#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl0 n SER 2 N 0.00 -6.95 0.00 1.61 7.64 -1.26 -5.11 113.62 109.55 2dl0 n SER 2 Ca 0.00 0.95 0.00 0.00 1.01 0.00 0.00 58.87 60.83 2dl0 n SER 2 Cb 0.00 -3.35 0.00 0.00 -1.01 0.00 0.00 64.21 59.85 2dl0 n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dl0 n SER 3 N -0.50 0.00 -3.10 6.43 7.64 -1.26 -5.20 113.62 117.64 2dl0 n SER 3 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 2dl0 n SER 3 Cb 0.00 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.22 2dl0 n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dl0 s GLY 4 N 0.00 0.28 -0.47 0.23 0.00 -1.26 -5.12 107.32 100.97 2dl0 s GLY 4 Ca 0.00 -0.65 -0.21 0.00 0.00 0.00 0.00 44.72 43.86 2dl0 s GLY 4 CO 0.00 -0.07 0.71 -1.35 0.00 0.00 0.00 173.10 172.39 2dl0 s SER 5 N -3.07 6.32 -0.03 1.64 1.04 -1.26 -5.02 113.70 113.31 2dl0 s SER 5 Ca 0.15 -0.43 -0.03 0.00 0.48 0.00 0.00 55.95 56.12 2dl0 s SER 5 Cb -0.05 -2.34 0.01 0.00 0.10 0.00 0.00 66.02 63.74 2dl0 s SER 5 CO 0.10 -0.89 0.08 -0.44 0.98 0.00 0.00 173.24 173.06 2dl0 s SER 6 N 2.30 -0.07 0.49 7.02 0.01 -1.26 -5.15 113.70 117.04 2dl0 s SER 6 Ca 0.23 0.15 -0.22 0.00 1.31 0.00 0.00 55.95 57.43 2dl0 s SER 6 Cb -0.15 0.15 -0.07 0.00 0.21 0.00 0.00 66.02 66.16 2dl0 s SER 6 CO 0.18 -0.03 1.14 -0.83 0.41 0.00 0.00 173.24 174.11 2dl0 s GLY 7 N 0.11 2.72 0.00 3.44 0.00 -1.26 -5.05 107.32 107.28 2dl0 s GLY 7 Ca -0.01 0.87 0.00 0.00 0.00 0.00 0.00 44.72 45.59 2dl0 s GLY 7 CO -0.00 1.29 0.00 0.61 0.00 0.00 0.00 173.10 175.00 2dl0 n GLY 8 N 0.31 3.47 0.00 0.20 0.00 -1.26 -5.14 105.19 102.77 2dl0 n GLY 8 Ca 0.09 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.18 2dl0 n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dl0 n GLY 9 N 5.00 -0.85 3.85 -0.02 0.00 -1.26 -5.17 105.19 106.75 2dl0 n GLY 9 Ca 0.00 0.18 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 2dl0 n GLY 9 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2dl0 s LEU 10 N 0.00 3.65 -0.69 0.99 0.05 -1.26 -5.08 118.68 116.34 2dl0 s LEU 10 Ca 0.00 -0.44 -0.07 0.00 0.05 0.00 0.00 54.13 53.68 2dl0 s LEU 10 Cb 0.00 -2.25 0.18 0.00 -2.05 0.00 0.00 46.19 42.07 2dl0 s LEU 10 CO 0.00 -0.28 0.55 -0.89 -0.55 0.00 0.00 176.35 175.18 2dl0 s THR 11 N -2.26 4.36 -0.03 5.48 2.01 -1.26 -5.05 115.64 118.89 2dl0 s THR 11 Ca 0.39 -2.77 0.05 0.00 0.31 0.00 0.00 61.69 59.67 2dl0 s THR 11 Cb -0.06 -3.78 -0.01 0.00 0.01 0.00 0.00 72.50 68.66 2dl0 s THR 11 CO 0.26 -0.93 -0.17 -0.70 -0.69 0.00 0.00 174.62 172.40 2dl0 s GLU 12 N 0.05 1.58 0.14 4.92 -6.30 -1.26 -5.13 118.70 112.70 2dl0 s GLU 12 Ca 0.17 -0.60 -0.27 0.00 -2.50 0.00 0.00 54.97 51.77 2dl0 s GLU 12 Cb -0.17 -1.44 -0.07 0.00 0.00 0.00 0.00 34.13 32.45 2dl0 s GLU 12 CO -0.05 0.29 0.83 0.42 0.02 0.00 0.00 175.26 176.77 2dl0 s ILE 13 N -0.14 4.41 0.42 -3.70 -1.09 -1.26 -5.07 121.20 114.77 2dl0 s ILE 13 Ca 0.01 1.81 0.04 0.00 -2.23 0.00 0.00 60.65 60.27 2dl0 s ILE 13 Cb -0.09 -4.19 0.00 0.00 -1.58 0.00 0.00 42.46 36.60 2dl0 s ILE 13 CO 0.01 0.46 0.59 0.00 -1.23 0.00 0.00 174.94 174.77 