#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1log s SER 3 N 0.00 1.89 -0.04 8.00 0.01 -1.26 -5.14 113.70 117.17 1log s SER 3 Ca 0.00 -0.51 0.02 0.00 1.31 0.00 0.00 55.95 56.77 1log s SER 3 Cb 0.00 -0.12 0.01 0.00 0.21 0.00 0.00 66.02 66.12 1log s SER 3 CO 0.00 0.04 -0.08 -0.31 0.41 0.00 0.00 173.24 173.30 1log s TYR 4 N -0.93 0.95 -0.03 2.43 1.51 -1.26 -5.15 117.35 114.88 1log s TYR 4 Ca 0.03 -0.26 0.02 0.00 -1.01 0.00 0.00 57.07 55.84 1log s TYR 4 Cb -0.09 -0.72 0.01 0.00 -0.11 0.00 0.00 41.96 41.06 1log s TYR 4 CO 0.02 -0.15 -0.07 0.95 -1.11 0.00 0.00 175.55 175.20 1log s THR 5 N 0.44 0.62 -0.01 -0.71 -4.23 -1.26 -5.15 115.64 105.35 1log s THR 5 Ca -0.07 -0.25 0.01 0.00 -1.18 0.00 0.00 61.69 60.20 1log s THR 5 Cb -0.11 -0.58 0.01 0.00 1.34 0.00 0.00 72.50 73.15 1log s THR 5 CO 0.01 0.21 -0.03 -0.22 -0.54 0.00 0.00 174.62 174.05 1log s LEU 6 N 0.41 1.74 -0.02 4.79 2.96 -1.26 -5.16 118.68 122.14 1log s LEU 6 Ca -0.06 -0.07 0.04 0.00 -0.22 0.00 0.00 54.13 53.82 1log s LEU 6 Cb -0.10 -0.24 -0.01 0.00 0.50 0.00 0.00 46.19 46.34 1log s LEU 6 CO 0.00 0.00 -0.14 0.20 -1.32 0.00 0.00 176.35 175.10 1log s ASN 7 N 0.27 1.75 -0.21 3.68 -0.87 -1.26 -5.16 114.94 113.14 1log s ASN 7 Ca -0.03 -0.27 -0.19 0.00 -1.57 0.00 0.00 52.86 50.79 1log s ASN 7 Cb -0.06 -0.33 0.06 0.00 -0.02 0.00 0.00 41.25 40.90 1log s ASN 7 CO -0.00 0.15 0.57 -1.61 -2.57 0.00 0.00 177.10 173.63 1log s GLU 8 N -0.13 0.66 -0.28 -0.60 0.41 -1.26 -5.11 118.70 112.39 1log s GLU 8 Ca 0.01 0.79 -0.29 0.00 -0.41 0.00 0.00 54.97 55.08 1log s GLU 8 Cb -0.08 0.32 -0.01 0.00 -1.78 0.00 0.00 34.13 32.58 1log s GLU 8 CO 0.00 -0.08 1.39 0.08 -0.49 0.00 0.00 175.26 176.17 1log s VAL 9 N 0.33 4.01 -0.32 2.63 1.01 -1.26 -4.96 120.40 121.83 1log s VAL 9 Ca -0.00 1.13 0.01 0.00 0.00 0.00 0.00 61.98 63.12 1log s VAL 9 Cb -0.04 -4.03 0.10 0.00 0.00 0.00 0.00 36.38 32.41 1log s VAL 9 CO 0.00 -0.43 0.08 -0.69 0.00 0.00 0.00 175.10 174.06 1log s VAL 10 N 4.64 1.37 -1.16 2.92 1.01 -1.26 -5.07 120.40 122.85 1log s VAL 10 Ca 0.61 -1.73 -0.23 0.00 0.00 0.00 0.00 61.98 60.63 1log s VAL 10 Cb -0.19 -2.03 -0.07 0.00 0.00 0.00 0.00 36.38 34.09 1log s VAL 10 CO 0.25 -0.65 1.92 -2.16 0.00 0.00 0.00 175.10 174.46 1log s PRO 11 N 1.37 2.61 0.35 2.72 0.04 -1.26 -4.86 135.00 135.96 1log s PRO 11 Ca 0.10 -1.13 0.15 0.00 0.04 0.00 0.00 61.00 60.16 1log s PRO 11 Cb -0.18 -5.25 1.12 0.00 0.04 0.00 0.00 