#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lob s THR 2 N 0.00 4.21 0.09 2.62 2.01 -1.26 -5.10 115.64 118.21 1lob s THR 2 Ca 0.00 -0.22 0.07 0.00 0.31 0.00 0.00 61.69 61.85 1lob s THR 2 Cb 0.00 -2.93 -0.03 0.00 0.01 0.00 0.00 72.50 69.55 1lob s THR 2 CO 0.00 0.40 -0.19 -0.94 -0.69 0.00 0.00 174.62 173.21 1lob s SER 3 N 1.11 2.24 -0.04 3.53 1.04 -1.26 -5.13 113.70 115.19 1lob s SER 3 Ca 0.03 -0.65 0.01 0.00 0.48 0.00 0.00 55.95 55.83 1lob s SER 3 Cb -0.14 -0.11 0.02 0.00 0.10 0.00 0.00 66.02 65.88 1lob s SER 3 CO 0.02 0.02 -0.05 -0.31 0.98 0.00 0.00 173.24 173.91 1lob s TYR 4 N -1.16 0.70 0.08 5.02 2.02 -1.26 -5.16 117.35 117.60 1lob s TYR 4 Ca 0.04 -0.18 0.06 0.00 -0.37 0.00 0.00 57.07 56.62 1lob s TYR 4 Cb -0.10 -0.60 -0.03 0.00 -0.40 0.00 0.00 41.96 40.83 1lob s TYR 4 CO 0.03 -0.15 -0.16 0.99 -1.57 0.00 0.00 175.55 174.69 1lob s THR 5 N 0.70 1.28 -0.07 -0.71 2.01 -1.26 -5.15 115.64 112.44 1lob s THR 5 Ca -0.09 -1.40 -0.06 0.00 0.31 0.00 0.00 61.69 60.45 1lob s THR 5 Cb -0.12 -1.23 0.02 0.00 0.01 0.00 0.00 72.50 71.18 1lob s THR 5 CO 0.00 -0.20 0.18 -0.22 -0.69 0.00 0.00 174.62 173.69 1lob s LEU 6 N -1.83 1.29 0.02 4.42 2.96 -1.26 -5.16 118.68 119.12 1lob s LEU 6 Ca 0.01 0.36 0.04 0.00 -0.22 0.00 0.00 54.13 54.32 1lob s LEU 6 Cb -0.10 0.60 -0.02 0.00 0.50 0.00 0.00 46.19 47.18 1lob s LEU 6 CO 0.03 -0.07 -0.12 0.20 -1.32 0.00 0.00 176.35 175.07 1lob s ASN 7 N 0.14 1.43 -0.18 3.68 -0.87 -1.26 -5.16 114.94 112.72 1lob s ASN 7 Ca -0.00 -0.38 -0.19 0.00 -1.57 0.00 0.00 52.86 50.72 1lob s ASN 7 Cb -0.02 -0.10 0.05 0.00 -0.02 0.00 0.00 41.25 41.17 1lob s ASN 7 CO -0.00 0.04 0.52 -0.70 -2.57 0.00 0.00 177.10 174.39 1lob s GLU 8 N -0.90 0.64 -0.30 -0.60 2.56 -1.26 -5.12 118.70 113.71 1lob s GLU 8 Ca 0.01 0.67 -0.27 0.00 0.00 0.00 0.00 54.97 55.37 1lob s GLU 8 Cb -0.07 0.31 0.01 0.00 2.00 0.00 0.00 34.13 36.38 1lob s GLU 8 CO 0.01 -0.09 0.99 0.08 -0.56 0.00 0.00 175.26 175.69 1lob s VAL 9 N 0.13 4.61 -0.29 3.70 1.01 -1.26 -5.00 120.40 123.30 1lob s VAL 9 Ca -0.01 1.63 0.01 0.00 0.00 0.00 0.00 61.98 63.60 1lob s VAL 9 Cb -0.04 -4.33 0.09 0.00 0.00 0.00 0.00 36.38 32.10 1lob s VAL 9 CO 0.01 -0.38 0.04 -0.69 0.00 0.00 0.00 175.10 174.09 1lob s VAL 10 N 3.41 1.39 -1.08 2.92 1.01 -1.26 -5.06 120.40 121.73 1lob s VAL 10 Ca 0.42 -1.56 -0.23 0.00 0.00 0.00 0.00 61.98 60.61 1lob s VAL 10 Cb -0.13 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 1lob s VAL 10 CO 0.13 -0.48 1.83 -2.16 0.00 