#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2did n SER 2 N 0.00 0.53 -3.57 1.61 7.64 -1.26 -4.80 113.62 113.77 2did n SER 2 Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.88 2did n SER 2 Cb 0.00 -1.01 -0.06 0.00 -1.01 0.00 0.00 64.21 62.13 2did n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2did s SER 3 N 9.02 -0.46 -0.42 6.43 0.15 -1.26 -5.11 113.70 122.05 2did s SER 3 Ca 1.29 0.70 0.05 0.00 0.70 0.00 0.00 55.95 58.69 2did s SER 3 Cb -1.05 1.30 0.18 0.00 -1.71 0.00 0.00 66.02 64.75 2did s SER 3 CO 0.45 -0.11 0.39 0.61 1.20 0.00 0.00 173.24 175.79 2did n GLY 4 N 4.00 1.99 3.63 9.45 0.00 -1.26 -5.11 105.19 117.89 2did n GLY 4 Ca -0.15 -1.19 -0.08 0.00 0.00 0.00 0.00 46.02 44.59 2did n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2did s SER 5 N -0.04 -0.36 -0.23 1.61 1.04 -1.26 -5.08 113.70 109.38 2did s SER 5 Ca 0.33 -0.26 -0.14 0.00 0.48 0.00 0.00 55.95 56.36 2did s SER 5 Cb 0.05 0.57 -0.17 0.00 0.10 0.00 0.00 66.02 66.57 2did s SER 5 CO -0.18 -1.00 -0.02 -1.20 0.98 0.00 0.00 173.24 171.82 2did n SER 6 N -0.40 1.95 0.00 7.02 7.64 -1.26 -5.01 113.62 123.56 2did n SER 6 Ca -0.09 0.30 0.00 0.00 1.01 0.00 0.00 58.87 60.08 2did n SER 6 Cb 0.62 -0.83 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 2did n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2did n GLY 7 N 1.54 1.24 3.47 0.23 0.00 -1.26 -4.76 105.19 105.65 2did n GLY 7 Ca -0.42 0.24 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 2did n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2did s GLU 8 N 0.00 1.36 0.71 1.61 8.01 -1.26 -5.15 118.70 123.98 2did s GLU 8 Ca 0.00 -1.16 -0.16 0.00 0.01 0.00 0.00 54.97 53.66 2did s GLU 8 Cb 0.00 0.44 0.03 0.00 -4.31 0.00 0.00 34.13 30.29 2did s GLU 8 CO 0.00 -0.54 1.26 -1.12 0.01 0.00 0.00 175.26 174.87 2did s SER 9 N -2.97 4.16 0.03 -0.19 0.01 -1.26 -4.97 113.70 108.51 2did s SER 9 Ca 0.18 2.53 -0.08 0.00 1.31 0.00 0.00 55.95 59.89 2did s SER 9 Cb 0.01 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.63 2did s SER 9 CO 0.03 -2.30 0.16 -0.76 0.41 0.00 0.00 173.24 170.79 2did s LEU 10 N -4.93 1.49 0.24 2.44 1.43 -1.26 -2.98 118.68 115.11 2did s LEU 10 Ca 0.79 -0.37 -0.30 0.00 -1.03 0.00 0.00 54.13 53.21 2did s LEU 10 Cb -0.34 0.84 -0.11 0.00 0.03 0.00 0.00 46.19 46.61 2did s LEU 10 CO 0.44 -0.51 1.53 0.00 0.23 0.00 0.00 176.35 178.04 2did n PRO 12 N 2.77 0.42 0.00 0.00 -0.04 -1.26 0.20 135.00 137.09 2did n PRO 12 Ca 0.09 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 2did n PRO 12 Cb 0.39 