#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2did s SER 2 N 0.00 6.45 -0.29 1.61 0.15 -1.26 -4.89 113.70 115.47 2did s SER 2 Ca 0.00 -1.33 -0.16 0.00 0.70 0.00 0.00 55.95 55.16 2did s SER 2 Cb 0.00 -2.55 0.14 0.00 -1.71 0.00 0.00 66.02 61.89 2did s SER 2 CO 0.00 -1.53 0.93 -0.94 1.20 0.00 0.00 173.24 172.90 2did s SER 3 N 4.67 -0.59 0.00 5.45 1.04 -1.26 -5.16 113.70 117.86 2did s SER 3 Ca 0.43 0.92 0.00 0.00 0.48 0.00 0.00 55.95 57.78 2did s SER 3 Cb -0.02 1.28 0.00 0.00 0.10 0.00 0.00 66.02 67.39 2did s SER 3 CO -0.06 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.63 2did n GLY 4 N 3.91 -0.78 3.73 7.32 0.00 -1.26 -5.15 105.19 112.95 2did n GLY 4 Ca -0.18 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.30 2did n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2did s SER 5 N -4.00 5.25 -0.39 1.61 0.01 -1.26 -5.03 113.70 109.89 2did s SER 5 Ca 0.00 -0.11 -0.44 0.00 1.31 0.00 0.00 55.95 56.71 2did s SER 5 Cb 0.00 -1.32 -0.19 0.00 0.21 0.00 0.00 66.02 64.72 2did s SER 5 CO 0.00 0.16 1.44 -1.20 0.41 0.00 0.00 173.24 174.05 2did n SER 6 N 0.45 0.95 -4.79 2.44 7.64 -1.26 -4.89 113.62 114.16 2did n SER 6 Ca -0.10 1.13 -0.38 0.00 1.01 0.00 0.00 58.87 60.54 2did n SER 6 Cb 0.52 -0.85 -0.06 0.00 -1.01 0.00 0.00 64.21 62.81 2did n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2did s GLY 7 N 2.36 2.44 0.14 0.23 0.00 -1.26 -5.03 107.32 106.21 2did s GLY 7 Ca 0.98 -0.22 -0.31 0.00 0.00 0.00 0.00 44.72 45.17 2did s GLY 7 CO 0.74 0.36 1.81 -0.54 0.00 0.00 0.00 173.10 175.48 2did s GLU 8 N -0.47 4.13 -0.21 2.90 2.02 -1.26 -4.86 118.70 120.94 2did s GLU 8 Ca 0.24 2.61 0.01 0.00 0.02 0.00 0.00 54.97 57.85 2did s GLU 8 Cb -0.16 -3.47 0.23 0.00 0.10 0.00 0.00 34.13 30.83 2did s GLU 8 CO 0.12 -0.83 1.62 0.43 0.02 0.00 0.00 175.26 176.62 2did n SER 9 N 5.30 4.45 -2.57 -0.19 7.64 -1.26 -4.98 113.62 122.00 2did n SER 9 Ca 0.17 -2.77 -0.31 0.00 1.01 0.00 0.00 58.87 56.98 2did n SER 9 Cb 0.37 -0.80 -0.03 0.00 -1.01 0.00 0.00 64.21 62.74 2did n SER 9 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2did n LEU 10 N 0.10 -0.40 -3.64 -3.43 4.77 -1.26 -4.58 117.00 108.56 2did n LEU 10 Ca 0.24 0.66 -0.45 0.00 -0.03 0.00 0.00 56.01 56.44 2did n LEU 10 Cb 0.82 -0.54 -0.05 0.00 -2.33 0.00 0.00 43.42 41.31 2did n LEU 10 CO 0.27 -1.45 0.28 0.00 -1.33 0.00 0.00 177.39 175.17 2did n PRO 12 N 1.07 0.48 0.00 0.00 -0.04 -1.26 0.13 135.00 135.37 2did n PRO 12 Ca 0.16 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2did n PRO 12 Cb 0.12 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.08 