#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lof s THR 2 N 0.00 3.41 0.15 6.31 2.01 -1.26 -5.04 115.64 121.22 1lof s THR 2 Ca 0.00 0.66 0.08 0.00 0.31 0.00 0.00 61.69 62.74 1lof s THR 2 Cb 0.00 -3.42 -0.04 0.00 0.01 0.00 0.00 72.50 69.05 1lof s THR 2 CO 0.00 -0.03 -0.18 -0.94 -0.69 0.00 0.00 174.62 172.77 1lof s SER 3 N 2.93 2.59 0.00 3.53 1.04 -1.26 -5.15 113.70 117.38 1lof s SER 3 Ca 0.73 -0.82 0.01 0.00 0.48 0.00 0.00 55.95 56.35 1lof s SER 3 Cb -0.35 -0.15 -0.00 0.00 0.10 0.00 0.00 66.02 65.62 1lof s SER 3 CO 0.30 -0.02 -0.04 -0.31 0.98 0.00 0.00 173.24 174.15 1lof s TYR 4 N -1.87 0.32 0.04 5.02 2.02 -1.26 -5.16 117.35 116.47 1lof s TYR 4 Ca 0.13 -0.10 0.02 0.00 -0.37 0.00 0.00 57.07 56.75 1lof s TYR 4 Cb -0.07 -0.21 -0.02 0.00 -0.40 0.00 0.00 41.96 41.26 1lof s TYR 4 CO 0.06 -0.02 -0.07 0.99 -1.57 0.00 0.00 175.55 174.94 1lof s THR 5 N -0.22 0.50 -0.07 -0.71 2.01 -1.26 -5.15 115.64 110.75 1lof s THR 5 Ca -0.00 -1.12 -0.08 0.00 0.31 0.00 0.00 61.69 60.80 1lof s THR 5 Cb -0.02 -0.65 0.02 0.00 0.01 0.00 0.00 72.50 71.86 1lof s THR 5 CO -0.00 -0.43 0.22 -0.22 -0.69 0.00 0.00 174.62 173.50 1lof s LEU 6 N -1.67 1.19 -0.01 4.42 2.96 -1.26 -5.16 118.68 119.16 1lof s LEU 6 Ca -0.09 0.34 0.00 0.00 -0.22 0.00 0.00 54.13 54.16 1lof s LEU 6 Cb -0.09 0.78 0.01 0.00 0.50 0.00 0.00 46.19 47.39 1lof s LEU 6 CO -0.00 -0.14 -0.00 0.20 -1.32 0.00 0.00 176.35 175.09 1lof s ASN 7 N -0.16 0.15 0.05 3.68 -0.87 -1.26 -5.15 114.94 111.38 1lof s ASN 7 Ca -0.03 -0.01 -0.16 0.00 -1.57 0.00 0.00 52.86 51.09 1lof s ASN 7 Cb -0.03 -0.05 0.03 0.00 -0.02 0.00 0.00 41.25 41.19 1lof s ASN 7 CO 0.01 -0.02 0.37 -0.70 -2.57 0.00 0.00 177.10 174.19 1lof s GLU 8 N 0.27 0.88 -0.34 -0.60 2.56 -1.26 -5.11 118.70 115.10 1lof s GLU 8 Ca -0.02 -0.42 -0.18 0.00 0.00 0.00 0.00 54.97 54.34 1lof s GLU 8 Cb -0.04 0.39 -0.01 0.00 2.00 0.00 0.00 34.13 36.47 1lof s GLU 8 CO -0.01 -0.30 0.52 0.08 -0.56 0.00 0.00 175.26 175.00 1lof s VAL 9 N -2.53 5.02 -0.42 3.70 1.01 -1.26 -5.00 120.40 120.91 1lof s VAL 9 Ca -0.05 0.43 0.02 0.00 0.00 0.00 0.00 61.98 62.38 1lof s VAL 9 Cb -0.01 -3.95 0.13 0.00 0.00 0.00 0.00 36.38 32.55 1lof s VAL 9 CO -0.03 -0.18 0.20 -0.69 0.00 0.00 0.00 175.10 174.40 1lof s VAL 10 N 2.40 1.62 -0.45 2.92 1.01 -1.26 -5.02 120.40 121.62 1lof s VAL 10 Ca 0.19 -2.49 -0.22 0.00 0.00 0.00 0.00 61.98 59.46 1lof s VAL 10 Cb -0.15 -2.15 -0.23 0.00 0.00 0.00 0.00 36.38 33.85 1lof s VAL 10 CO 0.13 -0.82 1.60 -0.81 0.00 0.00 0.00 175.10 175.20 1lof n PRO 11 N 3.73 0.04 -0.29 2.72 -0.04 -1.26 -4.80 135.00 135.10 1lof n PRO 11 Ca 0.06 -1.04 0.14 0.00 -0.04 0.00 0.00 63.50 62.62 1lof n PRO 11 Cb 0.36 -2.72 0.28 0.00 -0.04 0.00 0.00 33.50 31.38 1lof n PRO 11 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1lof n LEU 12 N 12.32 -0.05 -0.03 1.53 4.32 -1.26 -0.34 117.00 133.49 1lof n LEU 12 Ca 0.33 1.44 0.15 0.00 -0.02 0.00 0.00 56.01 57.91 1lof n LEU 12 Cb 0.43 -0.54 0.59 0.00 -1.62 0.00 0.00 43.42 42.28 1lof n LEU 12 CO 0.75 -1.47 1.18 0.50 -1.22 0.00 0.00 177.39 177.12 1lof h LYS 13 N 0.00 0.21 0.00 3.23 3.64 -1.87 -0.63 116.57 121.15 1lof h LYS 13 Ca 0.54 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.91 1lof h LYS 13 Cb 1.16 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1lof h LYS 13 CO -0.78 0.14 0.00 0.93 -2.27 0.00 0.00 179.45 177.47 1lof h GLU 14 N 0.21 0.00 0.00 1.90 4.39 -1.09 -3.38 114.58 116.62 1lof h GLU 14 Ca 0.26 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.82 1lof h GLU 14 Cb 0.73 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.35 1lof h GLU 14 CO -0.05 0.00 -1.53 1.19 -1.16 0.00 0.00 179.01 177.47 1lof n PHE 15 N -2.98 0.00 -4.15 4.33 3.72 -0.38 -5.07 117.46 112.93 1lof n PHE 15 Ca 0.03 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.14 1lof n PHE 15 Cb 0.42 -0.36 -0.08 0.00 -0.94 0.00 0.00 39.48 38.52 1lof n PHE 15 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1lof s VAL 16 N -2.19 3.95 0.89 -4.37 0.11 -0.39 -5.12 120.40 113.28 1lof s VAL 16 Ca -0.11 -1.12 -0.11 0.00 -2.93 0.00 0.00 61.98 57.72 1lof s VAL 16 Cb 0.03 -2.92 0.13 0.00 -1.53 0.00 0.00 36.38 32.10 1lof s VAL 16 CO 0.24 0.04 1.16 -2.16 -3.33 0.00 0.00 175.10 171.05 1lof s PRO 17 N -2.53 1.16 0.33 1.54 0.04 -1.26 -4.74 135.00 129.55 1lof s PRO 17 Ca 0.26 1.58 0.08 0.00 0.04 0.00 0.00 61.00 62.97 1lof s PRO 17 Cb -0.11 -1.74 0.79 0.00 0.04 0.00 0.00 34.50 33.48 1lof s PRO 17 CO 0.19 -2.53 1.82 0.93 0.04 0.00 0.00 177.00 177.44 1lof h GLU 18 N -1.67 0.70 -6.26 4.56 5.08 -1.98 -3.39 114.58 111.62 1lof h GLU 18 Ca -0.44 -0.04 -0.68 0.00 -1.00 0.00 0.00 59.36 57.20 1lof h GLU 18 Cb 1.27 -0.16 -0.19 0.00 0.50 0.00 0.00 28.75 30.17 1lof h GLU 18 CO 0.43 0.46 -0.72 -1.58 -1.00 0.00 0.00 179.01 176.60 1lof s TRP 19 N -5.75 2.86 0.17 4.33 0.52 -1.26 -5.13 118.94 114.68 1lof s TRP 19 Ca -0.10 -0.05 -0.05 0.00 0.02 0.00 0.00 56.10 55.92 1lof s TRP 19 Cb 0.23 -1.64 -0.03 0.00 -1.15 0.00 0.00 33.47 30.89 1lof s TRP 19 CO 0.80 0.32 0.18 0.14 0.02 0.00 0.00 176.95 178.41 1lof s VAL 20 N -0.89 0.06 0.02 4.03 -7.23 -1.26 -5.13 120.40 109.99 1lof s VAL 20 Ca 0.14 -1.72 0.08 0.00 -1.81 0.00 0.00 61.98 58.67 1lof s VAL 20 Cb -0.11 -2.09 -0.03 0.00 0.56 0.00 0.00 36.38 34.71 1lof s VAL 20 CO 0.04 -0.27 -0.23 -0.13 -0.31 0.00 0.00 175.10 174.20 1lof s ARG 21 N -4.04 2.03 0.26 4.82 0.52 -1.26 -5.15 118.95 116.13 1lof s ARG 21 Ca 0.25 -0.98 0.10 0.00 -0.52 0.00 0.00 55.73 54.58 1lof s ARG 21 Cb 0.05 -2.09 -0.04 0.00 0.52 0.00 0.00 34.95 33.38 1lof s ARG 21 CO 0.04 0.55 -0.07 0.96 0.02 0.00 0.00 175.30 176.79 1lof s ILE 22 N -0.77 3.14 -2.44 1.52 -4.36 -1.26 -5.12 121.20 111.90 1lof s ILE 22 Ca 0.12 -2.02 0.00 0.00 -0.26 0.00 0.00 60.65 58.49 1lof s ILE 22 Cb -0.10 -2.65 0.00 0.00 1.25 0.00 0.00 42.46 40.96 1lof s ILE 22 CO 0.02 -0.35 0.00 0.61 0.24 0.00 0.00 174.94 175.46 1lof n GLY 23 N -0.69 -0.58 3.29 6.27 0.00 -1.26 -5.16 105.19 107.06 1lof n GLY 23 Ca -0.07 -0.86 -0.28 0.00 0.00 0.00 0.00 46.02 44.81 1lof n GLY 23 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lof s PHE 24 N -3.00 2.08 0.11 1.61 0.08 -1.26 -5.15 117.98 112.45 1lof s PHE 24 Ca 0.00 -0.39 0.07 0.00 0.12 0.00 0.00 56.93 56.73 1lof s PHE 24 Cb 0.00 -1.26 -0.04 0.00 -0.57 0.00 0.00 43.02 41.16 1lof s PHE 24 CO 0.00 0.08 -0.18 -1.54 -0.10 0.00 0.00 175.22 173.49 1lof s SER 25 N -1.08 2.28 -0.07 1.36 1.04 -1.26 -5.15 113.70 110.81 1lof s SER 25 Ca 0.10 -0.73 -0.13 0.00 0.48 0.00 0.00 55.95 55.66 1lof s SER 25 Cb -0.09 -0.11 0.03 0.00 0.10 0.00 0.00 66.02 65.95 1lof s SER 25 CO 0.01 -0.03 0.33 0.00 0.98 0.00 0.00 173.24 174.54 1lof s ALA 26 N -1.54 -0.82 0.18 5.32 0.00 -1.26 -5.18 121.76 118.46 1lof s ALA 26 Ca 0.07 0.66 0.02 0.00 0.00 0.00 0.00 51.96 52.72 1lof s ALA 26 Cb -0.08 -0.26 -0.05 0.00 0.00 0.00 0.00 23.12 22.73 1lof s ALA 26 CO 0.04 -0.21 -0.01 0.95 0.00 0.00 0.00 175.76 176.53 1lof s THR 27 N -0.54 0.79 0.12 0.00 -4.23 -1.26 -5.12 115.64 105.40 1lof s THR 27 Ca -0.06 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.49 1lof s THR 27 Cb -0.04 -2.13 -0.04 0.00 1.34 0.00 0.00 72.50 71.63 1lof s THR 27 CO 0.02 -0.48 -0.10 0.42 -0.54 0.00 0.00 174.62 173.94 1lof s THR 28 N -3.58 1.06 0.00 3.99 -4.23 -1.26 -4.89 115.64 106.72 1lof s THR 28 Ca 0.24 -1.86 0.00 0.00 -1.18 0.00 0.00 61.69 58.89 1lof s THR 28 Cb 0.06 -1.62 0.00 0.00 1.34 0.00 0.00 72.50 72.28 1lof s THR 28 CO 0.04 -0.66 