#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 6.49 -0.06 1.61 0.01 -1.26 -5.00 113.70 115.49 2dl0 s SER 2 Ca 0.00 -1.56 -0.26 0.00 1.31 0.00 0.00 55.95 55.44 2dl0 s SER 2 Cb 0.00 -2.48 -0.03 0.00 0.21 0.00 0.00 66.02 63.72 2dl0 s SER 2 CO 0.00 -1.34 0.83 -0.55 0.41 0.00 0.00 173.24 172.59 2dl0 s SER 3 N 4.16 7.12 -0.19 2.44 0.15 -1.26 -3.87 113.70 122.25 2dl0 s SER 3 Ca 0.37 1.36 -0.01 0.00 0.70 0.00 0.00 55.95 58.36 2dl0 s SER 3 Cb -0.05 -2.48 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 2dl0 s SER 3 CO -0.05 -0.23 0.17 0.61 1.20 0.00 0.00 173.24 174.94 2dl0 n GLY 4 N 3.10 0.72 3.72 9.45 0.00 -1.26 -5.01 105.19 115.91 2dl0 n GLY 4 Ca 0.03 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 2dl0 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dl0 s SER 5 N -3.05 7.36 0.45 1.61 1.04 -1.25 -5.05 113.70 114.82 2dl0 s SER 5 Ca 0.08 1.78 -0.02 0.00 0.48 0.00 0.00 55.95 58.27 2dl0 s SER 5 Cb -0.04 -2.58 -0.02 0.00 0.10 0.00 0.00 66.02 63.49 2dl0 s SER 5 CO 0.10 -0.23 0.70 -0.94 0.98 0.00 0.00 173.24 173.86 2dl0 s SER 6 N 0.63 6.00 -0.40 7.02 1.04 -1.26 -4.96 113.70 121.78 2dl0 s SER 6 Ca 0.51 0.54 -0.40 0.00 0.48 0.00 0.00 55.95 57.08 2dl0 s SER 6 Cb -0.23 -1.84 -0.16 0.00 0.10 0.00 0.00 66.02 63.89 2dl0 s SER 6 CO 0.29 -0.63 2.05 0.61 0.98 0.00 0.00 173.24 176.54 2dl0 n GLY 7 N -2.13 0.30 0.00 7.32 0.00 -1.26 -4.63 105.19 104.79 2dl0 n GLY 7 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 46.02 47.03 2dl0 n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dl0 n GLY 8 N 6.32 -0.81 0.00 -0.02 0.00 -1.26 -5.16 105.19 104.26 2dl0 n GLY 8 Ca 0.43 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.77 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 0.00 3.93 3.88 -0.02 0.00 -1.26 -5.15 105.19 106.57 2dl0 n GLY 9 Ca 0.00 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 45.24 2dl0 n GLY 9 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dl0 s LEU 10 N 0.00 3.58 -0.21 0.99 1.43 -1.26 -5.08 118.68 118.13 2dl0 s LEU 10 Ca 0.00 1.18 0.01 0.00 -1.03 0.00 0.00 54.13 54.29 2dl0 s LEU 10 Cb 0.00 -4.14 0.05 0.00 0.03 0.00 0.00 46.19 42.13 2dl0 s LEU 10 CO 0.00 -0.61 -0.08 0.42 0.23 0.00 0.00 176.35 176.31 2dl0 s THR 11 N -2.74 1.56 -0.01 5.49 -4.23 -1.26 -4.93 115.64 109.52 2dl0 s THR 11 Ca 0.52 -1.06 0.06 0.00 -1.18 0.00 0.00 61.69 60.03 2dl0 s THR 11 Cb -0.10 -1.72 0.11 0.00 1.34 0.00 0.00 72.50 72.13 2dl0 s THR 11 CO 0.42 0.06 1.05 1.21 -0.54 0.00 0.00 174.62 176.82 2dl0 n GLU 12 N 4.69 0.03 -3.33 3.99 2.13 -1.26 -5.13 120.64 121.75 2dl0 n GLU 12 Ca -0.13 -1.24 -0.26 0.00 0.66 0.00 0.00 57.16 56.18 2dl0 n GLU 12 Cb 0.46 0.37 -0.02 0.00 0.27 0.00 0.00 31.44 32.52 2dl0 n GLU 12 CO 0.00 0.00 0.00 0.96 -0.41 0.00 0.00 177.13 177.68 2dl0 s ILE 13 N -0.01 5.07 -0.69 6.31 -4.36 -1.26 -5.06 121.20 121.20 2dl0 s ILE 13 Ca 0.08 -0.24 0.04 0.00 -0.26 0.00 0.00 60.65 60.27 2dl0 s ILE 13 Cb 0.10 -3.81 0.17 0.00 1.25 0.00 0.00 42.46 40.16 2dl0 s ILE 13 CO -0.04 -0.48 0.47 0.00 0.24 0.00 0.00 174.94 175.13 2dl0 n ARG 15 N 