2dl0 n ARG 15 N -1.92 -1.81 -4.49 0.00 1.74 -1.26 -4.99 116.66 103.93 2dl0 n ARG 15 Ca 0.03 1.64 -0.31 0.00 -0.77 0.00 0.00 57.85 58.44 2dl0 n ARG 15 Cb 0.58 -3.07 -0.16 0.00 -1.02 0.00 0.00 32.46 28.79 2dl0 n ARG 15 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2dl0 s LYS 16 N -1.82 2.69 1.24 5.56 2.20 -1.26 -5.13 119.74 123.21 2dl0 s LYS 16 Ca 0.15 -0.73 -0.20 0.00 -0.36 0.00 0.00 55.97 54.83 2dl0 s LYS 16 Cb -0.02 -2.24 0.30 0.00 -1.51 0.00 0.00 37.83 34.36 2dl0 s LYS 16 CO 0.55 -0.07 1.11 -1.25 -0.36 0.00 0.00 175.35 175.33 2dl0 s PRO 17 N 0.98 -1.51 0.52 4.03 0.04 -1.26 -5.00 135.00 132.80 2dl0 s PRO 17 Ca -0.05 -0.17 -0.21 0.00 0.04 0.00 0.00 61.00 60.62 2dl0 s PRO 17 Cb -0.15 -1.57 -0.06 0.00 0.04 0.00 0.00 34.50 32.76 2dl0 s PRO 17 CO -0.04 -3.89 1.16 0.14 0.04 0.00 0.00 177.00 174.41 2dl0 s VAL 18 N -3.01 3.07 -0.05 -0.36 -7.23 -1.26 -5.04 120.40 106.52 2dl0 s VAL 18 Ca 0.72 0.71 -0.01 0.00 -1.81 0.00 0.00 61.98 61.59 2dl0 s VAL 18 Cb -0.08 -3.32 -0.04 0.00 0.56 0.00 0.00 36.38 33.51 2dl0 s VAL 18 CO 0.56 -0.09 0.03 -0.55 -0.31 0.00 0.00 175.10 174.73 2dl0 s SER 19 N -1.59 5.40 1.13 4.85 0.15 -1.26 -5.12 113.70 117.26 2dl0 s SER 19 Ca 0.70 0.13 -0.16 0.00 0.70 0.00 0.00 55.95 57.31 2dl0 s SER 19 Cb -0.27 -1.52 0.25 0.00 -1.71 0.00 0.00 66.02 62.77 2dl0 s SER 19 CO 0.31 0.33 1.10 -2.16 1.20 0.00 0.00 173.24 174.02 2dl0 s PRO 20 N -1.28 -0.61 0.00 5.44 0.04 -1.26 -4.73 135.00 132.61 2dl0 s PRO 20 Ca 0.17 0.15 0.00 0.00 0.04 0.00 0.00 61.00 61.37 2dl0 s PRO 20 Cb -0.12 -1.65 0.00 0.00 0.04 0.00 0.00 34.50 32.78 2dl0 s PRO 20 CO 0.07 -3.35 0.00 0.41 0.04 0.00 0.00 177.00 174.18 2dl0 n GLY 21 N -1.01 1.93 3.35 0.56 0.00 -1.26 -5.08 105.19 103.68 2dl0 n GLY 21 Ca 0.10 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.67 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 1.90 2.11 0.00 0.00 1.01 -1.26 -4.90 121.20 120.06 2dl0 s ILE 23 Ca 0.06 0.09 0.00 0.00 0.00 0.00 0.00 60.65 60.80 2dl0 s ILE 23 Cb -0.27 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.14 2dl0 s ILE 23 CO 0.05 0.02 0.00 -0.24 0.00 0.00 0.00 174.94 174.76 2dl0 n SER 24 N 2.18 3.40 -2.80 3.58 2.88 -1.26 -5.04 113.62 116.56 2dl0 n SER 24 Ca 0.08 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.47 2dl0 n SER 24 Cb 0.38 0.04 -0.05 0.00 -0.75 0.00 0.00 64.21 63.83 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 -2.28 0.54 0.27 -3.46 7.64 -1.26 -4.92 113.62 110.14 2dl0 n SER 25 Ca 0.00 -2.40 -0.17 0.00 1.01 0.00 0.00 58.87 57.31 2dl0 n SER 25 Cb 0.42 0.82 -0.09 0.00 -1.01 0.00 0.00 64.21 64.34 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 1.53 0.00 -0.86 0.44 2.07 -1.90 -2.43 116.25 115.10 2dl0 h VAL 26 Ca -0.18 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.54 2dl0 h VAL 26 Cb 0.78 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.39 2dl0 h VAL 26 CO 0.29 0.00 -0.04 0.28 0.02 0.00 0.00 177.57 178.11 2dl0 h SER 27 N -0.94 -0.50 -0.94 0.57 0.02 -1.96 0.84 113.55 110.64 2dl0 h SER 27 Ca -0.06 0.24 0.12 0.00 -0.84 0.00 0.00 