34.50 30.23 1log s PRO 11 CO -0.19 -3.79 1.66 -0.07 0.04 0.00 0.00 177.00 174.64 1log h LEU 12 N 17.37 0.50 -1.65 -3.56 4.07 -1.99 -1.66 115.31 128.39 1log h LEU 12 Ca 0.22 0.20 0.16 0.00 0.08 0.00 0.00 57.88 58.54 1log h LEU 12 Cb 0.94 0.15 -0.05 0.00 1.08 0.00 0.00 40.66 42.78 1log h LEU 12 CO 1.24 -0.16 0.51 0.11 -1.08 0.00 0.00 178.44 179.06 1log h LYS 13 N 0.29 0.33 0.00 1.13 1.57 -1.89 -1.45 116.57 116.56 1log h LYS 13 Ca 0.75 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.51 1log h LYS 13 Cb 1.74 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.98 1log h LYS 13 CO -0.61 0.22 0.00 0.93 -0.57 0.00 0.00 179.45 179.41 1log h GLU 14 N 0.34 0.00 0.00 3.15 4.39 -1.71 -3.37 114.58 117.37 1log h GLU 14 Ca 0.37 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 60.05 1log h GLU 14 Cb 0.95 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.60 1log h GLU 14 CO -0.10 0.00 -1.30 1.19 -1.16 0.00 0.00 179.01 177.64 1log n PHE 15 N -2.72 0.00 -4.68 4.33 3.72 -0.58 -5.05 117.46 112.48 1log n PHE 15 Ca 0.04 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.16 1log n PHE 15 Cb 0.42 -0.17 -0.14 0.00 -0.94 0.00 0.00 39.48 38.65 1log n PHE 15 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1log s VAL 16 N -2.35 1.98 1.08 -4.37 1.01 -1.01 -5.14 120.40 111.61 1log s VAL 16 Ca -0.02 -1.41 -0.12 0.00 0.00 0.00 0.00 61.98 60.42 1log s VAL 16 Cb 0.03 -1.72 0.22 0.00 0.00 0.00 0.00 36.38 34.90 1log s VAL 16 CO 0.24 0.23 0.93 -2.65 0.00 0.00 0.00 175.10 173.86 1log n PRO 17 N 1.58 -1.65 -0.03 2.72 -0.02 -1.26 -4.77 135.00 131.58 1log n PRO 17 Ca -0.17 -0.44 -0.03 0.00 -2.02 0.00 0.00 63.50 60.84 1log n PRO 17 Cb 0.53 -2.18 0.20 0.00 -0.02 0.00 0.00 33.50 32.03 1log n PRO 17 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1log h GLU 18 N -2.33 0.59 -5.39 -0.52 5.08 -1.99 -3.40 114.58 106.62 1log h GLU 18 Ca -0.54 -0.18 -0.65 0.00 -1.00 0.00 0.00 59.36 56.98 1log h GLU 18 Cb 1.31 -0.06 -0.25 0.00 0.50 0.00 0.00 28.75 30.25 1log h GLU 18 CO 0.45 0.71 -0.74 -1.58 -1.00 0.00 0.00 179.01 176.84 1log s TRP 19 N -4.74 2.86 0.15 4.33 0.52 -1.26 -5.13 118.94 115.67 1log s TRP 19 Ca -0.08 -0.52 0.03 0.00 0.02 0.00 0.00 56.10 55.55 1log s TRP 19 Cb 0.14 -1.85 -0.04 0.00 -1.15 0.00 0.00 33.47 30.56 1log s TRP 19 CO 0.79 -0.14 -0.06 0.14 0.02 0.00 0.00 176.95 177.71 1log s VAL 20 N 0.26 0.92 -0.03 4.03 -7.23 -1.26 -5.14 120.40 111.95 1log