0.00 0.00 175.10 174.42 1lob s PRO 11 N 1.38 2.94 0.38 2.72 0.04 -1.26 -4.86 135.00 136.34 1lob s PRO 11 Ca 0.05 -0.99 0.18 0.00 0.04 0.00 0.00 61.00 60.28 1lob s PRO 11 Cb -0.18 -5.25 1.12 0.00 0.04 0.00 0.00 34.50 30.23 1lob s PRO 11 CO -0.15 -3.21 1.71 -0.07 0.04 0.00 0.00 177.00 175.33 1lob h LEU 12 N 16.14 0.47 -2.72 -3.56 4.07 -1.98 -0.13 115.31 127.59 1lob h LEU 12 Ca 0.21 0.13 -0.00 0.00 0.08 0.00 0.00 57.88 58.29 1lob h LEU 12 Cb 0.96 0.06 -0.00 0.00 1.08 0.00 0.00 40.66 42.77 1lob h LEU 12 CO 1.29 -0.01 -0.01 0.11 -1.08 0.00 0.00 178.44 178.75 1lob h LYS 13 N 0.36 0.00 0.00 1.13 1.57 -1.89 0.57 116.57 118.31 1lob h LYS 13 Ca 0.67 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.45 1lob h LYS 13 Cb 1.68 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.99 1lob h LYS 13 CO -0.42 0.01 -0.29 0.93 -0.57 0.00 0.00 179.45 179.11 1lob h GLU 14 N 0.00 0.00 0.00 3.15 4.39 -1.42 -3.39 114.58 117.30 1lob h GLU 14 Ca -0.00 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.54 1lob h GLU 14 Cb 0.04 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.66 1lob h GLU 14 CO 0.00 0.00 -1.59 1.19 -1.16 0.00 0.00 179.01 177.45 1lob n PHE 15 N -2.73 0.00 -4.38 4.33 3.72 0.11 -5.05 117.46 113.46 1lob n PHE 15 Ca 0.03 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.18 1lob n PHE 15 Cb 0.50 -0.42 -0.12 0.00 -0.94 0.00 0.00 39.48 38.50 1lob n PHE 15 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1lob s VAL 16 N -2.21 2.12 1.10 -4.37 0.11 -0.70 -5.14 120.40 111.31 1lob s VAL 16 Ca -0.06 -1.87 -0.15 0.00 -2.93 0.00 0.00 61.98 56.96 1lob s VAL 16 Cb 0.03 -1.95 0.24 0.00 -1.53 0.00 0.00 36.38 33.16 1lob s VAL 16 CO 0.33 -0.10 1.10 -2.16 -3.33 0.00 0.00 175.10 170.93 1lob s PRO 17 N -2.45 -0.36 0.28 1.54 0.04 -1.26 -4.72 135.00 128.08 1lob s PRO 17 Ca 0.16 0.27 -0.02 0.00 0.04 0.00 0.00 61.00 61.45 1lob s PRO 17 Cb -0.08 -1.67 0.40 0.00 0.04 0.00 0.00 34.50 33.19 1lob s PRO 17 CO 0.07 -3.21 1.90 0.93 0.04 0.00 0.00 177.00 176.74 1lob h GLU 18 N -2.23 1.02 -5.85 4.56 5.08 -1.98 -3.41 114.58 111.76 1lob h GLU 18 Ca -0.51 -0.12 -0.68 0.00 -1.00 0.00 0.00 59.36 57.06 1lob h GLU 18 Cb 1.32 -0.20 -0.25 0.00 0.50 0.00 0.00 28.75 30.11 1lob h GLU 18 CO 0.48 0.75 -0.78 -1.58 -1.00 0.00 0.00 179.01 176.89 1lob s TRP 19 N -5.66 2.73 0.13 4.33 0.52 -1.26 -5.12 118.94 114.61 1lob s TRP 19 Ca -0.11 -0.42 -0.01 0.00 0.02 0.00 0.00 56.10 55.58 1lob s TRP 19 Cb 0.17 -1.72 -0.04 0.00 -1.15 0.00 