61.79 61.25 2dl0 h SER 27 Cb 0.81 0.44 -0.08 0.00 0.14 0.00 0.00 62.40 63.71 2dl0 h SER 27 CO -0.06 -0.26 0.60 0.44 -1.14 0.00 0.00 176.83 176.41 2dl0 h ASP 28 N 0.05 0.81 0.26 3.07 5.19 -1.87 0.13 116.42 124.07 2dl0 h ASP 28 Ca 0.47 0.04 -0.27 0.00 -0.62 0.00 0.00 57.03 56.65 2dl0 h ASP 28 Cb 0.85 -0.12 0.01 0.00 0.18 0.00 0.00 39.33 40.25 2dl0 h ASP 28 CO -0.80 0.43 -1.11 -0.25 -3.12 0.00 0.00 179.24 174.39 2dl0 h TRP 29 N 0.87 0.80 -0.20 4.55 7.01 0.97 -2.90 115.95 127.04 2dl0 h TRP 29 Ca 0.46 -0.48 -0.07 0.00 2.11 0.00 0.00 58.89 60.92 2dl0 h TRP 29 Cb 0.55 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.52 2dl0 h TRP 29 CO -0.00 1.32 -0.17 -0.07 -2.79 0.00 0.00 178.44 176.73 2dl0 h LEU 30 N 0.25 0.33 -0.15 0.65 3.38 0.52 -2.95 115.31 117.33 2dl0 h LEU 30 Ca -0.13 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 57.61 2dl0 h LEU 30 Cb 1.78 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.44 2dl0 h LEU 30 CO 0.20 0.53 -0.44 0.40 0.09 0.00 0.00 178.44 179.22 2dl0 h ILE 31 N 0.31 1.35 -0.04 1.22 2.04 -0.81 0.19 117.51 121.77 2dl0 h ILE 31 Ca 0.06 -1.71 0.01 0.00 1.00 0.00 0.00 64.86 64.22 2dl0 h ILE 31 Cb 0.49 2.02 -0.00 0.00 -0.74 0.00 0.00 36.82 38.59 2dl0 h ILE 31 CO 0.03 0.52 0.27 -1.28 0.00 0.00 0.00 178.15 177.69 2dl0 h SER 32 N 0.21 0.00 0.00 1.72 0.87 -1.33 0.50 113.55 115.51 2dl0 h SER 32 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2dl0 h SER 32 Cb 1.06 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.02 2dl0 h SER 32 CO 0.09 0.00 -0.86 2.30 -0.53 0.00 0.00 176.83 177.83 2dl0 n ILE 33 N -3.04 0.00 -1.99 2.23 -5.35 -1.14 -4.99 119.36 105.08 2dl0 n ILE 33 Ca -0.01 -0.08 0.00 0.00 -0.27 0.00 0.00 62.75 62.38 2dl0 n ILE 33 Cb 0.33 0.98 0.00 0.00 -1.74 0.00 0.00 39.64 39.22 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 1.42 0.52 2.59 3.28 0.00 0.17 -4.98 105.19 108.19 2dl0 n GLY 34 Ca 0.03 -0.82 -0.12 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.08 2.60 0.00 0.99 4.77 0.61 -4.86 117.00 121.04 2dl0 n LEU 35 Ca 0.00 -3.92 0.07 0.00 -0.03 0.00 0.00 56.01 52.13 2dl0 n LEU 35 Cb 0.48 0.17 0.32 0.00 -2.33 0.00 0.00 43.42 42.06 2dl0 n LEU 35 CO 0.00 1.60 0.72 -0.81 -1.33 0.00 0.00 177.39 177.57 2dl0 n PRO 36 N -0.40 0.06 0.00 3.23 -0.04 -1.19 -2.69 135.00 133.96 2dl0 n PRO 36 Ca 0.19 0.23 0.09 0.00 -0.04 0.00 0.00 63.50 63.96 2dl0 n PRO 36 Cb 0.81 -1.50 0.51 0.00 -0.04 0.00 0.00 33.50 33.28 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 -1.44 0.58 -0.00 0.54 0.00 -1.26 -1.99 117.12 113.55 2dl0 n MET 37 Ca 0.04 0.00 0.04 0.00 0.00 0.00 0.00 57.70 57.79 2dl0 n MET 37 Cb 0.15 -1.46 -0.06 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 -0.96 0.00 -0.27 3.17 4.01 -1.09 -4.63 117.16 117.38 2dl0 n TYR 38 Ca 0.13 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.80 2dl0 n TYR 38 Cb 0.06 -0.08 -0.07 0.00 -0.31 0.00 0.00 39.34 38.94 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 1.10 -0.37 -0.48 -0.72 0.00 -1.59 0.35 119.26 117.55 2dl0 h ALA 39 Ca 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2dl0 