23 -0.18 -0.22 0.00 0.09 0.00 0.00 57.88 57.80 2dl0 h LEU 76 Cb 0.02 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.59 2dl0 h LEU 76 CO -0.04 0.82 -0.79 -1.28 0.09 0.00 0.00 178.44 177.24 2dl0 h SER 77 N 0.71 0.85 0.15 -0.43 0.87 -0.33 -2.99 113.55 112.37 2dl0 h SER 77 Ca 0.14 -0.67 -0.15 0.00 -1.23 0.00 0.00 61.79 59.87 2dl0 h SER 77 Cb 0.47 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 2dl0 h SER 77 CO 0.02 1.39 -0.55 0.00 -0.53 0.00 0.00 176.83 177.16 2dl0 h ALA 78 N 0.47 0.78 -0.23 6.23 0.00 -0.33 -3.01 119.26 123.17 2dl0 h ALA 78 Ca -0.07 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.32 2dl0 h ALA 78 Cb 1.44 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 2dl0 h ALA 78 CO 0.16 0.69 0.13 0.00 0.00 0.00 0.00 179.25 180.23 2dl0 h ALA 79 N 1.07 0.29 0.00 0.00 0.00 -0.61 -1.85 119.26 118.16 2dl0 h ALA 79 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2dl0 h ALA 79 Cb 1.07 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 2dl0 h ALA 79 CO 0.10 -0.19 -0.06 0.00 0.00 0.00 0.00 179.25 179.10 2dl0 h ARG 80 N 0.27 0.00 -0.00 0.00 3.08 -1.53 -0.74 114.38 115.46 2dl0 h ARG 80 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2dl0 h ARG 80 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2dl0 h ARG 80 CO -0.01 0.06 -0.24 1.28 -1.07 0.00 0.00 179.97 179.99 2dl0 n LEU 81 N -3.39 0.61 -4.56 3.04 4.77 -0.76 -4.78 117.00 111.95 2dl0 n LEU 81 Ca -0.02 -0.04 -0.40 0.00 -0.03 0.00 0.00 56.01 55.53 2dl0 n LEU 81 Cb 0.21 -0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 2dl0 n LEU 81 CO 0.27 0.12 1.39 0.12 -1.33 0.00 0.00 177.39 177.96 2dl0 s PHE 82 N -2.65 1.99 -0.54 -1.77 5.36 -0.28 -4.95 117.98 115.13 2dl0 s PHE 82 Ca 0.22 0.45 -0.17 0.00 -0.96 0.00 0.00 56.93 56.46 2dl0 s PHE 82 Cb 0.19 -4.33 0.09 0.00 -0.34 0.00 0.00 43.02 38.64 2dl0 s PHE 82 CO 0.55 -2.19 0.57 0.21 -1.46 0.00 0.00 175.22 172.90 2dl0 s LYS 83 N 6.27 3.03 0.40 10.12 2.20 -1.26 -4.87 119.74 135.63 2dl0 s LYS 83 Ca 0.54 -1.34 -0.25 0.00 -0.36 0.00 0.00 55.97 54.56 2dl0 s LYS 83 Cb -0.11 -4.21 -0.08 0.00 -1.51 0.00 0.00 37.83 31.91 2dl0 s LYS 83 CO 0.20 -1.32 1.16 -0.51 -0.36 0.00 0.00 175.35 174.53 2dl0 s LEU 84 N 2.18 4.19 0.52 5.43 1.43 -1.26 -5.00 118.68 126.16 2dl0 s LEU 84 Ca 0.08 2.33 -0.21 0.00 -1.03 0.00 0.00 54.13 55.31 2dl0 s LEU 84 Cb -0.25 -4.03 -0.06 0.00 0.03 0.00 0.00 46.19 41.88 2dl0 s LEU 84 CO 0.07 -0.68 1.14 -2.16 0.23 0.00 0.00 176.35 174.95 2dl0 s PRO 85 N -2.32 3.49 0.90 1.29 0.04 -1.26 -5.03 135.00 132.12 2dl0 s PRO 85 Ca 0.57 1.66 -0.12 0.00 0.04 0.00 0.00 61.00 63.16 2dl0 s PRO 85 Cb -0.30 -2.13 0.13 0.00 0.04 0.00 0.00 34.50 32.23 2dl0 s PRO 85 CO 0.38 -0.75 1.09 -1.25 0.04 0.00 0.00 177.00 176.52 2dl0 s PRO 86 N -3.10 1.23 -0.18 0.56 0.04 -1.26 -4.69 135.00 127.61 2dl0 s PRO 86 Ca 0.70 0.81 -0.04 