#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 4.01 -0.17 0.55 1.01 -1.26 -0.16 121.20 125.19 1gpt s ILE 2 Ca 0.00 -0.32 -0.26 0.00 0.00 0.00 0.00 60.65 60.07 1gpt s ILE 2 Cb 0.00 -2.76 -0.01 0.00 0.01 0.00 0.00 42.46 39.70 1gpt s ILE 2 CO 0.00 0.50 0.85 0.00 0.00 0.00 0.00 174.94 176.29 1gpt s ARG 4 N 2.18 2.55 0.18 0.00 0.52 -1.26 -0.68 118.95 122.43 1gpt s ARG 4 Ca 0.39 -2.94 0.07 0.00 -0.52 0.00 0.00 55.73 52.73 1gpt s ARG 4 Cb -0.17 -3.60 -0.04 0.00 0.52 0.00 0.00 34.95 31.66 1gpt s ARG 4 CO 0.13 -1.21 -0.13 1.03 0.02 0.00 0.00 175.30 175.14 1gpt s ARG 5 N -0.78 1.22 -0.08 3.54 1.81 -0.98 -4.86 118.95 118.82 1gpt s ARG 5 Ca 0.21 -1.51 -0.30 0.00 -1.72 0.00 0.00 55.73 52.42 1gpt s ARG 5 Cb -0.15 -0.96 -0.03 0.00 -0.45 0.00 0.00 34.95 33.37 1gpt s ARG 5 CO -0.08 0.15 1.23 0.50 -0.68 0.00 0.00 175.30 176.42 1gpt s ARG 6 N -3.54 4.32 -0.31 3.54 3.52 -1.26 -1.12 118.95 124.09 1gpt s ARG 6 Ca 0.19 1.69 -0.42 0.00 -0.13 0.00 0.00 55.73 57.05 1gpt s ARG 6 Cb -0.00 -3.61 -0.18 0.00 -1.56 0.00 0.00 34.95 29.60 1gpt s ARG 6 CO 0.05 -0.52 1.61 0.45 -0.81 0.00 0.00 175.30 176.07 1gpt n SER 7 N 5.57 1.69 -4.56 -2.12 2.88 0.25 -4.85 113.62 112.49 1gpt n SER 7 Ca 0.12 1.13 -0.39 0.00 -1.33 0.00 0.00 58.87 58.40 1gpt n SER 7 Cb 0.46 -1.03 -0.03 0.00 -0.75 0.00 0.00 64.21 62.86 1gpt n SER 7 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1gpt s ALA 8 N 2.82 2.24 0.00 -1.46 0.00 -1.26 -1.88 121.76 122.22 1gpt s ALA 8 Ca 0.99 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 52.46 1gpt s ALA 8 Cb -1.24 -4.26 0.00 0.00 0.00 0.00 0.00 23.12 17.61 1gpt s ALA 8 CO 0.70 -3.75 0.00 0.41 0.00 0.00 0.00 175.76 173.12 1gpt n GLY 9 N 5.67 3.50 3.69 0.00 0.00 -1.26 -5.02 105.19 111.76 1gpt n GLY 9 Ca 0.21 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.80 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 0.00 3.49 -0.01 1.61 2.19 -0.79 -5.01 117.98 119.47 1gpt s PHE 10 Ca 0.00 1.57 -0.02 0.00 0.33 0.00 0.00 56.93 58.81 1gpt s PHE 10 Cb 0.00 -3.20 -0.00 0.00 -1.31 0.00 0.00 43.02 38.51 1gpt s PHE 10 CO 0.00 -0.27 0.05 0.15 1.83 0.00 0.00 175.22 176.98 1gpt s LYS 11 N 2.11 0.20 0.00 10.12 1.02 -1.26 -4.60 119.74 127.33 1gpt s LYS 11 Ca 0.48 -0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.30 1gpt s LYS 11 Cb -0.18 0.08 0.00 0.00 -0.52 0.00 0.00 37.83 37.21 1gpt s LYS 11 CO 0.17 -0.04 0.00 0.41 -0.92 0.00 0.00 175.35 174.97 1gpt n GLY 12 N 2.41 -1.77 3.55 -3.33 0.00 -1.26 -4.83 