2.20 -0.89 -3.72 0.00 0.63 -1.26 -4.88 116.66 108.73 2dl0 n ARG 15 Ca 0.17 0.08 -0.33 0.00 -0.92 0.00 0.00 57.85 56.86 2dl0 n ARG 15 Cb 0.35 -3.02 -0.05 0.00 0.45 0.00 0.00 32.46 30.19 2dl0 n ARG 15 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 2dl0 s LYS 16 N -6.13 3.60 0.62 -0.14 1.02 -1.26 -5.08 119.74 112.36 2dl0 s LYS 16 Ca 0.22 -0.10 -0.17 0.00 0.02 0.00 0.00 55.97 55.95 2dl0 s LYS 16 Cb -0.13 -2.96 -0.02 0.00 -0.52 0.00 0.00 37.83 34.20 2dl0 s LYS 16 CO 0.77 0.55 1.12 -1.25 -0.92 0.00 0.00 175.35 175.62 2dl0 s PRO 17 N -2.28 3.00 -0.18 -1.68 0.04 -1.26 -4.98 135.00 127.66 2dl0 s PRO 17 Ca 0.35 1.47 0.13 0.00 0.04 0.00 0.00 61.00 62.99 2dl0 s PRO 17 Cb -0.13 -1.97 0.38 0.00 0.04 0.00 0.00 34.50 32.82 2dl0 s PRO 17 CO 0.22 -1.11 1.20 1.33 0.04 0.00 0.00 177.00 178.68 2dl0 n VAL 18 N -2.03 2.02 -2.96 -0.36 0.24 -1.26 -5.02 118.33 108.97 2dl0 n VAL 18 Ca 0.11 -2.87 -0.13 0.00 -2.04 0.00 0.00 64.34 59.41 2dl0 n VAL 18 Cb 0.52 -0.19 0.01 0.00 -1.47 0.00 0.00 33.84 32.71 2dl0 n VAL 18 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2dl0 n SER 19 N -1.13 -7.57 0.00 -1.34 2.88 -1.26 -4.92 113.62 100.28 2dl0 n SER 19 Ca 0.18 0.44 -0.07 0.00 -1.33 0.00 0.00 58.87 58.08 2dl0 n SER 19 Cb 0.69 -4.80 0.11 0.00 -0.75 0.00 0.00 64.21 59.46 2dl0 n SER 19 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2dl0 h PRO 20 N 2.03 0.54 -0.43 -1.46 0.13 -1.98 -3.47 132.00 127.34 2dl0 h PRO 20 Ca -0.09 -0.28 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2dl0 h PRO 20 Cb 1.06 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2dl0 h PRO 20 CO 0.20 0.86 0.00 0.41 -0.23 0.00 0.00 178.00 179.25 2dl0 n GLY 21 N 0.01 0.97 3.09 1.56 0.00 -1.26 -5.05 105.19 104.51 2dl0 n GLY 21 Ca -0.02 -0.47 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 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 0.77 1.51 -0.01 0.00 1.01 -1.26 -4.92 121.20 118.29 2dl0 s ILE 23 Ca 0.11 -0.79 -0.00 0.00 0.00 0.00 0.00 60.65 59.97 2dl0 s ILE 23 Cb -0.22 -1.27 -0.00 0.00 0.01 0.00 0.00 42.46 40.98 2dl0 s ILE 23 CO -0.04 0.43 -0.01 -1.20 0.00 0.00 0.00 174.94 174.12 2dl0 n SER 24 N 2.83 2.47 -4.29 3.58 7.64 -1.26 -5.03 113.62 119.57 2dl0 n SER 24 Ca -0.16 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.55 2dl0 n SER 24 Cb 0.53 -0.02 -0.10 0.00 -1.01 0.00 0.00 64.21 63.61 2dl0 n SER 24 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dl0 s SER 25 N -4.45 1.36 0.07 6.43 0.01 -1.26 -4.84 113.70 111.02 2dl0 s SER 25 Ca -0.01 -1.41 -0.15 0.00 1.31 0.00 0.00 55.95 55.70 2dl0 s SER 25 Cb 0.00 0.17 -0.03 0.00 0.21 0.00 0.00 66.02 66.37 2dl0 s SER 25 CO 0.02 -0.74 1.21 0.52 0.41 0.00 0.00 173.24 174.65 2dl0 n VAL 26 N -0.50 -0.32 -0.37 3.43 0.31 -1.26 -1.02 118.33 118.59 2dl0 n VAL 26 Ca -0.00 1.86 -0.08 0.00 -0.01 0.00 0.00 64.34 66.11 2dl0 n VAL 26 Cb 0.66 -2.38 -0.06 0.00 -0.91 0.00 0.00 33.84 31.15 2dl0 n VAL 26 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2dl0 n SER 27 N -4.05 -0.88 -0.34 4.52 7.64 -1.26 0.15 113.62 119.40 2dl0 n SER 27 Ca 0.01 1.60 