#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gpt s ILE 2 N 0.00 5.07 -0.10 5.15 -1.09 -1.26 -0.64 121.20 128.33 1gpt s ILE 2 Ca 0.00 0.07 -0.03 0.00 -2.23 0.00 0.00 60.65 58.46 1gpt s ILE 2 Cb 0.00 -3.33 -0.03 0.00 -1.58 0.00 0.00 42.46 37.52 1gpt s ILE 2 CO 0.00 0.41 0.03 0.00 -1.23 0.00 0.00 174.94 174.15 1gpt s ARG 4 N -0.72 1.70 -0.03 0.00 0.52 -1.26 -0.44 118.95 118.71 1gpt s ARG 4 Ca 0.12 -0.33 0.04 0.00 -0.52 0.00 0.00 55.73 55.03 1gpt s ARG 4 Cb -0.12 -1.65 -0.00 0.00 0.52 0.00 0.00 34.95 33.70 1gpt s ARG 4 CO 0.02 -0.21 -0.15 0.50 0.02 0.00 0.00 175.30 175.49 1gpt s ARG 5 N 1.49 1.46 0.14 3.54 6.06 -0.81 -4.96 118.95 125.88 1gpt s ARG 5 Ca 0.02 -0.51 -0.31 0.00 -2.50 0.00 0.00 55.73 52.43 1gpt s ARG 5 Cb -0.13 -1.31 -0.08 0.00 0.06 0.00 0.00 34.95 33.48 1gpt s ARG 5 CO -0.07 0.22 1.38 -0.98 -2.50 0.00 0.00 175.30 173.36 1gpt s ARG 6 N 0.02 4.33 -0.29 5.12 1.04 -1.26 -0.42 118.95 127.49 1gpt s ARG 6 Ca -0.02 2.10 -0.04 0.00 -1.04 0.00 0.00 55.73 56.73 1gpt s ARG 6 Cb -0.10 -3.22 0.01 0.00 -2.04 0.00 0.00 34.95 29.59 1gpt s ARG 6 CO 0.01 -0.41 0.19 0.43 -0.04 0.00 0.00 175.30 175.49 1gpt n SER 7 N 3.58 -1.36 -4.56 -2.89 7.64 0.75 -4.84 113.62 111.94 1gpt n SER 7 Ca 0.10 -0.33 -0.39 0.00 1.01 0.00 0.00 58.87 59.26 1gpt n SER 7 Cb 0.42 -0.48 -0.03 0.00 -1.01 0.00 0.00 64.21 63.11 1gpt n SER 7 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1gpt s ALA 8 N -3.10 2.58 0.00 -0.43 0.00 -1.26 -3.62 121.76 115.93 1gpt s ALA 8 Ca 0.05 -2.11 0.00 0.00 0.00 0.00 0.00 51.96 49.90 1gpt s ALA 8 Cb -0.03 -4.52 0.00 0.00 0.00 0.00 0.00 23.12 18.57 1gpt s ALA 8 CO 0.28 -3.75 0.00 0.41 0.00 0.00 0.00 175.76 172.69 1gpt n GLY 9 N 6.80 3.11 3.77 0.00 0.00 -1.26 -4.32 105.19 113.28 1gpt n GLY 9 Ca 0.32 -0.91 -0.40 0.00 0.00 0.00 0.00 46.02 45.04 1gpt n GLY 9 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1gpt s PHE 10 N -0.88 2.95 -0.64 1.61 5.36 -1.24 -4.98 117.98 120.16 1gpt s PHE 10 Ca 0.00 1.43 -0.28 0.00 -0.96 0.00 0.00 56.93 57.13 1gpt s PHE 10 Cb 0.00 -3.64 0.03 0.00 -0.34 0.00 0.00 43.02 39.07 1gpt s PHE 10 CO 0.00 -1.89 1.28 -1.59 -1.46 0.00 0.00 175.22 171.56 1gpt s LYS 11 N -2.06 3.33 6.64 10.12 0.00 -1.26 -4.74 119.74 131.76 1gpt s LYS 11 Ca 0.54 0.09 0.00 0.00 0.00 0.00 0.00 55.97 56.59 1gpt s LYS 11 Cb -0.38 -4.11 0.00 0.00 0.00 0.00 0.00 37.83 33.34 1gpt s LYS 11 CO 0.49 -1.94 0.00 0.41 0.00 0.00 0.00 175.35 174.31 1gpt n GLY 12 N 5.24 2.79 3.84 0.59 0.00 -1.26 -4.70 105.19 111.69 1gpt n GLY 12 Ca 0.07 