2did n PRO 12 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2did n GLN 13 N -1.01 0.18 0.00 0.54 3.00 -1.26 -4.79 117.38 114.04 2did n GLN 13 Ca 0.12 0.00 0.10 0.00 -0.01 0.00 0.00 57.00 57.21 2did n GLN 13 Cb 0.06 -0.80 -0.05 0.00 0.00 0.00 0.00 30.24 29.45 2did n GLN 13 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 2did n HIS 14 N -2.06 0.00 -4.20 1.08 8.25 -1.21 -4.97 115.22 112.12 2did n HIS 14 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.09 2did n HIS 14 Cb 0.30 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.34 2did n HIS 14 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2did n HIS 15 N -0.57 -1.04 -4.57 4.41 8.25 0.34 -4.81 115.22 117.24 2did n HIS 15 Ca 0.07 0.61 -0.32 0.00 -0.26 0.00 0.00 57.72 57.82 2did n HIS 15 Cb 0.40 -1.73 -0.11 0.00 1.12 0.00 0.00 29.99 29.66 2did n HIS 15 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2did s GLU 16 N -6.58 2.41 -0.48 -0.41 0.41 -1.26 -4.69 118.70 108.09 2did s GLU 16 Ca 0.68 -0.79 -0.46 0.00 -0.41 0.00 0.00 54.97 53.99 2did s GLU 16 Cb -0.39 -2.40 -0.19 0.00 -1.78 0.00 0.00 34.13 29.36 2did s GLU 16 CO 0.91 0.59 1.72 0.00 -0.49 0.00 0.00 175.26 177.99 2did n ALA 17 N 1.65 -0.96 -2.40 5.21 0.00 -1.26 -2.62 120.51 120.12 2did n ALA 17 Ca -0.16 0.43 -0.39 0.00 0.00 0.00 0.00 53.44 53.32 2did n ALA 17 Cb 0.52 -1.98 -0.03 0.00 0.00 0.00 0.00 19.45 17.96 2did n ALA 17 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2did s LEU 18 N 3.64 3.25 -0.09 0.00 1.43 -1.26 -4.31 118.68 121.34 2did s LEU 18 Ca 1.07 -0.47 0.13 0.00 -1.03 0.00 0.00 54.13 53.83 2did s LEU 18 Cb -1.46 -2.55 0.19 0.00 0.03 0.00 0.00 46.19 42.40 2did s LEU 18 CO 0.78 -1.97 1.08 -0.24 0.23 0.00 0.00 176.35 176.23 2did n SER 19 N 10.39 1.97 -4.00 2.29 2.88 -1.25 -4.92 113.62 120.97 2did n SER 19 Ca 0.15 -2.70 -0.09 0.00 -1.33 0.00 0.00 58.87 54.91 2did n SER 19 Cb 0.50 -0.31 -0.10 0.00 -0.75 0.00 0.00 64.21 63.55 2did n SER 19 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2did s LEU 20 N -2.12 2.22 -0.01 2.46 1.43 -1.09 -1.12 118.68 120.46 2did s LEU 20 Ca 0.21 -0.62 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 2did s LEU 20 Cb 0.19 0.21 0.00 0.00 0.03 0.00 0.00 46.19 46.62 2did s LEU 20 CO 0.02 -0.41 -0.01 0.12 0.23 0.00 0.00 176.35 176.30 2did s PHE 21 N -2.23 0.16 -0.18 0.29 2.19 0.50 -0.30 117.98 118.41 2did s PHE 21 Ca -0.09 -0.02 -0.05 0.00 0.33 0.00 0.00 56.93 57.11 2did s PHE 21 Cb -0.04 -0.14 -0.03 0.00 -1.31 0.00 0.00 43.02 41.50 2did s PHE 21 CO -0.04 -0.02 -0.00 0.00 