0.00 0.61 -0.54 0.00 0.00 174.62 174.08 1lof n GLY 29 N 0.17 1.56 0.09 3.99 0.00 -1.26 -4.95 105.19 104.79 1lof n GLY 29 Ca -0.13 -0.08 -0.04 0.00 0.00 0.00 0.00 46.02 45.77 1lof n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lof h ALA 30 N 1.00 0.54 -1.68 4.61 0.00 -2.07 -3.45 119.26 118.21 1lof h ALA 30 Ca 0.00 -0.91 -0.54 0.00 0.00 0.00 0.00 54.91 53.46 1lof h ALA 30 Cb 0.00 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.76 1lof h ALA 30 CO 0.00 1.14 -0.48 -1.21 0.00 0.00 0.00 179.25 178.70 1lof s GLU 31 N -2.77 2.37 0.31 0.00 2.02 -1.26 -5.15 118.70 114.22 1lof s GLU 31 Ca 0.00 -1.65 -0.11 0.00 0.02 0.00 0.00 54.97 53.23 1lof s GLU 31 Cb 0.09 -2.16 0.01 0.00 0.10 0.00 0.00 34.13 32.17 1lof s GLU 31 CO 0.80 -0.05 0.56 -0.59 0.02 0.00 0.00 175.26 176.00 1lof s PHE 32 N -2.50 0.47 0.00 1.61 -0.12 -1.26 -4.64 117.98 111.54 1lof s PHE 32 Ca 0.42 -0.86 0.00 0.00 -0.05 0.00 0.00 56.93 56.43 1lof s PHE 32 Cb -0.00 0.29 0.00 0.00 -0.63 0.00 0.00 43.02 42.67 1lof s PHE 32 CO 0.24 -1.17 0.00 0.00 -0.05 0.00 0.00 175.22 174.24 1lof n ALA 33 N -0.47 0.00 -2.28 1.99 0.00 -1.26 -5.07 120.51 113.42 1lof n ALA 33 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.03 1lof n ALA 33 Cb 0.61 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.00 1lof n ALA 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lof s ALA 34 N -2.00 3.58 -0.18 0.00 0.00 -1.26 -4.92 121.76 116.98 1lof s ALA 34 Ca 0.00 0.04 0.01 0.00 0.00 0.00 0.00 51.96 52.01 1lof s ALA 34 Cb 0.00 -2.64 0.03 0.00 0.00 0.00 0.00 23.12 20.50 1lof s ALA 34 CO 0.00 0.39 -0.15 -1.01 0.00 0.00 0.00 175.76 174.99 1lof s HIS 35 N -1.08 2.51 0.02 0.00 3.76 -1.26 -5.12 115.29 114.13 1lof s HIS 35 Ca 0.29 -1.53 0.02 0.00 -0.15 0.00 0.00 55.06 53.69 1lof s HIS 35 Cb -0.20 -1.74 -0.01 0.00 1.11 0.00 0.00 32.58 31.74 1lof s HIS 35 CO 0.19 -0.75 -0.07 -1.21 -0.85 0.00 0.00 174.74 172.05 1lof s GLU 36 N 1.37 0.52 -0.13 1.40 2.02 -1.26 -5.07 118.70 117.55 1lof s GLU 36 Ca 0.03 -0.46 -0.01 0.00 0.02 0.00 0.00 54.97 54.55 1lof s GLU 36 Cb -0.14 -0.42 -0.02 0.00 0.10 0.00 0.00 34.13 33.65 1lof s GLU 36 CO -0.11 0.10 -0.10 0.08 0.02 0.00 0.00 175.26 175.25 1lof s VAL 37 N -0.67 3.30 -0.10 2.63 1.01 -1.26 -5.04 120.40 120.26 1lof s VAL 37 Ca -0.03 -0.58 -0.02 0.00 0.00 0.00 0.00 61.98 61.36 1lof s VAL 37 Cb -0.06 -2.40 -0.25 0.00 0.00 0.00 0.00 36.38 33.67 1lof s VAL 37 CO 0.00 0.52 0.43 0.18 0.00 0.00 0.00 175.10 176.23 1lof n LEU 