0.00 0.04 0.00 0.00 61.00 62.51 2dl0 s PRO 86 Cb -0.25 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.49 2dl0 s PRO 86 CO 0.29 -2.26 0.15 0.41 0.04 0.00 0.00 177.00 175.63 2dl0 n GLY 87 N -1.13 -2.32 0.00 0.56 0.00 -1.26 -4.86 105.19 96.18 2dl0 n GLY 87 Ca 0.07 0.34 0.06 0.00 0.00 0.00 0.00 46.02 46.49 2dl0 n GLY 87 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dl0 n PRO 88 N -0.01 0.49 0.00 1.61 -0.04 -1.26 -4.67 135.00 131.11 2dl0 n PRO 88 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 2dl0 n PRO 88 Cb 0.11 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.17 2dl0 n PRO 88 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2dl0 n GLU 89 N -0.90 0.00 -2.76 0.54 1.02 -1.26 -5.10 120.64 112.18 2dl0 n GLU 89 Ca 0.09 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.19 2dl0 n GLU 89 Cb 0.04 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.48 2dl0 n GLU 89 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dl0 n ALA 90 N -3.00 -1.93 -2.54 0.62 0.00 -1.26 -5.14 120.51 107.26 2dl0 n ALA 90 Ca 0.00 -1.01 -0.41 0.00 0.00 0.00 0.00 53.44 52.02 2dl0 n ALA 90 Cb 0.00 -1.55 -0.04 0.00 0.00 0.00 0.00 19.45 17.86 2dl0 n ALA 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dl0 s MET 91 N 0.86 4.56 0.59 0.00 0.23 -1.26 -4.83 119.30 119.44 2dl0 s MET 91 Ca 0.30 1.25 0.00 0.00 -1.03 0.00 0.00 55.69 56.21 2dl0 s MET 91 Cb 0.02 -3.42 0.00 0.00 -1.53 0.00 0.00 34.83 29.90 2dl0 s MET 91 CO -0.06 0.11 0.00 0.43 -2.03 0.00 0.00 175.02 173.46 2dl0 n SER 92 N 3.38 -8.61 0.00 -1.18 7.64 -1.26 -4.87 113.62 108.71 2dl0 n SER 92 Ca 0.02 1.79 0.00 0.00 1.01 0.00 0.00 58.87 61.69 2dl0 n SER 92 Cb 0.50 -5.19 0.00 0.00 -1.01 0.00 0.00 64.21 58.51 2dl0 n SER 92 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dl0 n GLY 93 N -2.32 -0.19 0.05 0.23 0.00 -1.26 -4.90 105.19 96.81 2dl0 n GLY 93 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2dl0 n GLY 93 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dl0 h PRO 94 N 0.00 0.00 -6.84 1.61 0.13 -1.96 -3.42 132.00 121.52 2dl0 h PRO 94 Ca 0.00 -0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.64 2dl0 h PRO 94 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2dl0 h PRO 94 CO 0.00 0.49 0.41 0.45 -0.23 0.00 0.00 178.00 179.11 2dl0 s SER 95 N -5.69 7.27 -0.10 1.44 0.15 -1.26 -4.41 113.70 111.09 2dl0 s SER 95 Ca -0.16 2.06 -0.04 0.00 0.70 0.00 0.00 55.95 58.51 2dl0 s SER 95 Cb 0.02 -2.61 0.01 0.00 -1.71 0.00 0.00 66.02 61.73 2dl0 s SER 95 CO 0.67 -0.13 0.08 -1.54 1.20 0.00 0.00 173.24 173.52 2dl0 n SER 96 N 0.88 -6.75 0.00 5.45 3.41 -1.26 -4.77 113.62 110.59 2dl0 n SER 96 Ca 0.01 0.53 0.00 0.00 -0.26 0.00 0.00 58.87 59.15 2dl0 n SER 96 Cb 0.47 -2.31 0.00 0.00 -0.26 0.00 0.00 64.21 62.11 2dl0 n SER 96 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49