105.19 99.97 1gpt n GLY 12 Ca -0.17 -2.03 -0.38 0.00 0.00 0.00 0.00 46.02 43.44 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 2.97 -1.14 1.61 0.04 -1.25 -4.56 135.00 132.66 1gpt s PRO 13 Ca 0.00 -0.12 -0.16 0.00 0.04 0.00 0.00 61.00 60.75 1gpt s PRO 13 Cb 0.00 -4.59 0.13 0.00 0.04 0.00 0.00 34.50 30.08 1gpt s PRO 13 CO 0.00 -2.55 1.41 0.00 0.04 0.00 0.00 177.00 175.90 1gpt h VAL 15 N 5.27 1.18 -3.78 0.00 -1.51 -1.90 -3.37 116.25 112.14 1gpt h VAL 15 Ca 0.29 -0.36 -0.78 0.00 -1.23 0.00 0.00 66.70 64.62 1gpt h VAL 15 Cb 0.92 0.03 -0.27 0.00 -2.13 0.00 0.00 31.29 29.84 1gpt h VAL 15 CO 1.26 0.19 0.06 -0.55 -1.23 0.00 0.00 177.57 177.30 1gpt s SER 16 N -6.28 6.59 0.31 4.19 0.15 -1.26 -4.88 113.70 112.52 1gpt s SER 16 Ca -0.11 -2.78 0.06 0.00 0.70 0.00 0.00 55.95 53.82 1gpt s SER 16 Cb 0.18 -2.16 0.74 0.00 -1.71 0.00 0.00 66.02 63.07 1gpt s SER 16 CO 0.79 -0.53 1.78 0.78 1.20 0.00 0.00 173.24 177.26 1gpt h ASN 17 N 7.60 0.79 -0.38 5.45 2.35 -1.96 -2.88 115.58 126.55 1gpt h ASN 17 Ca 0.10 0.09 0.05 0.00 -0.55 0.00 0.00 56.30 56.00 1gpt h ASN 17 Cb 1.02 -0.05 -0.05 0.00 0.05 0.00 0.00 38.32 39.29 1gpt h ASN 17 CO 0.76 0.28 0.09 0.11 -1.65 0.00 0.00 177.43 177.03 1gpt h LYS 18 N 0.77 0.22 -0.52 0.81 1.57 -1.93 -1.67 116.57 115.82 1gpt h LYS 18 Ca 0.57 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.33 1gpt h LYS 18 Cb 0.89 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.13 1gpt h LYS 18 CO -0.37 0.15 0.28 -0.91 -0.57 0.00 0.00 179.45 178.03 1gpt h ASN 19 N 0.23 0.63 0.14 0.86 4.21 -1.94 -0.39 115.58 119.32 1gpt h ASN 19 Ca 0.18 -0.04 -0.01 0.00 1.21 0.00 0.00 56.30 57.64 1gpt h ASN 19 Cb 0.20 -0.16 0.00 0.00 -1.12 0.00 0.00 38.32 37.24 1gpt h ASN 19 CO -0.22 0.52 -0.06 0.00 -1.29 0.00 0.00 177.43 176.37 1gpt h ALA 21 N 0.54 0.52 0.29 0.00 0.00 -0.96 0.20 119.26 119.85 1gpt h ALA 21 Ca -0.02 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1gpt h ALA 21 Cb 0.25 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1gpt h ALA 21 CO 0.03 -0.27 -0.29 0.37 0.00 0.00 0.00 179.25 179.09 1gpt h GLN 22 N 0.28 -0.59 -0.82 0.00 4.15 -0.92 -0.36 115.11 116.85 1gpt h GLN 22 Ca 0.22 0.04 0.12 0.00 0.77 0.00 0.00 58.65 59.80 1gpt h GLN 22 Cb 0.25 0.13 -0.08 0.00 0.21 0.00 0.00 27.48 27.99 1gpt h GLN 22 CO -0.25 -0.40 0.43 0.28 -1.93 0.00 0.00 178.83 176.96 1gpt h VAL 23 N -0.62 0.80 -0.09 2.39 2.07 -0.42 0.52 116.25 120.90 1gpt h VAL 23 Ca -0.01 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.28 