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.06 1.18 -0.06 0.54 1.13 -1.26 -4.82 117.38 113.03 2did n GLN 13 Ca 0.11 0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 55.12 2did n GLN 13 Cb 0.07 -0.96 -0.12 0.00 0.11 0.00 0.00 30.24 29.34 2did n GLN 13 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2did n HIS 14 N -2.25 0.00 -2.09 1.08 8.25 -1.18 -5.00 115.22 114.03 2did n HIS 14 Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.32 2did n HIS 14 Cb 0.46 -0.67 -0.02 0.00 1.12 0.00 0.00 29.99 30.88 2did n HIS 14 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2did n HIS 15 N -2.47 -0.53 -3.92 4.41 -0.00 0.53 -4.86 115.22 108.37 2did n HIS 15 Ca -0.21 0.00 -0.21 0.00 0.46 0.00 0.00 57.72 57.76 2did n HIS 15 Cb 0.89 -2.94 -0.02 0.00 -0.12 0.00 0.00 29.99 27.80 2did n HIS 15 CO 0.00 0.00 0.00 -1.21 0.46 0.00 0.00 176.34 175.59 2did s GLU 16 N -4.39 3.34 -0.20 1.57 8.01 -1.26 -4.56 118.70 121.20 2did s GLU 16 Ca 0.00 -0.83 -0.37 0.00 0.01 0.00 0.00 54.97 53.78 2did s GLU 16 Cb 0.00 -2.84 -0.14 0.00 -4.31 0.00 0.00 34.13 26.84 2did s GLU 16 CO 0.00 0.37 1.84 0.00 0.01 0.00 0.00 175.26 177.49 2did n ALA 17 N -1.42 0.39 -2.75 5.21 0.00 -1.26 -2.07 120.51 118.62 2did n ALA 17 Ca -0.08 0.31 -0.42 0.00 0.00 0.00 0.00 53.44 53.25 2did n ALA 17 Cb 0.57 -2.38 -0.04 0.00 0.00 0.00 0.00 19.45 17.61 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 4.10 3.96 -0.13 0.00 1.43 -1.16 -4.24 118.68 122.64 2did s LEU 18 Ca 0.97 -0.78 0.15 0.00 -1.03 0.00 0.00 54.13 53.43 2did s LEU 18 Cb -0.88 -2.48 0.32 0.00 0.03 0.00 0.00 46.19 43.17 2did s LEU 18 CO 0.58 -1.57 1.16 -1.20 0.23 0.00 0.00 176.35 175.55 2did n SER 19 N 8.27 1.68 -4.04 2.29 7.64 -1.25 -4.91 113.62 123.29 2did n SER 19 Ca -0.01 -3.15 -0.08 0.00 1.01 0.00 0.00 58.87 56.63 2did n SER 19 Cb 0.47 -0.43 -0.09 0.00 -1.01 0.00 0.00 64.21 63.15 2did n SER 19 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2did s LEU 20 N -2.35 1.85 -0.16 -3.43 1.43 -1.18 -1.91 118.68 112.93 2did s LEU 20 Ca 0.31 -0.98 -0.04 0.00 -1.03 0.00 0.00 54.13 52.39 2did s LEU 20 Cb 0.29 0.53 0.08 0.00 0.03 0.00 0.00 46.19 47.13 2did s LEU 20 CO -0.03 -0.71 0.24 0.12 0.23 0.00 0.00 176.35 176.20 2did s PHE 21 N -3.95 -0.36 -0.56 0.29 5.36 0.52 -2.15 117.98 117.12 2did s PHE 21 Ca 0.13 0.62 -0.28 0.00 -0.96 0.00 0.00 56.93 56.45 2did s PHE 21 Cb 0.07 -0.19 0.01 0.00 -0.34 0.00 0.00 43.02 42.57 2did s PHE 21 CO -0.05 -0.47 1.41 0.00 -1.46 0.00 0.00 175.22 174.65 2did h TYR 23 N 10.99 1.20 0.53 0.00 3.20 -1.66 0.15 116.97 131.39 2did h TYR 23 Ca -0.27 -0.07 -0.02 0.00 3.14 0.00 0.00 58.73 61.51 2did h TYR 23 Cb 1.09 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 38.98 2did h TYR 23 CO 1.03 0.89 -0.48 1.49 -1.64 0.00 0.00 178.16 179.45 2did h GLU 24 N 1.16 -0.97 -0.08 1.82 4.22 -1.90 -1.65 114.58 117.18 2did h GLU 24 Ca 0.27 0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.78 2did h GLU 24 Cb 0.17 0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2did h GLU 24 CO -0.03 -0.64 0.00 -0.25 -2.18 0.00 0.00 179.01 175.91 2did n ASP 25 N -5.40 0.45 -4.11 1.04 8.00 -1.19 -4.89 116.55 110.45 2did n ASP 25 Ca -0.12 -1.99 -0.28 0.00 0.71 0.00 0.00 54.79 53.10 2did n ASP 25 Cb 0.45 -0.06 -0.09 0.00 -0.02 0.00 0.00 41.12 41.41 2did n ASP 25 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2did n GLN 26 N -0.26 -0.93 -3.83 -1.24 1.13 0.42 -4.90 117.38 107.77 2did n GLN 26 Ca 0.03 0.08 -0.11 0.00 -1.94 0.00 0.00 57.00 55.06 2did n GLN 26 Cb 0.07 -3.23 -0.09 0.00 0.11 0.00 0.00 30.24 27.10 2did n GLN 26 CO 0.00 0.00 0.00 -1.83 -1.44 0.00 0.00 177.06 173.79 2did s GLU 27 N -6.84 0.67 0.36 -1.09 -1.05 -0.54 -5.01 118.70 105.20 2did s GLU 27 Ca 0.06 -0.54 -0.25 0.00 -0.15 0.00 0.00 54.97 54.08 2did s GLU 27 Cb -0.03 0.28 -0.09 0.00 -0.44 0.00 0.00 34.13 33.84 2did s GLU 27 CO 0.88 -0.19 1.01 0.00 0.95 0.00 0.00 175.26 177.92 2did s ALA 28 N -2.26 3.17 0.26 -0.84 0.00 -1.26 -0.07 121.76 120.76 2did s ALA 28 Ca -0.07 0.66 0.03 0.00 0.00 0.00 0.00 51.96 52.57 2did s ALA 28 Cb -0.02 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 2did s ALA 28 CO -0.02 -0.06 0.19 0.14 0.00 0.00 0.00 175.76 176.02 2did s VAL 29 N -1.59 0.01 0.46 0.00 -7.23 -0.91 -4.82 120.40 106.33 2did s VAL 29 Ca 0.53 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.77 2did s VAL 29 Cb -0.22 -2.50 -0.01 0.00 0.56 0.00 0.00 36.38 34.21 2did s VAL 29 CO 0.28 0.00 0.31 0.00 -0.31 0.00 0.00 175.10 175.37 2did h LEU 31 N 1.09 0.59 -0.37 0.00 -0.00 -1.92 -1.36 115.31 113.33 2did h LEU 31 Ca -0.40 0.02 -0.09 0.00 -0.00 0.00 0.00 57.88 57.41 2did h LEU 31 Cb 1.27 -0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 41.82 2did h LEU 31 CO 0.62 0.34 -0.11 0.40 -0.00 0.00 0.00 178.44 179.69 2did h ILE 32 N 0.65 1.28 -0.27 0.15 2.04 -1.95 -2.77 117.51 116.63 2did h ILE 32 Ca 0.36 -1.20 0.01 0.00 1.00 0.00 0.00 64.86 65.03 2did h ILE 32 Cb 0.53 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 2did h ILE 32 CO -0.14 0.40 0.16 0.00 0.00 0.00 0.00 178.15 178.57 2did h ALA 34 N 1.12 -0.81 0.00 0.00 0.00 -1.35 -1.42 119.26 116.80 2did h ALA 34 Ca 0.11 