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 1gpt n GLY 12 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gpt s PRO 13 N 0.00 3.60 0.05 1.61 0.04 -1.26 -4.39 135.00 134.65 1gpt s PRO 13 Ca 0.00 0.96 -0.25 0.00 0.04 0.00 0.00 61.00 61.75 1gpt s PRO 13 Cb 0.00 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 32.40 1gpt s PRO 13 CO 0.00 -0.57 0.78 0.00 0.04 0.00 0.00 177.00 177.25 1gpt n VAL 15 N 2.84 0.00 -3.56 0.00 0.24 -1.26 -4.73 118.33 111.86 1gpt n VAL 15 Ca -0.02 -0.18 -0.17 0.00 -2.04 0.00 0.00 64.34 61.93 1gpt n VAL 15 Cb 0.50 0.67 -0.14 0.00 -1.47 0.00 0.00 33.84 33.41 1gpt n VAL 15 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1gpt s SER 16 N -1.46 1.10 0.21 -1.34 0.15 -1.26 -5.05 113.70 106.04 1gpt s SER 16 Ca 0.00 0.02 -0.10 0.00 0.70 0.00 0.00 55.95 56.57 1gpt s SER 16 Cb 0.00 0.40 0.24 0.00 -1.71 0.00 0.00 66.02 64.95 1gpt s SER 16 CO 0.00 -0.30 1.79 0.78 1.20 0.00 0.00 173.24 176.71 1gpt h ASN 17 N 8.32 0.46 -0.08 5.45 4.21 -1.97 -0.88 115.58 131.09 1gpt h ASN 17 Ca -0.16 0.04 0.03 0.00 1.21 0.00 0.00 56.30 57.43 1gpt h ASN 17 Cb 1.14 -0.04 -0.04 0.00 -1.12 0.00 0.00 38.32 38.26 1gpt h ASN 17 CO 0.23 0.29 -0.13 0.50 -1.29 0.00 0.00 177.43 177.03 1gpt h LYS 18 N 0.60 -0.17 -0.57 0.81 1.63 -1.96 -2.00 116.57 114.90 1gpt h LYS 18 Ca 0.29 0.01 -0.08 0.00 -0.85 0.00 0.00 60.65 60.03 1gpt h LYS 18 Cb 0.23 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.88 1gpt h LYS 18 CO -0.21 -0.12 0.05 -0.91 -3.45 0.00 0.00 179.45 174.81 1gpt h ASN 19 N -0.18 0.91 -0.44 4.20 4.21 -1.91 -0.09 115.58 122.28 1gpt h ASN 19 Ca 0.07 -0.22 0.03 0.00 1.21 0.00 0.00 56.30 57.39 1gpt h ASN 19 Cb 0.28 -0.24 -0.03 0.00 -1.12 0.00 0.00 38.32 37.21 1gpt h ASN 19 CO -0.18 0.94 0.24 0.00 -1.29 0.00 0.00 177.43 177.14 1gpt h ALA 21 N 1.21 -0.09 0.71 0.00 0.00 -1.01 -2.76 119.26 117.32 1gpt h ALA 21 Ca 0.18 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1gpt h ALA 21 Cb 0.05 0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1gpt h ALA 21 CO -0.10 -0.55 -0.34 0.37 0.00 0.00 0.00 179.25 178.62 1gpt h GLN 22 N -0.10 -0.91 -0.65 0.00 4.15 -0.70 -0.99 115.11 115.90 1gpt h GLN 22 Ca 0.00 0.06 0.12 0.00 0.77 0.00 0.00 58.65 59.60 1gpt h GLN 22 Cb 0.09 0.21 -0.09 0.00 0.21 0.00 0.00 27.48 27.91 1gpt h GLN 22 CO -0.01 -0.60 0.20 0.28 -1.93 0.00 0.00 178.83 176.78 1gpt h VAL 23 N -0.97 0.68 -0.23 2.39 2.07 -1.08 0.45 116.25 119.56 1gpt h VAL 23 Ca -0.10 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 1gpt h VAL 