38 N 3.46 2.22 -3.89 3.92 4.32 -1.26 -5.03 117.00 120.73 1lof n LEU 38 Ca -0.18 0.25 -0.09 0.00 -0.02 0.00 0.00 56.01 55.97 1lof n LEU 38 Cb 0.53 -0.81 -0.05 0.00 -1.62 0.00 0.00 43.42 41.47 1lof n LEU 38 CO 0.31 0.75 0.20 -0.94 -1.22 0.00 0.00 177.39 176.49 1lof s SER 39 N -6.81 -0.14 -0.21 -1.43 1.04 -1.26 -5.17 113.70 99.72 1lof s SER 39 Ca -0.18 -0.73 -0.17 0.00 0.48 0.00 0.00 55.95 55.34 1lof s SER 39 Cb 0.07 0.57 0.06 0.00 0.10 0.00 0.00 66.02 66.82 1lof s SER 39 CO 0.78 -1.09 0.55 0.86 0.98 0.00 0.00 173.24 175.32 1lof s TRP 40 N -3.95 -0.66 0.02 5.02 -0.00 -1.26 -5.15 118.94 112.96 1lof s TRP 40 Ca 0.16 1.53 0.04 0.00 -0.00 0.00 0.00 56.10 57.83 1lof s TRP 40 Cb -0.01 0.27 -0.02 0.00 -0.00 0.00 0.00 33.47 33.72 1lof s TRP 40 CO 0.03 -0.33 -0.13 -0.47 -0.00 0.00 0.00 176.95 176.05 1lof s TYR 41 N 0.63 1.19 -0.11 5.86 5.04 -1.26 -5.14 117.35 123.55 1lof s TYR 41 Ca -0.03 -0.31 -0.13 0.00 -2.44 0.00 0.00 57.07 54.17 1lof s TYR 41 Cb -0.05 -0.73 0.03 0.00 0.35 0.00 0.00 41.96 41.57 1lof s TYR 41 CO -0.04 0.01 0.35 0.12 -1.34 0.00 0.00 175.55 174.65 1lof s PHE 42 N -0.66 -0.36 -0.10 4.97 5.36 -1.26 -5.16 117.98 120.77 1lof s PHE 42 Ca 0.03 0.85 -0.09 0.00 -0.96 0.00 0.00 56.93 56.75 1lof s PHE 42 Cb -0.07 0.13 0.03 0.00 -0.34 0.00 0.00 43.02 42.77 1lof s PHE 42 CO 0.01 -0.22 0.27 -1.58 -1.46 0.00 0.00 175.22 172.24 1lof s HIS 43 N -0.03 -0.31 0.07 10.12 5.65 -1.26 -5.18 115.29 124.34 1lof s HIS 43 Ca -0.02 0.75 0.01 0.00 0.25 0.00 0.00 55.06 56.05 1lof s HIS 43 Cb -0.03 0.10 -0.04 0.00 -1.18 0.00 0.00 32.58 31.43 1lof s HIS 43 CO 0.01 -0.16 -0.05 -1.54 -0.65 0.00 0.00 174.74 172.35 1lof s SER 44 N 0.34 0.79 -0.17 9.88 1.04 -1.26 -5.16 113.70 119.16 1lof s SER 44 Ca -0.02 -0.90 -0.10 0.00 0.48 0.00 0.00 55.95 55.41 1lof s SER 44 Cb -0.03 0.12 0.06 0.00 0.10 0.00 0.00 66.02 66.27 1lof s SER 44 CO -0.01 -0.46 0.42 -1.83 0.98 0.00 0.00 173.24 172.33 1lof s GLU 45 N -3.36 0.41 -0.21 4.02 -1.05 -1.26 -5.12 118.70 112.14 1lof s GLU 45 Ca 0.05 0.77 0.00 0.00 -0.15 0.00 0.00 54.97 55.64 1lof s GLU 45 Cb 0.03 0.01 0.02 0.00 -0.44 0.00 0.00 34.13 33.76 1lof s GLU 45 CO -0.06 -0.14 -0.15 -1.17 0.95 0.00 0.00 175.26 174.69 1lof s LEU 46 N 1.25 2.56 0.00 1.83 2.96 -1.26 -5.36 118.68 120.66 1lof s LEU 46 Ca -0.08 -0.77 0.04 0.00 -0.22 0.00 0.00 54.13 53.10 1lof s LEU 46 Cb -0.08 -1.55 0.21 0.00 0.50 0.00 0.00 46.19 45.28 1lof s LEU 46 CO -0.11 -0.05 0.69 0.00 -1.32 0.00 0.00 176.35 175.56