0.21 0.00 1.01 0.00 0.00 58.87 61.70 2dl0 n SER 27 Cb 0.12 -0.24 0.44 0.00 -1.01 0.00 0.00 64.21 63.52 2dl0 n SER 27 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2dl0 h ASP 28 N 0.00 0.58 0.08 6.43 3.32 -1.47 0.41 116.42 125.77 2dl0 h ASP 28 Ca 0.18 0.16 -0.22 0.00 0.02 0.00 0.00 57.03 57.16 2dl0 h ASP 28 Cb 0.41 0.08 0.01 0.00 0.22 0.00 0.00 39.33 40.04 2dl0 h ASP 28 CO -0.86 -0.01 -0.85 -0.25 -1.72 0.00 0.00 179.24 175.56 2dl0 h TRP 29 N 0.45 0.85 -0.30 4.55 7.01 0.20 -2.28 115.95 126.43 2dl0 h TRP 29 Ca 0.69 -0.41 -0.07 0.00 2.11 0.00 0.00 58.89 61.21 2dl0 h TRP 29 Cb 1.48 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 28.40 2dl0 h TRP 29 CO -0.01 1.22 -0.12 -0.07 -2.79 0.00 0.00 178.44 176.67 2dl0 h LEU 30 N 0.39 0.49 -0.05 0.65 3.38 0.29 -3.00 115.31 117.45 2dl0 h LEU 30 Ca -0.07 -0.13 -0.19 0.00 0.09 0.00 0.00 57.88 57.59 2dl0 h LEU 30 Cb 1.47 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 42.10 2dl0 h LEU 30 CO 0.16 0.65 -0.70 0.40 0.09 0.00 0.00 178.44 179.05 2dl0 h ILE 31 N 0.47 1.36 -0.02 1.22 2.04 -0.68 0.24 117.51 122.14 2dl0 h ILE 31 Ca 0.09 -2.03 0.00 0.00 1.00 0.00 0.00 64.86 63.92 2dl0 h ILE 31 Cb 0.50 2.36 -0.00 0.00 -0.74 0.00 0.00 36.82 38.93 2dl0 h ILE 31 CO 0.03 0.61 0.25 -1.28 0.00 0.00 0.00 178.15 177.76 2dl0 h SER 32 N 0.15 0.00 0.00 1.72 0.87 -1.27 0.31 113.55 115.33 2dl0 h SER 32 Ca -0.07 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 2dl0 h SER 32 Cb 1.36 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.32 2dl0 h SER 32 CO 0.14 0.00 -1.69 2.30 -0.53 0.00 0.00 176.83 177.04 2dl0 n ILE 33 N -2.98 0.00 -0.83 2.23 -5.35 -1.17 -5.00 119.36 106.25 2dl0 n ILE 33 Ca -0.02 -0.37 0.00 0.00 -0.27 0.00 0.00 62.75 62.10 2dl0 n ILE 33 Cb 0.31 0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.46 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 1.38 1.28 2.57 3.28 0.00 0.11 -5.01 105.19 108.80 2dl0 n GLY 34 Ca -0.02 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.49 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 2.72 0.00 0.99 4.77 0.79 -4.86 117.00 121.42 2dl0 n LEU 35 Ca 0.00 -4.01 0.07 0.00 -0.03 0.00 0.00 56.01 52.04 2dl0 n LEU 35 Cb 0.20 0.13 0.35 0.00 -2.33 0.00 0.00 43.42 41.78 2dl0 n LEU 35 CO 0.00 1.65 0.71 -0.81 -1.33 0.00 0.00 177.39 177.61 2dl0 n PRO 36 N -0.40 0.15 0.00 3.23 -0.04 -1.18 -2.74 135.00 134.02 2dl0 n PRO 36 Ca 0.20 0.18 0.08 0.00 -0.04 0.00 0.00 63.50 63.92 2dl0 n PRO 36 Cb 0.80 -1.50 0.47 0.00 -0.04 0.00 0.00 33.50 33.23 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 -1.35 0.63 -0.00 0.54 0.00 -1.26 -2.12 117.12 113.56 2dl0 n MET 37 Ca 0.06 0.00 0.03 0.00 0.00 0.00 0.00 57.70 57.79 2dl0 n MET 37 Cb 0.13 -1.39 -0.04 0.00 0.00 0.00 0.00 33.22 31.92 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 -0.89 0.00 -0.29 3.17 4.01 -1.11 -4.63 117.16 117.42 2dl0 n TYR 38 Ca 0.12 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.78 2dl0 n TYR 38 Cb 0.05 -0.06 -0.07 0.00 -0.31 0.00 0.00 39.34 38.96 2dl0 n TYR 38 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dl0 