23 Cb 0.73 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1gpt h VAL 23 CO 0.16 0.06 0.06 0.00 0.02 0.00 0.00 177.57 177.87 1gpt h MET 25 N 0.19 0.32 -0.96 0.00 -1.53 -0.50 -1.88 114.93 110.57 1gpt h MET 25 Ca 0.07 -0.02 0.12 0.00 -3.44 0.00 0.00 59.70 56.43 1gpt h MET 25 Cb 0.28 -0.07 -0.08 0.00 -0.55 0.00 0.00 31.60 31.18 1gpt h MET 25 CO 0.00 0.21 0.61 0.37 0.14 0.00 0.00 176.91 178.24 1gpt h GLN 26 N 0.33 0.89 -1.03 0.39 5.75 0.05 -1.14 115.11 120.35 1gpt h GLN 26 Ca 0.16 -0.05 -0.58 0.00 -0.15 0.00 0.00 58.65 58.03 1gpt h GLN 26 Cb 0.10 -0.20 -0.28 0.00 1.07 0.00 0.00 27.48 28.17 1gpt h GLN 26 CO -0.13 0.59 0.74 0.39 -2.65 0.00 0.00 178.83 177.76 1gpt n GLU 27 N -4.59 2.42 0.00 1.69 4.71 -0.51 -4.94 120.64 119.42 1gpt n GLU 27 Ca 0.18 -3.00 0.00 0.00 -0.01 0.00 0.00 57.16 54.33 1gpt n GLU 27 Cb 0.37 -2.18 0.00 0.00 -1.01 0.00 0.00 31.44 28.62 1gpt n GLU 27 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1gpt n GLY 28 N -0.91 2.86 0.04 0.62 0.00 -0.43 -4.95 105.19 102.41 1gpt n GLY 28 Ca 0.58 -0.72 -0.01 0.00 0.00 0.00 0.00 46.02 45.87 1gpt n GLY 28 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1gpt n TRP 29 N 0.00 -0.04 0.00 1.61 7.02 -0.77 -4.77 117.44 120.49 1gpt n TRP 29 Ca 0.00 0.10 0.00 0.00 -1.02 0.00 0.00 57.50 56.58 1gpt n TRP 29 Cb 0.00 -0.26 0.00 0.00 -2.42 0.00 0.00 31.31 28.63 1gpt n TRP 29 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1gpt n GLY 30 N -1.02 3.76 0.00 6.99 0.00 -1.17 -1.85 105.19 111.90 1gpt n GLY 30 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1gpt n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gpt n GLY 31 N 0.00 2.02 3.63 -0.02 0.00 -0.46 -4.63 105.19 105.73 1gpt n GLY 31 Ca 0.00 -0.66 -0.06 0.00 0.00 0.00 0.00 46.02 45.30 1gpt n GLY 31 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gpt s GLY 32 N -0.40 -0.00 0.12 -0.02 0.00 -1.26 -0.75 107.32 105.01 1gpt s GLY 32 Ca 0.00 2.75 0.09 0.00 0.00 0.00 0.00 44.72 47.56 1gpt s GLY 32 CO 0.00 1.49 -0.21 0.21 0.00 0.00 0.00 173.10 174.58 1gpt s ASN 33 N -0.45 2.72 -0.32 1.64 3.84 -0.83 -3.71 114.94 117.83 1gpt s ASN 33 Ca 0.04 -0.74 0.03 0.00 0.21 0.00 0.00 52.86 52.40 1gpt s ASN 33 Cb -0.03 -0.16 0.10 0.00 -0.55 0.00 0.00 41.25 40.61 1gpt s ASN 33 CO -0.07 0.06 0.04 0.00 -2.79 0.00 0.00 177.10 174.34 1gpt s ASP 35 N 1.06 0.17 0.00 0.00 -4.77 -0.69 -4.77 116.67 107.67 1gpt s ASP 35 Ca 0.09 -1.28 0.00 0.00 -3.30 0.00 0.00 52.55 48.06 1gpt s ASP 35 Cb -0.19 0.37 0.00 0.00 -1.09 0.00 0.00 42.92 42.02 1gpt