h ALA 39 Cb 0.30 1.25 -0.02 0.00 0.00 0.00 0.00 17.79 19.31 2dl0 h ALA 39 CO 0.00 -0.65 0.12 0.78 0.00 0.00 0.00 179.25 179.50 2dl0 h GLY 40 N -0.01 0.77 0.70 0.00 0.00 -1.85 -1.49 103.07 101.20 2dl0 h GLY 40 Ca 0.10 -0.42 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 2dl0 h GLY 40 CO -0.62 0.40 -0.39 -0.84 0.00 0.00 0.00 176.54 175.09 2dl0 h THR 41 N 0.70 0.00 -0.86 4.70 2.02 -0.94 -1.78 112.91 116.74 2dl0 h THR 41 Ca 0.16 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.38 2dl0 h THR 41 Cb 0.25 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.61 2dl0 h THR 41 CO -0.00 0.00 0.55 -0.07 0.37 0.00 0.00 175.52 176.36 2dl0 h LEU 42 N -1.01 0.89 -1.51 2.58 3.38 -0.47 -1.43 115.31 117.75 2dl0 h LEU 42 Ca -0.09 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.02 2dl0 h LEU 42 Cb 0.79 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.30 2dl0 h LEU 42 CO 0.12 0.60 0.51 0.28 0.09 0.00 0.00 178.44 180.04 2dl0 h SER 43 N 1.04 0.46 -0.17 -0.43 0.02 -1.14 0.04 113.55 113.37 2dl0 h SER 43 Ca 0.36 0.02 -0.15 0.00 -0.84 0.00 0.00 61.79 61.18 2dl0 h SER 43 Cb 0.07 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 2dl0 h SER 43 CO -0.14 0.24 -0.45 0.74 -1.14 0.00 0.00 176.83 176.09 2dl0 h THR 44 N 0.49 1.29 0.00 -2.27 2.02 -0.35 -2.71 112.91 111.39 2dl0 h THR 44 Ca 0.38 -1.64 0.00 0.00 0.77 0.00 0.00 66.41 65.92 2dl0 h THR 44 Cb 0.77 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.73 2dl0 h THR 44 CO -0.13 0.53 0.00 0.00 0.37 0.00 0.00 175.52 176.28 2dl0 n ALA 45 N -2.53 1.74 0.00 6.16 0.00 -0.16 -4.83 120.51 120.89 2dl0 n ALA 45 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2dl0 n ALA 45 Cb 0.56 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.69 2dl0 n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dl0 n GLY 46 N 0.18 1.87 3.57 0.00 0.00 -0.87 -5.04 105.19 104.90 2dl0 n GLY 46 Ca 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.85 1.25 -0.12 1.61 0.40 -0.24 -4.47 117.98 114.56 2dl0 s PHE 47 Ca 0.00 1.96 0.03 0.00 -0.60 0.00 0.00 56.93 58.32 2dl0 s PHE 47 Cb 0.00 -3.46 -0.04 0.00 0.51 0.00 0.00 43.02 40.03 2dl0 s PHE 47 CO 0.00 -1.21 0.12 0.45 0.70 0.00 0.00 175.22 175.28 2dl0 n SER 48 N 18.57 1.02 -4.40 1.36 2.88 -1.26 -3.44 113.62 128.35 2dl0 n SER 48 Ca 0.44 -0.45 -0.31 0.00 -1.33 0.00 0.00 58.87 57.22 2dl0 n SER 48 Cb 0.45 1.03 -0.14 0.00 -0.75 0.00 0.00 64.21 64.80 2dl0 n SER 48 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2dl0 s THR 49 N -1.50 2.52 -1.69 2.46 -4.23 -1.26 -4.76 115.64 107.18 2dl0 s THR 49 Ca 0.01 -1.16 0.15 0.00 -1.18 0.00 0.00 61.69 59.50 2dl0 s THR 49 Cb 0.02 -2.00 0.34 0.00 1.34 0.00 0.00 72.50 72.21 2dl0 s THR 49 CO 0.13 0.43 1.37 0.18 -0.54 0.00 0.00 174.62 176.19 2dl0 n LEU 50 N 1.88 0.00 0.09 4.79 4.77 -1.26 -2.38 117.00 124.89 2dl0 n LEU 50 Ca -0.16 0.15 -0.06 0.00 -0.03 0.00 0.00 56.01 55.91 2dl0 n LEU 50 Cb 0.52 -0.15 -0.00 0.00 -2.33 0.00 0.00 43.42 41.45 2dl0 n LEU 50 CO 0.25 -0.08 0.27 -1.28 -1.33 0.00 0.00 177.39 175.22 2dl0 h