1gpt h VAL 23 Cb 0.57 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1gpt h VAL 23 CO -0.06 0.12 0.05 0.00 0.02 0.00 0.00 177.57 177.70 1gpt h MET 25 N 0.04 1.03 -0.77 0.00 2.07 -0.58 -0.67 114.93 116.05 1gpt h MET 25 Ca 0.03 -0.10 0.04 0.00 -2.07 0.00 0.00 59.70 57.60 1gpt h MET 25 Cb 0.10 -0.21 -0.05 0.00 -1.87 0.00 0.00 31.60 29.57 1gpt h MET 25 CO -0.00 0.75 0.48 0.37 1.07 0.00 0.00 176.91 179.57 1gpt h GLN 26 N 1.03 0.88 0.00 1.72 5.75 0.36 -2.03 115.11 122.83 1gpt h GLN 26 Ca 0.27 -0.05 -0.04 0.00 -0.15 0.00 0.00 58.65 58.68 1gpt h GLN 26 Cb -0.01 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.34 1gpt h GLN 26 CO -0.05 0.58 -0.17 0.93 -2.65 0.00 0.00 178.83 177.48 1gpt h GLU 27 N 0.91 0.00 0.00 1.69 5.08 -0.78 -3.47 114.58 118.01 1gpt h GLU 27 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1gpt h GLU 27 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1gpt h GLU 27 CO -0.13 0.17 0.00 0.41 -1.00 0.00 0.00 179.01 178.46 1gpt n GLY 28 N -0.41 1.90 3.77 -3.84 0.00 -0.76 -5.10 105.19 100.75 1gpt n GLY 28 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 1gpt n GLY 28 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1gpt s TRP 29 N -2.15 2.77 0.00 1.61 0.52 -0.29 -4.90 118.94 116.50 1gpt s TRP 29 Ca 0.00 1.52 0.00 0.00 0.02 0.00 0.00 56.10 57.64 1gpt s TRP 29 Cb 0.00 -3.41 0.00 0.00 -1.15 0.00 0.00 33.47 28.91 1gpt s TRP 29 CO 0.00 -1.67 1.51 0.41 0.02 0.00 0.00 176.95 177.22 1gpt n GLY 30 N 0.44 2.08 1.44 0.98 0.00 0.10 -2.99 105.19 107.25 1gpt n GLY 30 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 1.39 -2.50 0.00 -0.02 0.00 -1.26 -4.67 105.19 98.13 1gpt n GLY 31 Ca 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1gpt n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gpt n GLY 32 N -0.62 -0.68 3.14 -0.02 0.00 -1.26 -0.47 105.19 105.28 1gpt n GLY 32 Ca 0.00 -0.98 -0.14 0.00 0.00 0.00 0.00 46.02 44.91 1gpt n GLY 32 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1gpt s ASN 33 N -4.00 1.23 -0.50 1.61 3.84 -0.24 -4.03 114.94 112.85 1gpt s ASN 33 Ca 0.00 -0.76 -0.15 0.00 0.21 0.00 0.00 52.86 52.16 1gpt s ASN 33 Cb 0.00 0.03 0.10 0.00 -0.55 0.00 0.00 41.25 40.83 1gpt s ASN 33 CO 0.00 -0.27 0.43 0.00 -2.79 0.00 0.00 177.10 174.47 1gpt s ASP 35 N 3.01 6.76 0.00 0.00 1.11 0.89 -4.61 116.67 123.82 1gpt s ASP 35 Ca 0.04 0.91 0.00 0.00 0.18 0.00 0.00 52.55 53.68 1gpt s ASP 35 Cb -0.27 -2.32 0.00 0.00 1.07 0.00 0.00 42.92 41.41 1gpt