n ALA 39 N -1.37 -0.45 0.11 -0.72 0.00 -0.90 0.35 120.51 117.53 2dl0 n ALA 39 Ca 0.00 0.59 -0.02 0.00 0.00 0.00 0.00 53.44 54.01 2dl0 n ALA 39 Cb 0.12 -0.02 0.21 0.00 0.00 0.00 0.00 19.45 19.76 2dl0 n ALA 39 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2dl0 h GLY 40 N 0.00 0.20 0.78 0.00 0.00 -1.85 -1.31 103.07 100.88 2dl0 h GLY 40 Ca 0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.22 2dl0 h GLY 40 CO -0.65 0.18 -0.35 -0.84 0.00 0.00 0.00 176.54 174.88 2dl0 h THR 41 N 0.15 0.28 -0.26 4.70 2.02 -0.37 -1.41 112.91 118.02 2dl0 h THR 41 Ca 0.01 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.02 2dl0 h THR 41 Cb 0.90 0.28 -0.00 0.00 -1.74 0.00 0.00 68.15 67.59 2dl0 h THR 41 CO 0.07 0.00 -0.51 -0.07 0.37 0.00 0.00 175.52 175.39 2dl0 h LEU 42 N -0.83 0.79 -0.91 2.58 3.38 -0.68 -3.12 115.31 116.51 2dl0 h LEU 42 Ca -0.06 -0.41 0.14 0.00 0.09 0.00 0.00 57.88 57.65 2dl0 h LEU 42 Cb 0.70 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 41.13 2dl0 h LEU 42 CO 0.03 1.16 0.53 0.28 0.09 0.00 0.00 178.44 180.52 2dl0 h SER 43 N 0.57 0.71 -0.52 -0.43 0.02 -1.11 0.40 113.55 113.19 2dl0 h SER 43 Ca 0.02 0.07 -0.09 0.00 -0.84 0.00 0.00 61.79 60.95 2dl0 h SER 43 Cb 1.07 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.54 2dl0 h SER 43 CO 0.11 0.33 -0.02 0.74 -1.14 0.00 0.00 176.83 176.85 2dl0 h THR 44 N 0.78 1.26 0.00 -2.27 2.02 -1.20 -2.25 112.91 111.25 2dl0 h THR 44 Ca 0.48 -1.13 0.00 0.00 0.77 0.00 0.00 66.41 66.53 2dl0 h THR 44 Cb 0.60 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 2dl0 h THR 44 CO -0.32 0.41 0.00 0.00 0.37 0.00 0.00 175.52 175.98 2dl0 h ALA 45 N 1.08 1.00 0.00 6.16 0.00 -1.07 -3.45 119.26 122.98 2dl0 h ALA 45 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2dl0 h ALA 45 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2dl0 h ALA 45 CO 0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.69 2dl0 n GLY 46 N -0.31 1.33 3.56 0.00 0.00 -0.78 -5.06 105.19 103.93 2dl0 n GLY 46 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.61 1.77 -0.01 1.61 0.08 -0.03 -4.53 117.98 115.26 2dl0 s PHE 47 Ca 0.00 0.73 0.02 0.00 0.12 0.00 0.00 56.93 57.80 2dl0 s PHE 47 Cb 0.00 -3.99 -0.04 0.00 -0.57 0.00 0.00 43.02 38.42 2dl0 s PHE 47 CO 0.00 -1.69 0.04 0.45 -0.10 0.00 0.00 175.22 173.93 2dl0 n SER 48 N 14.38 4.41 -4.76 1.36 2.88 -1.26 -3.39 113.62 127.24 2dl0 n SER 48 Ca 0.41 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.63 2dl0 n SER 48 Cb 0.47 0.98 -0.07 0.00 -0.75 0.00 0.00 64.21 64.84 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 -2.15 4.57 -1.60 2.46 -4.23 -1.26 -4.40 115.64 109.02 2dl0 s THR 49 Ca -0.01 -0.54 0.22 0.00 -1.18 0.00 0.00 61.69 60.18 2dl0 s THR 49 Cb 0.01 -3.11 0.46 0.00 1.34 0.00 0.00 72.50 71.21 2dl0 s THR 49 CO 0.11 0.30 1.71 0.18 -0.54 0.00 0.00 174.62 176.37 2dl0 n LEU 50 N 1.04 0.00 0.11 4.79 4.77 -1.26 -2.89 117.00 123.56 2dl0 n LEU 50 Ca -0.12 0.20 -0.04 0.00 -0.03 0.00 0.00 56.01 56.02 2dl0 n LEU 50 Cb 0.52 -0.20 0.11 0.00 -2.33 0.00 0.00 43.42 