s ASP 35 CO -0.11 -0.83 0.00 0.61 0.70 0.00 0.00 175.17 175.54 1gpt n GLY 36 N -0.22 0.26 0.40 2.12 0.00 -1.26 -0.83 105.19 105.65 1gpt n GLY 36 Ca -0.01 -1.77 -0.18 0.00 0.00 0.00 0.00 46.02 44.07 1gpt n GLY 36 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1gpt h PRO 37 N 0.00 -0.94 0.00 1.61 0.11 -2.00 -3.46 132.00 127.32 1gpt h PRO 37 Ca 0.00 0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1gpt h PRO 37 Cb 0.00 0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.32 1gpt h PRO 37 CO 0.00 -0.60 0.00 1.28 -0.21 0.00 0.00 178.00 178.47 1gpt n LEU 38 N -5.48 0.00 -3.53 2.35 4.77 -1.26 -5.07 117.00 108.78 1gpt n LEU 38 Ca -0.14 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.56 1gpt n LEU 38 Cb 0.40 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.37 1gpt n LEU 38 CO 0.36 0.00 -0.28 -0.13 -1.33 0.00 0.00 177.39 176.01 1gpt s ARG 39 N 0.81 0.97 -0.25 3.23 0.52 -1.26 -4.10 118.95 118.88 1gpt s ARG 39 Ca 0.00 -1.89 -0.12 0.00 -0.52 0.00 0.00 55.73 53.20 1gpt s ARG 39 Cb 0.00 -1.73 -0.05 0.00 0.52 0.00 0.00 34.95 33.70 1gpt s ARG 39 CO 0.00 -1.26 0.23 0.50 0.02 0.00 0.00 175.30 174.79 1gpt s ARG 40 N 0.39 4.06 -1.17 3.54 3.52 -0.01 -0.60 118.95 128.67 1gpt s ARG 40 Ca 0.23 -0.16 -0.18 0.00 -0.13 0.00 0.00 55.73 55.50 1gpt s ARG 40 Cb -0.13 -3.58 -0.04 0.00 -1.56 0.00 0.00 34.95 29.64 1gpt s ARG 40 CO -0.07 -0.05 2.09 0.00 -0.81 0.00 0.00 175.30 176.45 1gpt s LYS 42 N 4.03 3.30 0.45 0.00 2.20 -0.06 -0.18 119.74 129.49 1gpt s LYS 42 Ca 0.52 -0.33 -0.07 0.00 -0.36 0.00 0.00 55.97 55.73 1gpt s LYS 42 Cb 0.14 -4.08 -0.04 0.00 -1.51 0.00 0.00 37.83 32.33 1gpt s LYS 42 CO 0.00 -1.54 0.78 0.00 -0.36 0.00 0.00 175.35 174.23 1gpt s MET 44 N -4.45 2.18 -0.25 0.00 1.00 0.07 -1.93 119.30 115.92 1gpt s MET 44 Ca 0.49 -1.14 -0.10 0.00 0.00 0.00 0.00 55.69 54.93 1gpt s MET 44 Cb -0.10 -2.72 -0.05 0.00 0.00 0.00 0.00 34.83 31.96 1gpt s MET 44 CO 0.41 -0.51 0.16 0.50 0.00 0.00 0.00 175.02 175.58 1gpt s ARG 45 N 1.22 3.99 -1.06 2.03 6.06 0.41 -1.36 118.95 130.25 1gpt s ARG 45 Ca -0.06 -0.31 -0.24 0.00 -2.50 0.00 0.00 55.73 52.63 1gpt s ARG 45 Cb -0.18 -3.55 -0.08 0.00 0.06 0.00 0.00 34.95 31.20 1gpt s ARG 45 CO -0.07 -0.03 1.95 0.50 -2.50 0.00 0.00 175.30 175.15 1gpt s ARG 46 N 1.32 2.46 0.00 5.12 6.06 -0.77 -0.67 118.95 132.47 1gpt s ARG 46 Ca 0.07 -0.75 0.15 0.00 -2.50 0.00 0.00 55.73 52.70 1gpt s ARG 46 Cb -0.14 -5.15 0.12 0.00 0.06 0.00 0.00 34.95 29.83 1gpt s ARG 46 CO 0.07 -3.79 0.98 0.00 -2.50 0.00 0.00 175.30 170.06