SER 51 N 0.00 0.08 1.16 -1.43 0.87 -2.01 -3.11 113.55 109.11 2dl0 h SER 51 Ca 0.00 -0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 2dl0 h SER 51 Cb 0.07 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 2dl0 h SER 51 CO 0.00 0.90 -0.20 0.00 -0.53 0.00 0.00 176.83 176.99 2dl0 n GLN 52 N -3.57 0.21 0.37 2.24 6.02 -1.00 -4.03 117.38 117.61 2dl0 n GLN 52 Ca -0.02 0.13 -0.18 0.00 -0.01 0.00 0.00 57.00 56.92 2dl0 n GLN 52 Cb 0.81 -1.70 -0.09 0.00 1.02 0.00 0.00 30.24 30.28 2dl0 n GLN 52 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2dl0 h VAL 53 N 0.00 0.19 0.00 5.09 2.07 -1.65 -1.98 116.25 119.97 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 0.68 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 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 -5.54 0.49 -0.29 1.57 -0.04 -1.26 -2.11 135.00 127.82 2dl0 n PRO 54 Ca -0.13 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.41 2dl0 n PRO 54 Cb 0.43 -1.36 0.19 0.00 -0.04 0.00 0.00 33.50 32.72 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 2.83 -3.40 3.54 2.88 -0.76 -4.76 113.62 113.10 2dl0 n SER 55 Ca 0.08 -3.18 -0.28 0.00 -1.33 0.00 0.00 58.87 54.16 2dl0 n SER 55 Cb 0.04 -0.49 0.25 0.00 -0.75 0.00 0.00 64.21 63.25 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 -1.08 0.00 -3.63 2.46 4.77 -0.90 -5.03 117.00 113.60 2dl0 n LEU 56 Ca 0.19 -1.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.12 2dl0 n LEU 56 Cb 0.76 -0.93 -0.05 0.00 -2.33 0.00 0.00 43.42 40.86 2dl0 n LEU 56 CO 0.07 -2.29 1.00 -0.44 -1.33 0.00 0.00 177.39 174.39 2dl0 s SER 57 N -3.88 -0.19 0.31 -1.43 0.01 -1.26 -4.96 113.70 102.31 2dl0 s SER 57 Ca 0.65 0.27 0.06 0.00 1.31 0.00 0.00 55.95 58.24 2dl0 s SER 57 Cb -0.08 0.24 0.86 0.00 0.21 0.00 0.00 66.02 67.25 2dl0 s SER 57 CO 0.51 -0.13 1.61 -0.74 0.41 0.00 0.00 173.24 174.90 2dl0 h HIS 58 N 2.76 0.34 -0.24 2.43 2.76 -1.98 0.70 115.15 121.92 2dl0 h HIS 58 Ca -0.18 0.05 -0.16 0.00 -2.20 0.00 0.00 60.37 57.88 2dl0 h HIS 58 Cb 1.18 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.14 2dl0 h HIS 58 CO 0.24 -0.33 -0.51 1.15 -1.30 0.00 0.00 177.93 177.19 2dl0 h THR 59 N 0.12 1.30 0.36 6.26 2.02 -1.98 -2.63 112.91 118.36 2dl0 h THR 59 Ca 0.63 -1.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.09 2dl0 h THR 59 Cb 1.38 1.66 -0.02 0.00 -1.74 0.00 0.00 68.15 69.43 2dl0 h THR 59 CO -0.76 0.55 -0.38 0.00 0.37 0.00 0.00 175.52 175.30 2dl0 h LEU 61 N -0.78 0.93 -2.32 0.00 3.38 -1.37 -0.88 115.31 114.28 2dl0 h LEU 61 Ca -0.03 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2dl0 h LEU 61 Cb 0.70 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 2dl0 h LEU 61 CO -0.08 0.67 -0.04 1.56 0.09 0.00 0.00 178.44 180.65 2dl0 h GLN 62 N 1.10 0.00 0.00 1.13 1.08 -1.04 -0.36 115.11 117.02 2dl0 h GLN 62 Ca 0.30 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.45 2dl0 h GLN 62 Cb -0.12 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.30 2dl0 h GLN 62 CO -0.07 0.04 -0.29 0.93 -0.95 0.00 0.00 178.83 178.49 2dl0 h GLU 63 N 0.00 0.00 0.00 