41.52 2dl0 n LEU 50 CO 0.39 -0.06 0.43 0.28 -1.33 0.00 0.00 177.39 177.10 2dl0 h SER 51 N 0.00 0.11 0.91 -1.43 0.02 -1.99 -2.93 113.55 108.24 2dl0 h SER 51 Ca 0.00 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2dl0 h SER 51 Cb 0.14 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.65 2dl0 h SER 51 CO 0.00 0.76 -0.24 0.00 -1.14 0.00 0.00 176.83 176.20 2dl0 n GLN 52 N -3.76 0.09 0.43 3.45 6.02 -1.14 -4.06 117.38 118.40 2dl0 n GLN 52 Ca -0.02 0.05 -0.19 0.00 -0.01 0.00 0.00 57.00 56.83 2dl0 n GLN 52 Cb 0.67 -1.58 -0.09 0.00 1.02 0.00 0.00 30.24 30.26 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 0.21 0.00 5.09 2.07 -1.64 -2.29 116.25 119.69 2dl0 h VAL 53 Ca 0.00 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.51 2dl0 h VAL 53 Cb 0.58 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 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 -5.55 0.49 -0.25 1.57 -0.04 -1.26 -2.10 135.00 127.85 2dl0 n PRO 54 Ca -0.15 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.40 2dl0 n PRO 54 Cb 0.43 -1.39 0.17 0.00 -0.04 0.00 0.00 33.50 32.67 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 -0.89 2.35 -3.24 3.54 2.88 -0.88 -4.75 113.62 112.64 2dl0 n SER 55 Ca 0.09 -3.30 -0.29 0.00 -1.33 0.00 0.00 58.87 54.04 2dl0 n SER 55 Cb 0.04 -0.47 0.28 0.00 -0.75 0.00 0.00 64.21 63.31 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 -1.27 0.00 -3.64 2.46 4.77 -0.89 -5.02 117.00 113.40 2dl0 n LEU 56 Ca 0.18 -0.87 -0.05 0.00 -0.03 0.00 0.00 56.01 55.24 2dl0 n LEU 56 Cb 0.69 -0.95 -0.07 0.00 -2.33 0.00 0.00 43.42 40.76 2dl0 n LEU 56 CO 0.02 -2.72 0.96 -0.55 -1.33 0.00 0.00 177.39 173.77 2dl0 s SER 57 N -3.20 -0.23 0.35 -1.43 0.15 -1.26 -4.96 113.70 103.12 2dl0 s SER 57 Ca 0.65 0.44 0.16 0.00 0.70 0.00 0.00 55.95 57.90 2dl0 s SER 57 Cb -0.11 0.52 1.19 0.00 -1.71 0.00 0.00 66.02 65.92 2dl0 s SER 57 CO 0.54 -0.08 1.55 1.57 1.20 0.00 0.00 173.24 178.02 2dl0 n HIS 58 N 2.04 1.03 0.05 3.44 -0.00 -1.26 0.23 115.22 120.74 2dl0 n HIS 58 Ca -0.12 1.17 -0.06 0.00 0.46 0.00 0.00 57.72 59.17 2dl0 n HIS 58 Cb 0.56 -1.49 0.12 0.00 -0.12 0.00 0.00 29.99 29.07 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 1.34 0.34 3.57 2.02 -1.98 -1.94 112.91 116.26 2dl0 h THR 59 Ca 0.78 -1.76 -0.02 0.00 0.77 0.00 0.00 66.41 66.18 2dl0 h THR 59 Cb 1.98 1.79 0.00 0.00 -1.74 0.00 0.00 68.15 70.18 2dl0 h THR 59 CO -0.80 0.54 -0.16 0.00 0.37 0.00 0.00 175.52 175.46 2dl0 h LEU 61 N -0.51 0.80 -1.58 0.00 3.38 -1.38 -2.45 115.31 113.56 2dl0 h LEU 61 Ca -0.05 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.67 2dl0 h LEU 61 Cb 0.38 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2dl0 h LEU 61 CO 0.08 0.88 -0.21 1.56 0.09 0.00 0.00 178.44 180.83 2dl0 h GLN 62 N 0.76 0.00 0.00 1.13 1.08 -1.18 -0.81 115.11 116.09 2dl0 h GLN 62 Ca 0.14 -0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.20 2dl0 h GLN 62 Cb 0.49 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.90 2dl0 h GLN 62 CO 0.02 0.21 -0.68 0.93 -0.95 0.00 0.00 178.83 178.36 2dl0 h GLU 63 N 0.00 0.00 0.00 1.46 4.39 -0.64 -3.06 114.58 116.73 2dl0 h GLU 63 Ca -0.00 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 2dl0 h GLU 63 Cb 0.37 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 2dl0 h GLU 63 CO 0.03 0.68 -0.23 0.00 -1.16 0.00 0.00 179.01 178.33 2dl0 h ALA 64 N 1.32 0.89 0.00 3.43 0.00 -1.12 -3.47 119.26 120.32 2dl0 h ALA 64 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2dl0 h ALA 64 Cb 1.