s ASP 35 CO 0.05 -0.02 0.00 0.61 1.18 0.00 0.00 175.17 176.98 1gpt n GLY 36 N 3.20 0.00 3.70 0.21 0.00 -1.26 -1.74 105.19 109.30 1gpt n GLY 36 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1gpt n GLY 36 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gpt s PRO 37 N 0.00 4.32 0.00 1.61 0.04 -1.26 -1.91 135.00 137.80 1gpt s PRO 37 Ca 0.00 1.99 0.00 0.00 0.04 0.00 0.00 61.00 63.03 1gpt s PRO 37 Cb 0.00 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 31.15 1gpt s PRO 37 CO 0.00 -0.47 0.00 -0.11 0.04 0.00 0.00 177.00 176.46 1gpt n LEU 38 N 4.51 0.14 -3.28 -3.56 7.94 -1.26 -3.02 117.00 118.47 1gpt n LEU 38 Ca 0.12 0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 54.93 1gpt n LEU 38 Cb 0.43 -0.40 0.01 0.00 0.53 0.00 0.00 43.42 43.99 1gpt n LEU 38 CO 0.58 -0.07 0.16 0.54 -1.11 0.00 0.00 177.39 177.49 1gpt n ARG 39 N -2.00 -1.44 -2.99 1.96 1.74 -0.80 -3.42 116.66 109.71 1gpt n ARG 39 Ca 0.00 1.20 -0.40 0.00 -0.77 0.00 0.00 57.85 57.89 1gpt n ARG 39 Cb 0.00 -4.93 -0.06 0.00 -1.02 0.00 0.00 32.46 26.46 1gpt n ARG 39 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1gpt s ARG 40 N -3.77 4.52 -1.30 5.56 1.70 -0.71 -2.04 118.95 122.91 1gpt s ARG 40 Ca 0.08 1.11 -0.14 0.00 -0.47 0.00 0.00 55.73 56.30 1gpt s ARG 40 Cb -0.02 -3.30 0.11 0.00 -0.57 0.00 0.00 34.95 31.17 1gpt s ARG 40 CO 0.79 0.45 1.77 0.00 -1.08 0.00 0.00 175.30 177.22 1gpt s LYS 42 N 2.58 3.86 0.41 0.00 2.20 0.14 -0.58 119.74 128.35 1gpt s LYS 42 Ca 0.47 -0.38 0.03 0.00 -0.36 0.00 0.00 55.97 55.74 1gpt s LYS 42 Cb 0.05 -3.61 -0.03 0.00 -1.51 0.00 0.00 37.83 32.73 1gpt s LYS 42 CO 0.01 -0.20 0.09 0.00 -0.36 0.00 0.00 175.35 174.89 1gpt s MET 44 N -3.78 3.67 0.34 0.00 1.00 0.38 -2.33 119.30 118.58 1gpt s MET 44 Ca 0.23 -0.49 0.06 0.00 0.00 0.00 0.00 55.69 55.48 1gpt s MET 44 Cb 0.04 -2.94 -0.02 0.00 0.00 0.00 0.00 34.83 31.91 1gpt s MET 44 CO 0.13 0.28 0.20 -2.13 0.00 0.00 0.00 175.02 173.50 1gpt n ARG 45 N 3.44 0.48 -3.58 2.03 0.00 0.14 0.03 116.66 119.20 1gpt n ARG 45 Ca -0.17 -3.13 -0.37 0.00 -0.00 0.00 0.00 57.85 54.18 1gpt n ARG 45 Cb 0.52 2.16 -0.09 0.00 0.00 0.00 0.00 32.46 35.06 1gpt n ARG 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 1gpt s ARG 46 N -3.34 4.11 0.00 -0.14 6.06 -1.26 -0.76 118.95 123.62 1gpt s ARG 46 Ca 0.29 -0.12 0.16 0.00 -2.50 0.00 0.00 55.73 53.56 1gpt s ARG 46 Cb 0.01 -3.53 0.13 0.00 0.06 0.00 0.00 34.95 31.62 1gpt s ARG 46 CO 0.20 0.04 1.02 0.00 -2.50 0.00 0.00 175.30 174.07