1.46 5.08 -0.10 -3.19 114.58 117.83 2dl0 h GLU 63 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2dl0 h GLU 63 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2dl0 h GLU 63 CO 0.00 0.25 -0.32 0.00 -1.00 0.00 0.00 179.01 177.94 2dl0 h ALA 64 N 1.75 0.83 0.00 3.43 0.00 -0.93 -3.47 119.26 120.86 2dl0 h ALA 64 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2dl0 h ALA 64 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2dl0 h ALA 64 CO 0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.69 2dl0 n GLY 65 N 1.17 1.38 3.74 0.00 0.00 -1.02 -4.90 105.19 105.55 2dl0 n GLY 65 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.87 3.97 0.00 -0.61 1.01 -0.90 -4.90 121.20 117.89 2dl0 s ILE 66 Ca 0.00 1.70 0.00 0.00 0.00 0.00 0.00 60.65 62.35 2dl0 s ILE 66 Cb 0.00 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.39 2dl0 s ILE 66 CO 0.00 0.29 0.00 0.35 0.00 0.00 0.00 174.94 175.58 2dl0 n THR 67 N 2.40 0.00 -1.52 2.92 -2.24 -1.26 -3.63 114.28 110.95 2dl0 n THR 67 Ca 0.02 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.58 2dl0 n THR 67 Cb 0.47 -0.29 -0.15 0.00 -2.10 0.00 0.00 70.33 68.26 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 -1.24 0.27 0.21 -0.78 0.00 -1.26 -4.68 120.64 113.17 2dl0 n GLU 68 Ca 0.00 -0.29 0.13 0.00 0.00 0.00 0.00 57.16 57.00 2dl0 n GLU 68 Cb 0.17 -2.16 0.44 0.00 0.00 0.00 0.00 31.44 29.89 2dl0 n GLU 68 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 2dl0 h GLU 69 N 12.39 0.00 -0.12 3.44 4.57 -1.98 0.98 114.58 133.85 2dl0 h GLU 69 Ca -0.01 0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 57.96 2dl0 h GLU 69 Cb 1.12 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.72 2dl0 h GLU 69 CO 1.35 0.00 -0.79 -0.09 -1.18 0.00 0.00 179.01 178.31 2dl0 h ARG 70 N 0.00 0.68 0.14 1.92 9.65 -2.00 -2.64 114.38 122.13 2dl0 h ARG 70 Ca 0.11 -0.57 -0.31 0.00 -1.10 0.00 0.00 59.98 58.11 2dl0 h ARG 70 Cb 1.60 0.12 0.00 0.00 -1.39 0.00 0.00 29.97 30.30 2dl0 h ARG 70 CO -0.00 1.18 -1.48 0.45 2.80 0.00 0.00 179.97 182.92 2dl0 h HIS 71 N 0.46 0.55 -0.36 2.20 3.86 0.55 -3.20 115.15 119.21 2dl0 h HIS 71 Ca -0.05 -0.40 -0.00 0.00 -1.16 0.00 0.00 60.37 58.75 2dl0 h HIS 71 Cb 1.40 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.83 2dl0 h HIS 71 CO 0.08 1.41 0.22 0.82 0.86 0.00 0.00 177.93 181.32 2dl0 h ILE 72 N 0.08 1.12 -0.66 2.45 2.04 -1.20 -0.97 117.51 120.37 2dl0 h ILE 72 Ca -0.23 -0.27 -0.04 0.00 1.00 0.00 0.00 64.86 65.33 2dl0 h ILE 72 Cb 2.03 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 38.72 2dl0 h ILE 72 CO 0.19 0.12 0.26 0.03 0.00 0.00 0.00 178.15 178.75 2dl0 h ARG 73 N 0.48 0.97 -0.51 2.37 2.47 -1.60 0.30 114.38 118.86 2dl0 h ARG 73 Ca 0.13 -0.16 -0.08 0.00 -1.26 0.00 0.00 59.98 58.61 2dl0 h ARG 73 Cb -0.00 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.13 2dl0 h ARG 73 CO -0.03 0.80 0.02 -0.22 0.56 0.00 0.00 179.97 181.10 2dl0 h LYS 74 N 0.96 0.89 -0.10 0.04 3.64 -1.45 -0.45 116.57 120.09 2dl0 h LYS 74 Ca 0.22 -0.27 -0.04 0.00 -1.27 0.00 0.00 60.65 59.29 2dl0 h LYS 74 Cb 