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2dl0 h ALA 64 CO 0.09 0.29 0.00 0.41 0.00 0.00 0.00 179.25 180.03 2dl0 n GLY 65 N 0.81 0.97 3.71 0.00 0.00 -0.97 -4.92 105.19 104.79 2dl0 n GLY 65 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.61 4.53 0.00 -0.61 1.01 -0.38 -4.88 121.20 119.25 2dl0 s ILE 66 Ca 0.00 1.83 0.00 0.00 0.00 0.00 0.00 60.65 62.48 2dl0 s ILE 66 Cb 0.00 -4.17 0.00 0.00 0.01 0.00 0.00 42.46 38.30 2dl0 s ILE 66 CO 0.00 0.15 0.00 0.35 0.00 0.00 0.00 174.94 175.44 2dl0 n THR 67 N 3.83 0.00 -1.51 2.92 -2.24 -1.26 -3.51 114.28 112.51 2dl0 n THR 67 Ca 0.07 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.61 2dl0 n THR 67 Cb 0.49 -0.39 -0.19 0.00 -2.10 0.00 0.00 70.33 68.14 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 -1.64 0.12 0.04 -0.78 0.00 -1.26 -4.65 120.64 112.46 2dl0 n GLU 68 Ca 0.00 -0.13 0.19 0.00 0.00 0.00 0.00 57.16 57.22 2dl0 n GLU 68 Cb 0.26 -1.55 0.48 0.00 0.00 0.00 0.00 31.44 30.62 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 11.65 0.00 -0.17 3.44 4.81 -1.98 0.97 114.58 133.29 2dl0 h GLU 69 Ca 0.01 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.05 2dl0 h GLU 69 Cb 1.14 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.52 2dl0 h GLU 69 CO 1.49 0.00 -0.63 -0.09 -0.73 0.00 0.00 179.01 179.04 2dl0 h ARG 70 N 0.00 0.73 0.19 1.92 9.65 -2.01 -2.69 114.38 122.18 2dl0 h ARG 70 Ca 0.26 -0.56 -0.32 0.00 -1.10 0.00 0.00 59.98 58.26 2dl0 h ARG 70 Cb 2.01 0.10 0.03 0.00 -1.39 0.00 0.00 29.97 30.72 2dl0 h ARG 70 CO -0.00 1.18 -1.37 0.45 2.80 0.00 0.00 179.97 183.03 2dl0 h HIS 71 N 0.44 0.97 -0.15 2.20 3.86 0.55 -3.10 115.15 119.92 2dl0 h HIS 71 Ca -0.03 -0.66 0.03 0.00 -1.16 0.00 0.00 60.37 58.54 2dl0 h HIS 71 Cb 1.26 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 29.65 2dl0 h HIS 71 CO 0.09 1.51 -0.03 0.82 0.86 0.00 0.00 177.93 181.18 2dl0 h ILE 72 N 0.20 0.86 -0.94 2.45 2.04 -1.17 -0.41 117.51 120.54 2dl0 h ILE 72 Ca -0.22 -0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.64 2dl0 h ILE 72 Cb 2.05 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 38.93 2dl0 h ILE 72 CO 0.26 0.00 0.59 0.03 0.00 0.00 0.00 178.15 179.03 2dl0 h ARG 73 N 0.01 1.26 0.02 2.37 3.08 -1.59 0.52 114.38 120.05 2dl0 h ARG 73 Ca 0.07 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 2dl0 h ARG 73 Cb 0.10 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 29.88 2dl0 h ARG 73 CO -0.15 0.86 -0.01 -0.22 -1.07 0.00 0.00 179.97 179.38 2dl0 h LYS 74 N 1.29 -0.03 -0.24 0.04 3.64 -1.34 0.11 116.57 120.04 2dl0 h LYS 74 Ca 0.34 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.71 2dl0 