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2did h ALA 34 Cb -0.01 0.60 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2did h ALA 34 CO -0.05 -1.00 -0.00 -0.84 0.00 0.00 0.00 179.25 177.36 2did h ILE 35 N -0.75 0.59 -3.26 0.00 3.07 -1.39 -3.38 117.51 112.38 2did h ILE 35 Ca -0.02 -0.02 -0.53 0.00 1.55 0.00 0.00 64.86 65.85 2did h ILE 35 Cb 0.70 1.01 0.05 0.00 -0.27 0.00 0.00 36.82 38.31 2did h ILE 35 CO -0.12 0.00 0.75 -0.94 -1.05 0.00 0.00 178.15 176.80 2did s SER 36 N -6.29 6.71 0.60 2.16 1.04 -0.13 -4.86 113.70 112.92 2did s SER 36 Ca -0.05 2.58 0.29 0.00 0.48 0.00 0.00 55.95 59.24 2did s SER 36 Cb 0.15 -2.61 1.40 0.00 0.10 0.00 0.00 66.02 65.06 2did s SER 36 CO 0.57 -0.68 1.80 -0.74 0.98 0.00 0.00 173.24 175.17 2did h HIS 37 N 5.52 0.00 -0.63 5.02 2.76 -1.82 0.21 115.15 126.21 2did h HIS 37 Ca -0.45 0.00 0.06 0.00 -2.20 0.00 0.00 60.37 57.78 2did h HIS 37 Cb 1.21 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 30.14 2did h HIS 37 CO 0.62 0.00 0.41 1.15 -1.30 0.00 0.00 177.93 178.81 2did h THR 38 N 0.00 1.02 -2.12 6.26 2.02 -1.89 -3.21 112.91 114.99 2did h THR 38 Ca 0.25 -0.22 -0.58 0.00 0.77 0.00 0.00 66.41 66.63 2did h THR 38 Cb 1.43 0.32 -0.41 0.00 -1.74 0.00 0.00 68.15 67.75 2did h THR 38 CO -0.00 0.12 -0.79 1.41 0.37 0.00 0.00 175.52 176.63 2did n HIS 39 N -4.47 2.17 -0.04 3.16 8.25 0.73 -4.85 115.22 120.17 2did n HIS 39 Ca 0.09 -3.93 -0.07 0.00 -0.26 0.00 0.00 57.72 53.54 2did n HIS 39 Cb 0.22 -0.48 -0.03 0.00 1.12 0.00 0.00 29.99 30.82 2did n HIS 39 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2did n ARG 40 N 1.01 0.16 0.16 -0.41 5.12 -1.21 -4.47 116.66 117.02 2did n ARG 40 Ca 0.27 0.06 0.01 0.00 -1.93 0.00 0.00 57.85 56.26 2did n ARG 40 Cb 0.46 -0.83 0.26 0.00 -1.16 0.00 0.00 32.46 31.19 2did n ARG 40 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2did h ALA 41 N -0.22 1.10 -2.23 7.54 0.00 -1.88 -3.45 119.26 120.11 2did h ALA 41 Ca -0.18 -0.45 -0.48 0.00 0.00 0.00 0.00 54.91 53.79 2did h ALA 41 Cb 1.18 -0.08 0.20 0.00 0.00 0.00 0.00 17.79 19.08 2did h ALA 41 CO -0.10 0.62 0.14 -1.01 0.00 0.00 0.00 179.25 178.91 2did s HIS 42 N -3.78 1.61 -1.07 0.00 3.76 -1.26 -4.94 115.29 109.60 2did s HIS 42 Ca -0.02 1.50 -0.10 0.00 -0.15 0.00 0.00 55.06 56.29 2did s HIS 42 Cb 0.13 -3.22 0.26 0.00 1.11 0.00 0.00 32.58 30.86 2did s HIS 42 CO 0.74 -3.17 1.09 0.99 -0.85 0.00 0.00 174.74 173.54 2did s THR 43 N -2.61 5.84 -0.07 1.30 2.01 -1.26 -4.97 115.64 115.88 2did s THR 43 Ca 0.67 -3.17 -0.30 0.00 0.31 0.00 0.00 61.69 59.20 2did s THR 43 