s VAL 20 Ca -0.08 -2.01 0.02 0.00 -1.81 0.00 0.00 61.98 58.11 1log s VAL 20 Cb -0.15 -1.92 -0.03 0.00 0.56 0.00 0.00 36.38 34.84 1log s VAL 20 CO 0.05 -0.68 -0.06 -0.13 -0.31 0.00 0.00 175.10 173.97 1log s ARG 21 N -3.82 2.66 0.10 4.82 0.52 -1.26 -5.14 118.95 116.83 1log s ARG 21 Ca 0.18 -0.64 0.05 0.00 -0.52 0.00 0.00 55.73 54.81 1log s ARG 21 Cb 0.04 -2.56 -0.04 0.00 0.52 0.00 0.00 34.95 32.91 1log s ARG 21 CO 0.01 0.63 0.01 0.96 0.02 0.00 0.00 175.30 176.92 1log s ILE 22 N -0.94 4.01 0.00 1.52 -4.36 -1.26 -5.12 121.20 115.05 1log s ILE 22 Ca 0.16 -1.04 0.00 0.00 -0.26 0.00 0.00 60.65 59.51 1log s ILE 22 Cb -0.11 -2.93 0.00 0.00 1.25 0.00 0.00 42.46 40.67 1log s ILE 22 CO 0.05 0.08 0.00 0.61 0.24 0.00 0.00 174.94 175.93 1log n GLY 23 N 0.45 0.82 3.39 6.27 0.00 -1.26 -5.16 105.19 109.70 1log n GLY 23 Ca -0.10 -0.73 -0.25 0.00 0.00 0.00 0.00 46.02 44.93 1log n GLY 23 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1log s PHE 24 N -2.66 2.14 0.03 1.61 0.08 -1.26 -5.15 117.98 112.77 1log s PHE 24 Ca 0.00 -0.39 0.01 0.00 0.12 0.00 0.00 56.93 56.67 1log s PHE 24 Cb 0.00 -1.07 -0.02 0.00 -0.57 0.00 0.00 43.02 41.36 1log s PHE 24 CO 0.00 0.44 -0.05 0.45 -0.10 0.00 0.00 175.22 175.96 1log s SER 25 N -2.62 0.49 -0.13 1.36 0.15 -1.26 -5.16 113.70 106.52 1log s SER 25 Ca 0.19 -0.46 -0.19 0.00 0.70 0.00 0.00 55.95 56.19 1log s SER 25 Cb -0.07 0.06 0.05 0.00 -1.71 0.00 0.00 66.02 64.34 1log s SER 25 CO 0.09 -0.22 0.48 0.00 1.20 0.00 0.00 173.24 174.79 1log s ALA 26 N -1.24 -1.21 0.23 5.45 0.00 -1.26 -5.18 121.76 118.55 1log s ALA 26 Ca -0.11 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.02 1log s ALA 26 Cb -0.09 -0.52 -0.05 0.00 0.00 0.00 0.00 23.12 22.47 1log s ALA 26 CO -0.00 -0.26 0.10 0.95 0.00 0.00 0.00 175.76 176.55 1log s THR 27 N -0.27 0.34 0.10 0.00 -4.23 -1.26 -5.12 115.64 105.21 1log s THR 27 Ca -0.04 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 58.49 1log s THR 27 Cb -0.03 -2.53 -0.04 0.00 1.34 0.00 0.00 72.50 71.24 1log s THR 27 CO 0.03 -0.05 -0.07 0.42 -0.54 0.00 0.00 174.62 174.41 1log s THR 28 N -3.91 0.75 0.00 3.99 -4.23 -1.26 -4.87 115.64 106.10 1log s THR 28 Ca 0.37 -1.95 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 1log s THR 28 Cb 0.07 -1.70 0.00 0.00 1.34 0.00 0.00 72.50 72.21 1log s THR 28 CO 0.12 -0.86 0.00 0.61 -0.54 0.00 0.00 174.62 173.95 1log n GLY 29 N -0.06 2.89 0.16 3.99 0.00 -1.26 -4.98 105.19 105.93 1log n GLY 29 Ca -0.12 -0.31 0.04 0.00 0.00 0.00 0.00 46.02 45.63 1log n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1log h ALA 30 N 1.00 0.80 -1.99 4.61 0.00 -2.07 -3.43 119.26 118.17 1log h ALA 30 Ca 0.00 -0.41 -0.57 0.00 0.00 0.00 0.00 54.91 53.94 1log h ALA 30 Cb 0.00 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 17.62 1log h ALA 30 CO 0.00 0.56 -0.61 -2.00 0.00 0.00 0.00 179.25 177.21 1log s GLU 31 N -3.24 2.21 0.21 0.00 2.56 -1.26 -5.15 118.70 114.02 1log s GLU 31 Ca 0.02 -1.60 -0.13 0.00 0.00 0.00 0.00 54.97 53.26 1log s GLU 31 Cb 0.09 -2.06 0.01 0.00 2.00 0.00 0.00 34.13 34.17 1log s GLU 31 CO 0.72 0.20 0.44 -0.59 -0.56 0.00 0.00 175.26 175.46 1log s PHE 32 N -2.44 0.20 0.10 5.30 -0.12 -1.26 -4.75 117.98 115.01 1log s PHE 32 Ca 0.35 -0.56 -0.25 0.00 -0.05 0.00 0.00 56.93 56.41 1log s PHE 32 Cb -0.03 0.19 0.08 0.00 -0.63 0.00 0.00 43.02 42.64 1log s PHE 32 CO 0.20 -0.89 0.70 0.00 -0.05 0.00 0.00 175.22 175.18 1log s ALA 33 N -3.95 -1.68 0.06 1.99 0.00 -1.26 -5.09 121.76 111.82 1log s ALA 33 Ca 0.16 0.69 -0.13 0.00 0.00 0.00 0.00 51.96 52.68 1log s ALA 33 Cb 0.00 0.70 -0.06 0.00 0.00 0.00 0.00 23.12 23.76 1log s ALA 33 CO 0.02 -0.73 0.44 0.00 0.00 0.00 0.00 175.76 175.50 1log s ALA 34 N -3.46 3.68 -0.15 0.00 0.00 -1.26 -4.95 121.76 115.63 1log s ALA 34 Ca 0.02 -0.24 0.01 0.00 0.00 0.00 0.00 51.96 51.75 1log s ALA 34 Cb -0.01 -2.39 0.02 0.00 0.00 0.00 0.00 23.12 20.74 1log s ALA 34 CO -0.11 0.50 -0.15 -1.01 0.00 0.00 0.00 175.76 174.98 1log s HIS 35 N -1.26 2.27 0.11 0.00 3.76 -1.26 -5.12 115.29 113.79 1log s HIS 35 Ca 0.30 -1.27 0.05 0.00 -0.15 0.00 0.00 55.06 53.98 1log s HIS 35 Cb -0.16 -1.64 -0.04 0.00 1.11 0.00 0.00 32.58 31.85 1log s HIS 35 CO 0.16 -0.68 -0.12 -1.21 -0.85 0.00 0.00 174.74 172.05 1log s GLU 36 N 1.39 0.93 -0.05 1.40 2.02 -1.26 -5.08 118.70 118.06 1log s GLU 36 Ca 0.04 -1.21 0.05 0.00 0.02 0.00 0.00 54.97 53.87 1log s GLU 36 Cb -0.13 -0.69 -0.01 0.00 0.10 0.00 0.00 34.13 33.40 1log s GLU 36 CO -0.10 0.12 -0.20 0.08 0.02 0.00 0.00 175.26 175.18 1log s VAL 37 N -2.36 1.64 -0.07 2.63 1.01 -1.26 -5.04 120.40 116.95 1log s VAL 37 Ca 0.07 -0.83 0.19 0.00 0.00 0.00 0.00 61.98 61.41 1log s VAL 37 Cb -0.03 -1.40 -0.29 0.00 0.00 0.00 0.00 36.38 34.66 1log s VAL 37 CO 0.01 0.46 0.33 0.18 0.00 0.00 0.00 175.10 176.09 1log n LEU 38 N 3.07 0.00 -3.44 3.92 4.32 -1.26 -5.04 117.00 