h LYS 74 Cb -0.10 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 2dl0 h LYS 74 CO -0.07 0.07 0.09 -0.07 -2.27 0.00 0.00 179.45 177.20 2dl0 h LEU 75 N -0.12 0.33 -1.51 5.20 3.38 -0.84 0.15 115.31 121.89 2dl0 h LEU 75 Ca -0.00 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 2dl0 h LEU 75 Cb 0.11 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2dl0 h LEU 75 CO 0.01 0.41 0.13 -0.07 0.09 0.00 0.00 178.44 179.01 2dl0 h LEU 76 N 0.23 0.41 0.05 1.67 3.38 -0.82 0.89 115.31 121.12 2dl0 h LEU 76 Ca 0.08 -0.03 -0.28 0.00 0.09 0.00 0.00 57.88 57.73 2dl0 h LEU 76 Cb 0.18 -0.10 0.02 0.00 0.09 0.00 0.00 40.66 40.85 2dl0 h LEU 76 CO -0.01 0.37 -1.14 -1.28 0.09 0.00 0.00 178.44 176.48 2dl0 h SER 77 N 0.46 0.88 0.37 -0.43 0.87 -0.42 -2.91 113.55 112.37 2dl0 h SER 77 Ca 0.11 -0.76 -0.11 0.00 -1.23 0.00 0.00 61.79 59.81 2dl0 h SER 77 Cb 0.09 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 2dl0 h SER 77 CO -0.01 1.56 -0.49 0.00 -0.53 0.00 0.00 176.83 177.36 2dl0 h ALA 78 N 0.37 1.08 -0.11 6.23 0.00 -0.29 -2.97 119.26 123.57 2dl0 h ALA 78 Ca -0.15 -0.46 -0.15 0.00 0.00 0.00 0.00 54.91 54.15 2dl0 h ALA 78 Cb 1.80 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 2dl0 h ALA 78 CO 0.22 0.63 -0.57 0.00 0.00 0.00 0.00 179.25 179.53 2dl0 h ALA 79 N 1.39 0.82 0.00 0.00 0.00 -0.87 -2.77 119.26 117.82 2dl0 h ALA 79 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2dl0 h ALA 79 Cb 0.91 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2dl0 h ALA 79 CO 0.07 0.70 0.00 0.54 0.00 0.00 0.00 179.25 180.56 2dl0 n ARG 80 N -3.91 0.21 -0.45 0.00 1.74 -1.10 -2.12 116.66 111.02 2dl0 n ARG 80 Ca -0.03 0.38 0.11 0.00 -0.77 0.00 0.00 57.85 57.54 2dl0 n ARG 80 Cb 0.60 -1.86 0.33 0.00 -1.02 0.00 0.00 32.46 30.52 2dl0 n ARG 80 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2dl0 n LEU 81 N -2.24 4.22 -4.42 0.55 4.77 -1.05 -4.86 117.00 113.97 2dl0 n LEU 81 Ca 0.03 -2.16 -0.44 0.00 -0.03 0.00 0.00 56.01 53.41 2dl0 n LEU 81 Cb 0.27 -0.51 -0.07 0.00 -2.33 0.00 0.00 43.42 40.77 2dl0 n LEU 81 CO 0.22 0.92 0.18 0.12 -1.33 0.00 0.00 177.39 177.50 2dl0 s PHE 82 N -1.30 3.15 -0.46 -1.77 5.36 -0.90 -5.02 117.98 117.03 2dl0 s PHE 82 Ca 0.49 -0.73 -0.10 0.00 -0.96 0.00 0.00 56.93 55.63 2dl0 s PHE 82 Cb 0.28 -3.35 0.11 0.00 -0.34 0.00 0.00 43.02 39.71 2dl0 s PHE 82 CO 0.30 -0.91 0.34 0.21 -1.46 0.00 0.00 175.22 173.69 2dl0 s LYS 83 N 2.14 2.58 0.40 10.12 2.20 -1.26 -4.84 119.74 131.08 2dl0 s LYS 83 Ca 0.10 -1.66 -0.25 0.00 -0.36 0.00 0.00 55.97 53.80 2dl0 s LYS 83 Cb -0.22 -3.93 -0.08 0.00 -1.51 0.00 0.00 37.83 32.08 2dl0 s LYS 83 CO 0.09 -1.14 1.15 -0.51 -0.36 0.00 0.00 175.35 174.59 2dl0 s LEU 84 N 1.41 4.18 0.52 5.43 1.43 -1.26 -5.01 118.68 125.38 2dl0 s LEU 84 Ca 0.05 2.30 -0.21 0.00 -1.03 0.00 0.00 54.13 55.24 2dl0 s LEU 84 Cb -0.26 -4.05 -0.06 0.00 0.03 0.00 0.00 46.19 41.85 2dl0 s LEU 84 CO 0.01 -0.66 1.14 -2.16 0.23 0.00 0.00 176.35 174.91 2dl0 s PRO 85 N -2.33 3.48 0.07 1.29 0.04 -1.26 -4.98 135.00 131.31 2dl0 s PRO 85 Ca 0.57 1.66 -0.31 0.00 0.04 0.00 