0.19 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2dl0 h LYS 74 CO -0.02 0.91 -0.09 -0.07 -2.27 0.00 0.00 179.45 177.91 2dl0 h LEU 75 N 0.76 0.26 -1.15 5.20 3.38 -0.86 -0.74 115.31 122.16 2dl0 h LEU 75 Ca 0.15 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 2dl0 h LEU 75 Cb 0.49 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 2dl0 h LEU 75 CO 0.02 0.68 0.44 -0.07 0.09 0.00 0.00 178.44 179.60 2dl0 h LEU 76 N -0.16 0.91 -0.24 1.67 3.38 -0.92 0.07 115.31 120.01 2dl0 h LEU 76 Ca 0.02 -0.06 -0.20 0.00 0.09 0.00 0.00 57.88 57.73 2dl0 h LEU 76 Cb 0.60 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2dl0 h LEU 76 CO 0.02 0.71 -0.64 -1.28 0.09 0.00 0.00 178.44 177.34 2dl0 h SER 77 N 1.04 0.98 -0.18 -0.43 0.87 -1.04 -2.93 113.55 111.86 2dl0 h SER 77 Ca 0.27 -0.57 -0.10 0.00 -1.23 0.00 0.00 61.79 60.16 2dl0 h SER 77 Cb -0.02 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.64 2dl0 h SER 77 CO -0.05 1.37 -0.20 0.00 -0.53 0.00 0.00 176.83 177.42 2dl0 h ALA 78 N 0.63 1.04 -0.49 6.23 0.00 -0.71 -2.96 119.26 123.00 2dl0 h ALA 78 Ca -0.01 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 2dl0 h ALA 78 Cb 1.26 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 2dl0 h ALA 78 CO 0.14 0.58 0.18 0.00 0.00 0.00 0.00 179.25 180.15 2dl0 h ALA 79 N 1.24 0.64 0.00 0.00 0.00 -0.96 -1.94 119.26 118.24 2dl0 h ALA 79 Ca 0.08 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2dl0 h ALA 79 Cb 0.65 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2dl0 h ALA 79 CO 0.05 0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.56 2dl0 h ARG 80 N 0.66 0.00 0.00 0.00 3.08 -1.39 -0.94 114.38 115.79 2dl0 h ARG 80 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 2dl0 h ARG 80 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2dl0 h ARG 80 CO -0.01 0.00 -0.56 1.28 -1.07 0.00 0.00 179.97 179.61 2dl0 n LEU 81 N -2.72 0.55 -4.55 3.04 4.77 -0.76 -4.77 117.00 112.55 2dl0 n LEU 81 Ca -0.00 -0.05 -0.37 0.00 -0.03 0.00 0.00 56.01 55.56 2dl0 n LEU 81 Cb 0.18 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 2dl0 n LEU 81 CO 0.20 0.14 1.40 0.12 -1.33 0.00 0.00 177.39 177.92 2dl0 s PHE 82 N -3.00 2.06 -0.56 -1.77 5.36 -0.36 -4.95 117.98 114.77 2dl0 s PHE 82 Ca 0.11 0.14 -0.21 0.00 -0.96 0.00 0.00 56.93 56.01 2dl0 s PHE 82 Cb 0.17 -4.37 0.06 0.00 -0.34 0.00 0.00 43.02 38.55 2dl0 s PHE 82 CO 0.72 -2.03 0.77 0.21 -1.46 0.00 0.00 175.22 173.43 2dl0 s LYS 83 N 6.20 3.16 0.37 10.12 2.20 -1.26 -4.90 119.74 135.62 2dl0 s LYS 83 Ca 0.54 -0.80 -0.26 0.00 -0.36 0.00 0.00 55.97 55.10 2dl0 s LYS 83 Cb -0.07 -4.13 -0.09 0.00 -1.51 0.00 0.00 37.83 32.03 2dl0 s LYS 83 CO 0.07 -1.43 1.08 -0.51 -0.36 0.00 0.00 175.35 174.19 2dl0 s LEU 84 N 3.19 4.26 0.77 5.43 1.43 -1.26 -5.03 118.68 127.47 2dl0 s LEU 84 Ca 0.19 2.14 -0.11 0.00 -1.03 0.00 0.00 54.13 55.33 2dl0 s LEU 84 Cb -0.18 -4.01 0.05 0.00 0.03 0.00 0.00 46.19 42.09 2dl0 s LEU 84 CO 0.12 -0.42 1.09 -2.16 0.23 0.00 0.00 176.35 175.22 2dl0 s PRO 85 N -2.17 2.29 0.95 1.29 0.04 -1.26 -5.03 135.00 131.10 