118.56 1log n LEU 38 Ca -0.18 0.00 -0.11 0.00 -0.02 0.00 0.00 56.01 55.70 1log n LEU 38 Cb 0.53 0.13 -0.02 0.00 -1.62 0.00 0.00 43.42 42.44 1log n LEU 38 CO 0.25 0.13 0.47 -0.94 -1.22 0.00 0.00 177.39 176.08 1log s SER 39 N -4.58 -0.53 -0.11 -1.43 1.04 -1.26 -5.17 113.70 101.66 1log s SER 39 Ca -0.08 0.03 -0.06 0.00 0.48 0.00 0.00 55.95 56.32 1log s SER 39 Cb 0.11 0.55 0.04 0.00 0.10 0.00 0.00 66.02 66.82 1log s SER 39 CO 0.81 -0.87 0.25 0.86 0.98 0.00 0.00 173.24 175.27 1log s TRP 40 N -3.48 -0.33 -0.05 5.02 -0.00 -1.26 -5.15 118.94 113.69 1log s TRP 40 Ca 0.01 0.78 0.04 0.00 -0.00 0.00 0.00 56.10 56.94 1log s TRP 40 Cb -0.01 0.07 -0.00 0.00 -0.00 0.00 0.00 33.47 33.53 1log s TRP 40 CO -0.11 -0.22 -0.18 -0.47 -0.00 0.00 0.00 176.95 175.98 1log s TYR 41 N 1.02 1.79 -0.03 5.86 5.04 -1.26 -5.15 117.35 124.62 1log s TYR 41 Ca -0.07 -0.54 -0.04 0.00 -2.44 0.00 0.00 57.07 53.98 1log s TYR 41 Cb -0.08 -1.21 0.01 0.00 0.35 0.00 0.00 41.96 41.03 1log s TYR 41 CO -0.07 -0.19 0.11 0.12 -1.34 0.00 0.00 175.55 174.19 1log s PHE 42 N 0.08 -0.08 -0.11 4.97 5.36 -1.26 -5.15 117.98 121.79 1log s PHE 42 Ca -0.05 0.19 -0.06 0.00 -0.96 0.00 0.00 56.93 56.05 1log s PHE 42 Cb -0.12 0.01 0.04 0.00 -0.34 0.00 0.00 43.02 42.61 1log s PHE 42 CO 0.03 -0.11 0.26 -1.58 -1.46 0.00 0.00 175.22 172.36 1log s HIS 43 N -0.27 -0.34 0.12 10.12 5.65 -1.26 -5.16 115.29 124.15 1log s HIS 43 Ca -0.03 0.80 0.05 0.00 0.25 0.00 0.00 55.06 56.12 1log s HIS 43 Cb -0.02 0.07 -0.04 0.00 -1.18 0.00 0.00 32.58 31.41 1log s HIS 43 CO 0.00 -0.22 -0.11 -1.54 -0.65 0.00 0.00 174.74 172.22 1log s SER 44 N 1.03 1.71 -0.14 9.88 1.04 -1.26 -5.14 113.70 120.82 1log s SER 44 Ca -0.07 -0.87 -0.04 0.00 0.48 0.00 0.00 55.95 55.45 1log s SER 44 Cb -0.08 -0.02 0.06 0.00 0.10 0.00 0.00 66.02 66.08 1log s SER 44 CO -0.07 -0.25 0.13 -0.70 0.98 0.00 0.00 173.24 173.33 1log s GLU 45 N -3.02 0.06 -0.25 4.02 -6.30 -1.26 -5.13 118.70 106.84 1log s GLU 45 Ca 0.10 0.18 -0.08 0.00 -2.50 0.00 0.00 54.97 52.67 1log s GLU 45 Cb -0.02 -1.17 -0.03 0.00 0.00 0.00 0.00 34.13 32.90 1log s GLU 45 CO 0.01 -0.54 0.08 -1.17 0.02 0.00 0.00 175.26 173.66 1log s LEU 46 N 2.22 3.54 0.00 2.70 2.96 -1.26 -5.37 118.68 123.48 1log s LEU 46 Ca 0.04 -0.15 0.17 0.00 -0.22 0.00 0.00 54.13 53.96 1log s LEU 46 Cb -0.15 -1.95 1.00 0.00 0.50 0.00 0.00 46.19 45.60 1log s LEU 46 CO -0.08 -0.01 1.41 0.00 -1.32 0.00 0.00 176.35 176.34