0.00 61.00 62.97 2dl0 s PRO 85 Cb -0.29 -2.13 -0.07 0.00 0.04 0.00 0.00 34.50 32.05 2dl0 s PRO 85 CO 0.37 -0.75 1.39 -1.25 0.04 0.00 0.00 177.00 176.80 2dl0 s PRO 86 N -3.10 4.31 0.00 0.56 0.04 -1.26 -4.66 135.00 130.89 2dl0 s PRO 86 Ca 0.70 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.77 2dl0 s PRO 86 Cb -0.25 -3.38 0.00 0.00 0.04 0.00 0.00 34.50 30.91 2dl0 s PRO 86 CO 0.29 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 177.26 2dl0 n GLY 87 N 3.55 1.01 0.00 0.56 0.00 -1.26 -4.97 105.19 104.07 2dl0 n GLY 87 Ca 0.12 -0.63 0.08 0.00 0.00 0.00 0.00 46.02 45.59 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 0.43 -3.91 1.61 -0.04 -1.26 -4.87 135.00 126.96 2dl0 n PRO 88 Ca 0.00 0.03 -0.25 0.00 -0.04 0.00 0.00 63.50 63.25 2dl0 n PRO 88 Cb 0.00 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 31.95 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 -1.06 -3.57 0.00 0.54 1.02 -1.26 -4.40 120.64 111.91 2dl0 n GLU 89 Ca 0.11 0.44 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 2dl0 n GLU 89 Cb 0.07 -4.64 0.00 0.00 -0.02 0.00 0.00 31.44 26.85 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 -4.38 0.00 -0.82 0.62 0.00 -1.26 -5.15 120.51 109.53 2dl0 n ALA 90 Ca -0.31 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.81 2dl0 n ALA 90 Cb 0.68 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.28 2dl0 n ALA 90 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2dl0 n MET 91 N 0.00 -0.25 -3.96 0.00 1.56 -1.26 -5.04 117.12 108.17 2dl0 n MET 91 Ca 0.00 -0.01 -0.17 0.00 -0.27 0.00 0.00 57.70 57.26 2dl0 n MET 91 Cb 0.00 -2.32 -0.16 0.00 2.15 0.00 0.00 33.22 32.90 2dl0 n MET 91 CO 0.00 0.00 0.00 -1.54 -0.73 0.00 0.00 175.97 173.70 2dl0 s SER 92 N -2.39 0.43 0.00 6.12 1.04 -1.26 -4.82 113.70 112.81 2dl0 s SER 92 Ca 0.67 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 57.07 2dl0 s SER 92 Cb -0.25 -0.21 0.00 0.00 0.10 0.00 0.00 66.02 65.67 2dl0 s SER 92 CO 0.57 -0.08 0.00 0.61 0.98 0.00 0.00 173.24 175.33 2dl0 n GLY 93 N 3.96 2.71 3.70 7.32 0.00 -1.26 -5.13 105.19 116.49 2dl0 n GLY 93 Ca -0.25 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 2dl0 n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dl0 s PRO 94 N -1.91 4.29 0.12 1.61 0.04 -1.26 -5.02 135.00 132.86 2dl0 s PRO 94 Ca 0.00 2.03 -0.04 0.00 0.04 0.00 0.00 61.00 63.03 2dl0 s PRO 94 Cb 0.00 -3.49 -0.03 0.00 0.04 0.00 0.00 34.50 31.02 2dl0 s PRO 94 CO 0.00 -0.55 0.11 -1.12 0.04 0.00 0.00 177.00 175.48 2dl0 s SER 95 N 1.74 0.25 -0.10 6.66 0.01 -1.26 -5.10 113.70 115.90 2dl0 s SER 95 Ca 0.65 -1.00 -0.04 0.00 1.31 0.00 0.00 55.95 56.87 2dl0 s SER 95 Cb -0.34 0.32 -0.01 0.00 0.21 0.00 0.00 66.02 66.20 2dl0 s SER 95 CO 0.28 -0.74 -0.08 -1.28 0.41 0.00 0.00 173.24 171.83 2dl0 h SER 96 N 2.83 0.00 0.00 2.44 0.87 -2.09 -3.55 113.55 114.06 2dl0 h SER 96 Ca -0.34 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.22 2dl0 h SER 96 Cb 1.19 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 2dl0 h SER 96 CO 0.57 0.53 0.00 0.61 -0.53 0.00 0.00 176.83 178.01