1.83 0.00 0.00 175.22 176.99 2did h TYR 23 N 7.15 -0.12 -0.77 0.00 -1.99 -1.85 0.23 116.97 119.61 2did h TYR 23 Ca -0.34 -0.00 0.21 0.00 2.00 0.00 0.00 58.73 60.60 2did h TYR 23 Cb 1.18 0.04 -0.14 0.00 2.00 0.00 0.00 36.73 39.81 2did h TYR 23 CO 0.57 -0.07 0.02 -1.91 -0.00 0.00 0.00 178.16 176.76 2did n GLU 24 N -3.05 -0.06 0.06 4.88 4.07 -1.26 0.23 120.64 125.51 2did n GLU 24 Ca -0.02 1.16 -0.10 0.00 -0.06 0.00 0.00 57.16 58.14 2did n GLU 24 Cb 0.05 -1.84 -0.13 0.00 -0.06 0.00 0.00 31.44 29.46 2did n GLU 24 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 2did h ASP 25 N 0.00 0.13 -1.93 4.31 3.32 -1.96 -3.48 116.42 116.81 2did h ASP 25 Ca 0.47 -0.16 -0.22 0.00 0.02 0.00 0.00 57.03 57.14 2did h ASP 25 Cb 0.97 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.49 2did h ASP 25 CO -0.73 1.13 -0.30 1.67 -1.72 0.00 0.00 179.24 179.29 2did n GLN 26 N -3.36 -1.47 -3.82 3.56 -0.06 0.62 -5.02 117.38 107.84 2did n GLN 26 Ca -0.06 0.52 -0.16 0.00 -2.00 0.00 0.00 57.00 55.30 2did n GLN 26 Cb 0.99 -4.59 -0.16 0.00 -4.06 0.00 0.00 30.24 22.42 2did n GLN 26 CO 0.00 0.00 0.00 -1.83 -0.20 0.00 0.00 177.06 175.03 2did s GLU 27 N -4.75 0.07 0.06 3.69 -1.05 -0.98 -5.00 118.70 110.74 2did s GLU 27 Ca 0.05 0.16 -0.35 0.00 -0.15 0.00 0.00 54.97 54.68 2did s GLU 27 Cb -0.02 -0.33 -0.14 0.00 -0.44 0.00 0.00 34.13 33.19 2did s GLU 27 CO 0.07 -0.16 1.59 0.00 0.95 0.00 0.00 175.26 177.71 2did n ALA 28 N 4.20 0.58 -2.43 -0.84 0.00 -1.26 -3.02 120.51 117.74 2did n ALA 28 Ca -0.27 0.43 -0.25 0.00 0.00 0.00 0.00 53.44 53.34 2did n ALA 28 Cb 0.50 -2.30 -0.06 0.00 0.00 0.00 0.00 19.45 17.59 2did n ALA 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2did s VAL 29 N 1.62 2.11 0.49 0.00 -7.23 0.59 -4.89 120.40 113.09 2did s VAL 29 Ca 0.84 -1.64 0.02 0.00 -1.81 0.00 0.00 61.98 59.39 2did s VAL 29 Cb -0.78 -2.75 0.02 0.00 0.56 0.00 0.00 36.38 33.43 2did s VAL 29 CO 0.45 0.00 0.17 0.00 -0.31 0.00 0.00 175.10 175.41 2did h LEU 31 N 0.00 -0.16 -0.14 0.00 3.38 -1.87 -1.58 115.31 114.93 2did h LEU 31 Ca -0.36 0.06 0.03 0.00 0.09 0.00 0.00 57.88 57.70 2did h LEU 31 Cb 1.18 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 42.03 2did h LEU 31 CO 0.59 -0.05 -0.05 0.40 0.09 0.00 0.00 178.44 179.42 2did h ILE 32 N 0.04 0.83 0.22 1.22 1.08 -1.95 -2.72 117.51 116.23 2did h ILE 32 Ca 0.12 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.59 2did h ILE 32 Cb 0.17 0.83 -0.04 0.00 -3.07 0.00 0.00 36.82 34.71 2did h ILE 32 CO -0.23 0.00 -0.47 0.00 -0.69 0.00 0.00 178.15 176.76 2did h ALA 34 N -0.76 2.05 -0.70 0.00 0.00 -1.19 1.24 119.26 119.89 2did h ALA 34 Ca -0.02 0.24 -0.44 0.00 0.00 0.00 0.00 54.91 54.68 2did h ALA 34 Cb 0.72 0.26 -0.21 0.00 0.00 0.00 0.00 17.79 18.56 2did h ALA 34 CO -0.19 -0.79 0.57 0.44 0.00 0.00 0.00 179.25 179.28 2did n ILE 35 N -5.18 2.97 -4.91 0.00 -5.35 -0.59 -4.57 119.36 101.73 2did n ILE 35 Ca 0.35 -1.94 -0.33 0.00 -0.27 0.00 0.00 62.75 60.56 2did n ILE 35 Cb 1.15 -1.06 -0.14 0.00 -1.74 0.00 0.00 39.64 37.85 2did n ILE 35 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2did s SER 36 N -0.67 3.92 0.31 7.28 0.15 0.42 -4.99 113.70 120.12 2did s SER 36 Ca 0.44 -0.25 0.05 0.00 0.70 0.00 0.00 55.95 56.89 2did s SER 36 Cb 0.35 -0.98 0.84 0.00 -1.71 0.00 0.00 66.02 64.53 2did s SER 36 CO 0.02 0.30 1.60 0.45 1.20 0.00 0.00 173.24 176.81 2did h HIS 37 N 5.67 0.22 -0.75 3.44 3.86 -1.91 1.16 115.15 126.85 2did h HIS 37 Ca -0.41 0.06 0.05 0.00 -1.16 0.00 0.00 60.37 58.91 2did h HIS 37 Cb 1.16 0.06 -0.04 0.00 1.06 0.00 0.00 27.41 29.65 2did h HIS 37 CO 0.49 -0.38 0.49 1.15 0.86 0.00 0.00 177.93 180.54 2did h THR 38 N 0.07 1.07 -1.83 2.45 2.02 -1.95 -2.60 112.91 112.14 2did h THR 38 Ca 0.63 -0.29 -0.69 0.00 0.77 0.00 0.00 66.41 66.82 2did h THR 38 Cb 1.37 0.14 -0.34 0.00 -1.74 0.00 0.00 68.15 67.58 2did h THR 38 CO -0.82 0.16 0.27 1.41 0.37 0.00 0.00 175.52 176.91 2did n HIS 39 N -4.47 3.19 -0.12 3.16 -0.00 0.40 -4.64 115.22 112.75 2did n HIS 39 Ca 0.10 -2.72 -0.25 0.00 -0.00 0.00 0.00 57.72 54.85 2did n HIS 39 Cb 0.17 -0.71 -0.11 0.00 -0.00 0.00 0.00 29.99 29.33 2did n HIS 39 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 2did n ARG 40 N -0.48 0.62 -1.76 -0.41 5.12 -0.94 -4.40 116.66 114.42 2did n ARG 40 Ca 0.47 0.28 -0.33 0.00 -1.93 0.00 0.00 57.85 56.33 2did n ARG 40 Cb 0.41 -1.56 0.05 0.00 -1.16 0.00 0.00 32.46 30.20 2did n ARG 40 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2did n ALA 41 N -3.72 6.00 -2.55 7.54 0.00 -1.26 -4.99 120.51 121.53 2did n ALA 41 Ca -0.47 -3.82 -0.28 0.00 0.00 0.00 0.00 53.44 48.88 2did n ALA 41 Cb 0.90 -1.42 -0.06 0.00 0.00 0.00 0.00 19.45 18.86 2did n ALA 41 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2did s HIS 42 N -3.82 2.14 -1.01 0.00 3.76 -1.26 -5.08 115.29 110.01 2did s HIS 42 Ca 0.57 -0.77 -0.07 0.00 -0.15 0.00 0.00 55.06 54.64 2did s HIS 42 Cb 0.46 -1.82 0.25 0.00 1.11 0.00 0.00 32.58 32.58 2did s HIS 42 CO -0.14 0.08 0.97 0.99 -0.85 0.00 0.00 174.74 175.80 2did s THR 43 N -2.74 5.44 0.19 1.30 2.01 -1.26 -5.05 115.64 115.53 2did s THR 43 Ca 0.28 -3.47 -0.18 0.00 0.31 0.00 0.00 61.69 