Cb -0.23 -4.62 -0.02 0.00 0.01 0.00 0.00 72.50 67.64 2did s THR 43 CO 0.60 -1.21 1.07 -0.69 -0.69 0.00 0.00 174.62 173.71 2did s VAL 44 N -0.71 4.59 0.01 3.82 1.01 -1.26 -1.99 120.40 125.87 2did s VAL 44 Ca 0.30 1.88 0.05 0.00 0.00 0.00 0.00 61.98 64.20 2did s VAL 44 Cb -0.09 -4.20 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 2did s VAL 44 CO -0.07 0.03 -0.13 0.68 0.00 0.00 0.00 175.10 175.61 2did s VAL 45 N 1.88 3.20 0.17 2.92 -7.23 0.00 -4.91 120.40 116.44 2did s VAL 45 Ca 0.52 -0.93 -0.30 0.00 -1.81 0.00 0.00 61.98 59.46 2did s VAL 45 Cb -0.21 -2.35 -0.08 0.00 0.56 0.00 0.00 36.38 34.29 2did s VAL 45 CO 0.21 0.41 1.32 -2.16 -0.31 0.00 0.00 175.10 174.57 2did s PRO 46 N -1.30 4.37 -0.13 4.82 0.04 -1.26 -0.36 135.00 141.19 2did s PRO 46 Ca 0.15 2.04 0.13 0.00 0.04 0.00 0.00 61.00 63.37 2did s PRO 46 Cb -0.11 -3.21 -0.24 0.00 0.04 0.00 0.00 34.50 30.98 2did s PRO 46 CO 0.05 -0.30 0.34 1.28 0.04 0.00 0.00 177.00 178.42 2did n LEU 47 N 3.00 0.69 -4.32 -3.56 4.77 -0.80 -4.88 117.00 111.90 2did n LEU 47 Ca 0.07 0.19 -0.39 0.00 -0.03 0.00 0.00 56.01 55.86 2did n LEU 47 Cb 0.43 0.19 0.02 0.00 -2.33 0.00 0.00 43.42 41.72 2did n LEU 47 CO 0.58 0.49 -0.43 -1.54 -1.33 0.00 0.00 177.39 175.16 2did n SER 48 N -2.95 -2.85 0.00 -1.43 3.41 -1.25 -4.96 113.62 103.59 2did n SER 48 Ca -0.26 0.69 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 2did n SER 48 Cb 1.10 -0.94 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 2did n SER 48 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2did n GLY 49 N 2.28 -1.47 3.57 5.00 0.00 -1.26 -4.63 105.19 108.68 2did n GLY 49 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 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 0.00 2.96 -0.49 1.61 0.04 -1.26 -4.91 135.00 132.96 2did s PRO 50 Ca 0.00 0.92 0.05 0.00 0.04 0.00 0.00 61.00 62.01 2did s PRO 50 Cb 0.00 -4.29 0.19 0.00 0.04 0.00 0.00 34.50 30.45 2did s PRO 50 CO 0.00 -2.32 0.45 -1.13 0.04 0.00 0.00 177.00 174.04 2did n SER 51 N 11.51 0.79 -0.03 6.66 3.41 -1.26 -4.95 113.62 129.75 2did n SER 51 Ca 0.21 -2.72 -0.14 0.00 -0.26 0.00 0.00 58.87 55.96 2did n SER 51 Cb 0.50 -0.62 -0.10 0.00 -0.26 0.00 0.00 64.21 63.73 2did n SER 51 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2did h SER 52 N 5.11 0.28 0.00 4.04 0.87 -2.00 -3.53 113.55 118.32 2did h SER 52 Ca 0.20 -0.65 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2did h SER 52 Cb 0.85 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.72 2did h SER 52 CO 0.51 0.88 0.00 0.61 -0.53 0.00 0.00 176.83 178.30