0.00 33.47 30.73 1lob s TRP 19 CO 0.80 -0.02 0.05 0.14 0.02 0.00 0.00 176.95 177.94 1lob s VAL 20 N -0.21 0.11 0.12 4.03 -7.23 -1.26 -5.15 120.40 110.81 1lob s VAL 20 Ca 0.00 -1.91 0.08 0.00 -1.81 0.00 0.00 61.98 58.34 1lob s VAL 20 Cb -0.13 -2.04 -0.04 0.00 0.56 0.00 0.00 36.38 34.72 1lob s VAL 20 CO 0.03 -0.47 -0.14 -0.13 -0.31 0.00 0.00 175.10 174.09 1lob s ARG 21 N -4.05 1.95 0.12 4.82 0.52 -1.26 -5.15 118.95 115.91 1lob s ARG 21 Ca 0.24 -1.14 0.09 0.00 -0.52 0.00 0.00 55.73 54.40 1lob s ARG 21 Cb 0.07 -2.19 -0.04 0.00 0.52 0.00 0.00 34.95 33.32 1lob s ARG 21 CO 0.02 0.48 -0.18 0.96 0.02 0.00 0.00 175.30 176.60 1lob s ILE 22 N -1.27 2.82 0.00 1.52 -4.36 -1.26 -5.13 121.20 113.52 1lob s ILE 22 Ca 0.20 -1.51 0.00 0.00 -0.26 0.00 0.00 60.65 59.08 1lob s ILE 22 Cb -0.10 -2.29 0.00 0.00 1.25 0.00 0.00 42.46 41.31 1lob s ILE 22 CO 0.12 0.10 0.00 0.61 0.24 0.00 0.00 174.94 176.01 1lob n GLY 23 N 0.80 0.87 3.46 6.27 0.00 -1.26 -5.17 105.19 110.17 1lob n GLY 23 Ca -0.16 -0.74 -0.24 0.00 0.00 0.00 0.00 46.02 44.88 1lob n GLY 23 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lob s PHE 24 N -2.78 2.28 0.00 1.61 0.08 -1.26 -5.15 117.98 112.77 1lob s PHE 24 Ca 0.00 -0.34 -0.00 0.00 0.12 0.00 0.00 56.93 56.71 1lob s PHE 24 Cb 0.00 -1.02 -0.01 0.00 -0.57 0.00 0.00 43.02 41.43 1lob s PHE 24 CO 0.00 0.67 0.00 0.45 -0.10 0.00 0.00 175.22 176.24 1lob s SER 25 N -3.33 0.07 -0.02 1.36 0.15 -1.26 -5.16 113.70 105.51 1lob s SER 25 Ca 0.28 -0.15 -0.07 0.00 0.70 0.00 0.00 55.95 56.71 1lob s SER 25 Cb -0.06 0.05 0.01 0.00 -1.71 0.00 0.00 66.02 64.31 1lob s SER 25 CO 0.14 -0.11 0.15 0.00 1.20 0.00 0.00 173.24 174.62 1lob s ALA 26 N -0.50 -0.36 0.15 5.45 0.00 -1.26 -5.18 121.76 120.07 1lob s ALA 26 Ca -0.05 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.01 1lob s ALA 26 Cb -0.03 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 1lob s ALA 26 CO -0.00 -0.16 0.03 0.95 0.00 0.00 0.00 175.76 176.58 1lob s THR 27 N -0.80 0.39 0.27 0.00 -4.23 -1.26 -5.12 115.64 104.89 1lob s THR 27 Ca -0.09 -1.94 0.03 0.00 -1.18 0.00 0.00 61.69 58.51 1lob s THR 27 Cb -0.05 -2.08 -0.06 0.00 1.34 0.00 0.00 72.50 71.65 1lob s THR 27 CO 0.01 -0.47 0.06 0.42 -0.54 0.00 0.00 174.62 174.09 1lob s THR 28 N -3.85 0.90 0.00 3.99 -4.23 -1.26 -4.87 115.64 106.32 1lob s THR 28 Ca 0.24 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.74 1lob s THR 28 Cb 0.07 -2.62 0.00 0.00 1.34 0.00 0.00 72.50 71.29 1lob s THR 28 CO 0.03 -0.09 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 1lob n GLY 29 N -0.53 3.93 0.22 3.99 0.00 -1.26 -4.97 105.19 106.56 1lob n GLY 29 Ca -0.02 -0.39 -0.06 0.00 0.00 0.00 0.00 46.02 45.54 1lob n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lob h ALA 30 N 1.22 0.89 -1.57 4.61 0.00 -2.08 -3.42 119.26 118.92 1lob h ALA 30 Ca 0.00 -0.44 -0.50 0.00 0.00 0.00 0.00 54.91 53.97 1lob h ALA 30 Cb 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1lob h ALA 30 CO 0.00 0.64 -0.39 -1.21 0.00 0.00 0.00 179.25 178.29 1lob s GLU 31 N -4.19 2.55 0.26 0.00 2.02 -1.26 -5.13 118.70 112.95 1lob s GLU 31 Ca -0.07 -1.51 -0.18 0.00 0.02 0.00 0.00 54.97 53.23 1lob s GLU 31 Cb 0.12 -2.38 0.01 0.00 0.10 0.00 0.00 34.13 31.99 1lob s GLU 31 CO 0.81 -0.15 0.63 -0.59 0.02 0.00 0.00 175.26 175.99 1lob s PHE 32 N -2.45 -0.02 -0.05 1.61 -0.12 -1.26 -4.69 117.98 110.99 1lob s PHE 32 Ca 0.47 -0.40 -0.30 0.00 -0.05 0.00 0.00 56.93 56.65 1lob s PHE 32 Cb -0.03 0.53 0.11 0.00 -0.63 0.00 0.00 43.02 43.00 1lob s PHE 32 CO 0.27 -1.14 0.95 0.00 -0.05 0.00 0.00 175.22 175.25 1lob s ALA 33 N -3.95 -1.87 0.21 1.99 0.00 -1.26 -5.08 121.76 111.80 1lob s ALA 33 Ca 0.14 1.15 -0.19 0.00 0.00 0.00 0.00 51.96 53.06 1lob s ALA 33 Cb -0.04 0.26 -0.08 0.00 0.00 0.00 0.00 23.12 23.26 1lob s ALA 33 CO 0.07 -0.65 0.70 0.00 0.00 0.00 0.00 175.76 175.88 1lob s ALA 34 N -2.89 3.44 -0.19 0.00 0.00 -1.26 -4.94 121.76 115.93 1lob s ALA 34 Ca 0.05 0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.15 1lob s ALA 34 Cb -0.01 -2.78 0.04 0.00 0.00 0.00 0.00 23.12 20.37 1lob s ALA 34 CO -0.08 0.34 -0.11 -1.01 0.00 0.00 0.00 175.76 174.91 1lob s HIS 35 N -1.49 2.31 0.11 0.00 3.76 -1.26 -5.13 115.29 113.59 1lob s HIS 35 Ca 0.42 -1.48 0.05 0.00 -0.15 0.00 0.00 55.06 53.90 1lob s HIS 35 Cb -0.17 -1.61 -0.04 0.00 1.11 0.00 0.00 32.58 31.88 1lob s HIS 35 CO 0.21 -0.72 -0.12 -1.21 -0.85 0.00 0.00 174.74 172.05 1lob s GLU 36 N 1.43 0.94 -0.09 1.40 2.02 -1.26 -5.04 118.70 118.10 1lob s GLU 36 Ca 0.00 -1.20 0.03 0.00 0.02 0.00 0.00 54.97 53.82 1lob s GLU 36 Cb -0.15 -0.72 0.01 0.00 0.10 0.00 0.00 34.13 33.37 1lob s GLU 36 CO -0.09 0.13 -0.17 0.08 0.02 0.00 0.00 175.26 175.23 1lob s VAL 37 N -2.29 1.50 -0.17 2.63 1.01 -1.26 -5.04 120.40 116.78 1lob s VAL 37 Ca 0.07 -0.68 0.17 0.00 0.00 0.00 0.00 61.98 61.54 1lob s VAL 37 Cb -0.04 -1.34 -0.25 0.00 0.00 0.00 0.00 36.38 34.75 1lob s VAL 37 CO 0.02 0.44 0.19 0.18 0.00 0.00 0.00 175.10 175.92 1lob n