58.62 2did s THR 43 Cb 0.03 -4.30 -0.08 0.00 0.01 0.00 0.00 72.50 68.16 2did s THR 43 CO 0.15 -1.14 0.66 -0.69 -0.69 0.00 0.00 174.62 172.92 2did s VAL 44 N -1.15 4.65 0.02 3.82 1.01 -1.26 -2.83 120.40 124.66 2did s VAL 44 Ca 0.28 1.17 0.04 0.00 0.00 0.00 0.00 61.98 63.47 2did s VAL 44 Cb -0.09 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 2did s VAL 44 CO -0.09 0.26 -0.11 0.68 0.00 0.00 0.00 175.10 175.84 2did s VAL 45 N -1.45 0.85 0.15 2.92 -7.23 0.79 -4.95 120.40 111.48 2did s VAL 45 Ca 0.40 -0.74 -0.31 0.00 -1.81 0.00 0.00 61.98 59.52 2did s VAL 45 Cb -0.17 -0.77 -0.08 0.00 0.56 0.00 0.00 36.38 35.92 2did s VAL 45 CO 0.20 0.03 1.33 -2.16 -0.31 0.00 0.00 175.10 174.20 2did s PRO 46 N -0.80 4.36 -0.07 4.82 0.04 -1.26 -0.37 135.00 141.73 2did s PRO 46 Ca 0.01 2.04 -0.18 0.00 0.04 0.00 0.00 61.00 62.91 2did s PRO 46 Cb -0.06 -3.23 -0.05 0.00 0.04 0.00 0.00 34.50 31.20 2did s PRO 46 CO 0.00 -0.33 0.49 -0.51 0.04 0.00 0.00 177.00 176.70 2did s LEU 47 N 0.48 4.35 0.15 -3.56 1.43 -0.27 -4.88 118.68 116.38 2did s LEU 47 Ca 0.60 0.93 -0.23 0.00 -1.03 0.00 0.00 54.13 54.40 2did s LEU 47 Cb -0.36 -2.73 -0.08 0.00 0.03 0.00 0.00 46.19 43.06 2did s LEU 47 CO 0.34 0.09 0.71 -0.44 0.23 0.00 0.00 176.35 177.28 2did s SER 48 N 0.08 7.24 0.15 2.29 0.01 -1.26 -4.80 113.70 117.41 2did s SER 48 Ca 0.27 1.50 0.00 0.00 1.31 0.00 0.00 55.95 59.03 2did s SER 48 Cb -0.16 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2did s SER 48 CO 0.12 0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.58 2did n GLY 49 N 1.45 0.58 3.76 3.44 0.00 -1.26 -5.04 105.19 108.11 2did n GLY 49 Ca -0.06 -1.86 -0.41 0.00 0.00 0.00 0.00 46.02 43.69 2did n GLY 49 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2did s PRO 50 N 0.32 4.44 -0.40 1.61 0.04 -1.26 -4.88 135.00 134.88 2did s PRO 50 Ca 0.00 2.05 -0.43 0.00 0.04 0.00 0.00 61.00 62.66 2did s PRO 50 Cb 0.00 -3.14 -0.19 0.00 0.04 0.00 0.00 34.50 31.21 2did s PRO 50 CO 0.00 -0.11 1.43 0.45 0.04 0.00 0.00 177.00 178.81 2did n SER 51 N 1.54 0.96 -4.22 6.66 2.88 -1.26 -4.93 113.62 115.24 2did n SER 51 Ca 0.02 1.11 -0.15 0.00 -1.33 0.00 0.00 58.87 58.52 2did n SER 51 Cb 0.43 -0.83 -0.10 0.00 -0.75 0.00 0.00 64.21 62.95 2did n SER 51 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2did s SER 52 N 2.38 1.73 0.00 -3.46 0.15 -1.26 -5.33 113.70 107.90 2did s SER 52 Ca 0.97 -0.90 0.07 0.00 0.70 0.00 0.00 55.95 56.78 2did s SER 52 Cb -1.38 -0.02 0.05 0.00 -1.71 0.00 0.00 66.02 62.97 2did s SER 52 CO 0.73 -0.27 0.71 0.61 1.20 0.00 0.00 173.24 176.23