2dl0 s PRO 85 Ca 0.54 1.18 -0.12 0.00 0.04 0.00 0.00 61.00 62.64 2dl0 s PRO 85 Cb -0.26 -1.90 0.16 0.00 0.04 0.00 0.00 34.50 32.54 2dl0 s PRO 85 CO 0.33 -1.62 1.09 -1.25 0.04 0.00 0.00 177.00 175.59 2dl0 s PRO 86 N -4.86 0.83 0.00 0.56 0.04 -1.26 -4.94 135.00 125.37 2dl0 s PRO 86 Ca 0.61 0.67 0.00 0.00 0.04 0.00 0.00 61.00 62.33 2dl0 s PRO 86 Cb -0.17 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.60 2dl0 s PRO 86 CO 0.55 -2.49 0.00 0.41 0.04 0.00 0.00 177.00 175.51 2dl0 n GLY 87 N -1.10 1.13 0.00 0.56 0.00 -1.26 -4.97 105.19 99.56 2dl0 n GLY 87 Ca 0.06 -0.62 0.06 0.00 0.00 0.00 0.00 46.02 45.52 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 0.00 0.49 -4.02 1.61 -0.04 -1.26 -4.83 135.00 126.95 2dl0 n PRO 88 Ca 0.00 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.11 2dl0 n PRO 88 Cb 0.00 -1.36 -0.07 0.00 -0.04 0.00 0.00 33.50 32.03 2dl0 n PRO 88 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2dl0 n GLU 89 N -0.86 -0.77 -2.81 0.54 2.13 -1.26 -2.34 120.64 115.26 2dl0 n GLU 89 Ca 0.08 0.11 -0.03 0.00 0.66 0.00 0.00 57.16 57.99 2dl0 n GLU 89 Cb 0.04 -3.86 0.00 0.00 0.27 0.00 0.00 31.44 27.90 2dl0 n GLU 89 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2dl0 n ALA 90 N -3.46 -3.22 -2.77 4.31 0.00 -1.26 -5.01 120.51 109.10 2dl0 n ALA 90 Ca 0.08 0.62 -0.35 0.00 0.00 0.00 0.00 53.44 53.79 2dl0 n ALA 90 Cb 0.38 -1.67 -0.08 0.00 0.00 0.00 0.00 19.45 18.09 2dl0 n ALA 90 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2dl0 s MET 91 N -1.84 3.14 0.51 0.00 1.75 -0.99 -4.99 119.30 116.89 2dl0 s MET 91 Ca 0.07 -0.34 0.00 0.00 -1.25 0.00 0.00 55.69 54.17 2dl0 s MET 91 Cb -0.02 -2.93 0.00 0.00 2.84 0.00 0.00 34.83 34.72 2dl0 s MET 91 CO 0.72 0.71 0.00 0.43 -0.65 0.00 0.00 175.02 176.24 2dl0 n SER 92 N 1.85 -7.43 0.00 1.11 7.64 -1.26 -5.02 113.62 110.51 2dl0 n SER 92 Ca -0.18 1.16 0.00 0.00 1.01 0.00 0.00 58.87 60.86 2dl0 n SER 92 Cb 0.54 -4.38 0.00 0.00 -1.01 0.00 0.00 64.21 59.35 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 -4.13 4.23 0.00 0.23 0.00 -1.26 -4.96 105.19 99.29 2dl0 n GLY 93 Ca -0.06 -2.00 0.06 0.00 0.00 0.00 0.00 46.02 44.01 2dl0 n GLY 93 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dl0 n PRO 94 N 0.00 0.49 -1.65 1.61 -0.04 -1.26 -4.86 135.00 129.28 2dl0 n PRO 94 Ca 0.00 0.00 -0.64 0.00 -0.04 0.00 0.00 63.50 62.82 2dl0 n PRO 94 Cb 0.00 -1.37 -0.09 0.00 -0.04 0.00 0.00 33.50 32.00 2dl0 n PRO 94 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dl0 n SER 95 N -0.87 0.96 -0.14 3.54 2.88 -1.26 -4.82 113.62 113.91 2dl0 n SER 95 Ca 0.09 1.15 -0.06 0.00 -1.33 0.00 0.00 58.87 58.71 2dl0 n SER 95 Cb 0.04 -0.86 0.03 0.00 -0.75 0.00 0.00 64.21 62.66 2dl0 n SER 95 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2dl0 h SER 96 N 4.50 0.40 0.00 -3.46 0.02 -2.06 -3.54 113.55 109.40 2dl0 h SER 96 Ca -0.44 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2dl0 h SER 96 Cb 1.34 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.81 2dl0 h SER 96 CO 0.89 0.28 0.00 0.61 -1.14 0.00 0.00 176.83 177.47