LEU 38 N 3.81 0.15 -3.51 3.92 4.32 -1.26 -5.02 117.00 119.40 1lob n LEU 38 Ca -0.21 0.07 -0.13 0.00 -0.02 0.00 0.00 56.01 55.72 1lob n LEU 38 Cb 0.52 0.43 -0.04 0.00 -1.62 0.00 0.00 43.42 42.71 1lob n LEU 38 CO 0.26 0.46 0.33 -0.94 -1.22 0.00 0.00 177.39 176.28 1lob s SER 39 N -5.55 -0.49 -0.15 -1.43 1.04 -1.26 -5.17 113.70 100.69 1lob s SER 39 Ca -0.09 0.10 -0.13 0.00 0.48 0.00 0.00 55.95 56.31 1lob s SER 39 Cb 0.07 0.54 0.04 0.00 0.10 0.00 0.00 66.02 66.77 1lob s SER 39 CO 0.83 -0.83 0.38 0.86 0.98 0.00 0.00 173.24 175.47 1lob s TRP 40 N -3.03 -0.45 0.00 5.02 -0.00 -1.26 -5.16 118.94 114.06 1lob s TRP 40 Ca -0.02 1.06 0.01 0.00 -0.00 0.00 0.00 56.10 57.15 1lob s TRP 40 Cb -0.00 0.16 -0.01 0.00 -0.00 0.00 0.00 33.47 33.62 1lob s TRP 40 CO -0.06 -0.22 -0.05 -0.47 -0.00 0.00 0.00 176.95 176.14 1lob s TYR 41 N 0.41 0.41 -0.04 5.86 5.04 -1.26 -5.16 117.35 122.61 1lob s TYR 41 Ca -0.02 -0.13 -0.10 0.00 -2.44 0.00 0.00 57.07 54.39 1lob s TYR 41 Cb -0.04 -0.26 0.02 0.00 0.35 0.00 0.00 41.96 42.03 1lob s TYR 41 CO -0.02 -0.02 0.22 0.12 -1.34 0.00 0.00 175.55 174.52 1lob s PHE 42 N -0.27 -0.15 -0.14 4.97 5.36 -1.26 -5.15 117.98 121.35 1lob s PHE 42 Ca -0.00 0.30 -0.07 0.00 -0.96 0.00 0.00 56.93 56.20 1lob s PHE 42 Cb -0.03 0.05 0.05 0.00 -0.34 0.00 0.00 43.02 42.75 1lob s PHE 42 CO -0.00 -0.24 0.33 -1.58 -1.46 0.00 0.00 175.22 172.26 1lob s HIS 43 N -0.71 -0.47 0.06 10.12 5.65 -1.26 -5.16 115.29 123.51 1lob s HIS 43 Ca -0.08 1.05 0.04 0.00 0.25 0.00 0.00 55.06 56.32 1lob s HIS 43 Cb -0.04 0.15 -0.03 0.00 -1.18 0.00 0.00 32.58 31.48 1lob s HIS 43 CO 0.02 -0.30 -0.13 -1.54 -0.65 0.00 0.00 174.74 172.14 1lob s SER 44 N 1.43 1.48 -0.05 9.88 1.04 -1.26 -5.14 113.70 121.08 1lob s SER 44 Ca -0.09 -0.55 -0.02 0.00 0.48 0.00 0.00 55.95 55.77 1lob s SER 44 Cb -0.10 -0.05 0.03 0.00 0.10 0.00 0.00 66.02 66.01 1lob s SER 44 CO -0.11 -0.07 0.04 -0.70 0.98 0.00 0.00 173.24 173.38 1lob s GLU 45 N -1.53 0.15 -0.24 4.02 2.12 -1.26 -5.12 118.70 116.84 1lob s GLU 45 Ca -0.03 0.28 -0.03 0.00 0.36 0.00 0.00 54.97 55.56 1lob s GLU 45 Cb -0.09 -0.65 0.01 0.00 0.26 0.00 0.00 34.13 33.65 1lob s GLU 45 CO 0.02 -0.31 -0.05 -1.17 -0.54 0.00 0.00 175.26 173.21 1lob s LEU 46 N 2.06 3.06 0.00 2.70 2.96 -1.26 -5.37 118.68 122.84 1lob s LEU 46 Ca 0.04 -0.63 0.08 0.00 -0.22 0.00 0.00 54.13 53.41 1lob s LEU 46 Cb -0.12 -1.71 0.49 0.00 0.50 0.00 0.00 46.19 45.35 1lob s LEU 46 CO -0.04 -0.08 0.94 0.00 -1.32 0.00 0.00 176.35 175.86