#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 2.22 0.25 0.55 -1.09 -1.25 -0.73 121.20 121.15 1gpt s ILE 2 Ca 0.00 -1.54 -0.20 0.00 -2.23 0.00 0.00 60.65 56.68 1gpt s ILE 2 Cb 0.00 -2.27 -0.09 0.00 -1.58 0.00 0.00 42.46 38.53 1gpt s ILE 2 CO 0.00 0.03 0.76 0.00 -1.23 0.00 0.00 174.94 174.50 1gpt s ARG 4 N -2.12 1.81 -0.15 0.00 0.52 -1.26 -0.06 118.95 117.69 1gpt s ARG 4 Ca 0.45 -0.37 0.00 0.00 -0.52 0.00 0.00 55.73 55.29 1gpt s ARG 4 Cb -0.16 -1.79 -0.00 0.00 0.52 0.00 0.00 34.95 33.51 1gpt s ARG 4 CO 0.21 -0.26 -0.15 1.03 0.02 0.00 0.00 175.30 176.14 1gpt s ARG 5 N 1.62 3.24 0.13 3.54 1.81 -0.17 -4.88 118.95 124.25 1gpt s ARG 5 Ca 0.05 -0.74 -0.31 0.00 -1.72 0.00 0.00 55.73 53.00 1gpt s ARG 5 Cb -0.13 -2.61 -0.10 0.00 -0.45 0.00 0.00 34.95 31.66 1gpt s ARG 5 CO -0.09 0.07 1.79 0.50 -0.68 0.00 0.00 175.30 176.89 1gpt s ARG 6 N 0.69 4.14 -0.22 3.54 6.06 -1.26 -0.51 118.95 131.39 1gpt s ARG 6 Ca -0.07 2.56 -0.05 0.00 -2.50 0.00 0.00 55.73 55.67 1gpt s ARG 6 Cb -0.16 -3.52 0.01 0.00 0.06 0.00 0.00 34.95 31.35 1gpt s ARG 6 CO 0.02 -0.81 0.13 0.45 -2.50 0.00 0.00 175.30 172.59 1gpt n SER 7 N 5.40 -0.85 -4.56 -2.12 2.88 0.45 -4.79 113.62 110.03 1gpt n SER 7 Ca 0.17 -0.24 -0.32 0.00 -1.33 0.00 0.00 58.87 57.15 1gpt n SER 7 Cb 0.38 -0.31 -0.04 0.00 -0.75 0.00 0.00 64.21 63.48 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 -3.98 1.96 0.00 -1.46 0.00 -1.24 -2.97 121.76 114.07 1gpt s ALA 8 Ca 0.07 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 50.70 1gpt s ALA 8 Cb -0.04 -4.47 0.00 0.00 0.00 0.00 0.00 23.12 18.61 1gpt s ALA 8 CO 0.19 -4.36 0.00 0.41 0.00 0.00 0.00 175.76 171.99 1gpt n GLY 9 N 6.46 2.66 3.77 0.00 0.00 -1.26 -4.48 105.19 112.34 1gpt n GLY 9 Ca 0.32 -0.08 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.44 3.00 -0.23 1.61 5.36 -1.16 -5.04 117.98 120.08 1gpt s PHE 10 Ca 0.00 1.48 0.02 0.00 -0.96 0.00 0.00 56.93 57.47 1gpt s PHE 10 Cb 0.00 -3.55 0.05 0.00 -0.34 0.00 0.00 43.02 39.18 1gpt s PHE 10 CO 0.00 -1.68 -0.10 0.15 -1.46 0.00 0.00 175.22 172.14 1gpt s LYS 11 N -2.12 2.06 0.00 10.12 -0.14 -1.26 -4.82 119.74 123.59 1gpt s LYS 11 Ca 0.55 -1.09 0.00 0.00 -1.36 0.00 0.00 55.97 54.06 1gpt s LYS 11 Cb -0.35 -2.67 0.00 0.00 -1.68 0.00 0.00 37.83 33.12 1gpt s LYS 11 CO 0.46 -0.52 0.00 0.41 -0.76 0.00 0.00 175.35 174.93 1gpt n GLY 12 N 4.57 -1.35 3.77 -3.33 0.00 -1.26 -5.04 105.19 102.56 1gpt n GLY 12 Ca -0.14 -2.10 -0.36 0.00 0.00 0.00 0.00 46.02 43.42 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 3.53 -1.28 1.61 0.04 -1.26 -4.35 135.00 133.29 1gpt s PRO 13 Ca 0.00 1.74 -0.17 0.00 0.04 0.00 0.00 61.00 62.61 1gpt s PRO 13 Cb 0.00 -2.22 0.09 0.00 0.04 0.00 0.00 34.50 32.41 1gpt s PRO 13 CO 0.00 -0.73 1.67 0.00 0.04 0.00 0.00 177.00 177.98 1gpt h VAL 15 N 5.34 1.29 -3.54 0.00 2.07 -1.92 -3.44 116.25 116.05 1gpt h VAL 15 Ca 0.42 -2.15 -0.60 0.00 0.82 0.00 0.00 66.70 65.20 1gpt h VAL 15 Cb 0.87 2.27 -0.39 0.00 -1.52 0.00 0.00 31.29 32.53 1gpt h VAL 15 CO 1.41 0.67 -0.78 -0.55 0.02 0.00 0.00 177.57 178.34 1gpt s SER 16 N -7.20 3.79 0.36 0.57 0.15 -1.26 -4.98 113.70 105.13 1gpt s SER 16 Ca -0.10 -1.23 0.09 0.00 0.70 0.00 0.00 55.95 55.41 1gpt s SER 16 Cb 0.07 -1.09 0.83 0.00 -1.71 0.00 0.00 66.02 64.12 1gpt s SER 16 CO 0.91 -0.27 1.89 0.78 1.20 0.00 0.00 173.24 177.75 1gpt h ASN 17 N 7.99 0.63 -0.26 5.45 4.21 -1.91 -2.08 115.58 129.61 1gpt h ASN 17 Ca -0.16 0.03 0.02 0.00 1.21 0.00 0.00 56.30 57.40 1gpt h ASN 17 Cb 1.07 -0.09 -0.02 0.00 -1.12 0.00 0.00 38.32 38.15 1gpt h ASN 17 CO 0.41 0.34 0.11 0.50 -1.29 0.00 0.00 177.43 177.50 1gpt h LYS 18 N 0.68 0.23 -0.01 0.81 3.64 -1.94 0.11 116.57 120.10 1gpt h LYS 18 Ca 0.42 -0.01 -0.17 0.00 -1.27 0.00 0.00 60.65 59.62 1gpt h LYS 18 Cb 0.66 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.41 1gpt h LYS 18 CO -0.18 0.15 -0.75 -0.91 -2.27 0.00 0.00 179.45 175.49 1gpt h ASN 19 N 0.24 0.13 -0.36 4.20 4.21 -1.92 0.42 115.58 122.50 1gpt h ASN 19 Ca 0.11 -0.09 0.06 0.00 1.21 0.00 0.00 56.30 57.59 1gpt h ASN 19 Cb 0.06 -0.04 -0.05 0.00 -1.12 0.00 0.00 38.32 37.17 1gpt h ASN 19 CO -0.10 0.83 0.03 0.00 -1.29 0.00 0.00 177.43 176.90 1gpt h ALA 21 N 1.29 -0.31 0.26 0.00 0.00 -0.49 -2.33 119.26 117.68 1gpt h ALA 21 Ca 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1gpt h ALA 21 Cb 0.22 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1gpt h ALA 21 CO -0.26 -0.68 -0.47 0.37 0.00 0.00 0.00 179.25 178.21 1gpt h GLN 22 N -0.32 -0.75 -0.80 0.00 4.15 -0.76 0.03 115.11 116.66 1gpt h GLN 22 Ca -0.03 0.05 0.18 0.00 0.77 0.00 0.00 58.65 59.63 1gpt h GLN 22 Cb 0.26 0.17 -0.12 0.00 0.21 0.00 0.00 27.48 28.00 1gpt h GLN 22 CO 0.04 -0.50 0.22 0.28 -1.93 0.00 0.00 178.83 176.94 1gpt h VAL 23 N -0.78 0.47 -0.25 2.39 2.07 -1.11 0.38 116.25 119.42 1gpt h VAL 23 Ca -0.03 -0.10 -0.19 0.00 0.82 0.00 0.00 66.70 67.20 1gpt h VAL 23 Cb 0.73 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1gpt h VAL 23 CO -0.18 0.05 -0.61 0.00 0.02 0.00 0.00 177.57 176.86 1gpt h MET 25 N 0.61 0.52 -0.88 0.00 2.07 -0.26 0.81 114.93 117.81 1gpt h MET 25 Ca -0.01 -0.10 0.18 0.00 -2.07 0.00 0.00 59.70 57.71 1gpt h MET 25 Cb 1.23 -0.08 -0.07 0.00 -1.87 0.00 0.00 31.60 30.80 1gpt h MET 25 CO 0.13 0.51 0.57 0.37 1.07 0.00 0.00 176.91 179.57 1gpt h GLN 26 N 0.41 0.49 -0.70 1.72 4.15 -0.07 0.33 115.11 121.44 1gpt h GLN 26 Ca 0.12 -0.03 -0.17 0.00 0.77 0.00 0.00 58.65 59.33 1gpt h GLN 26 Cb 0.19 -0.11 -0.10 0.00 0.21 0.00 0.00 27.48 27.67 1gpt h GLN 26 CO -0.01 0.32 0.21 0.39 -1.93 0.00 0.00 178.83 177.82 1gpt n GLU 27 N -4.53 3.96 0.00 1.69 4.71 -0.08 -4.99 120.64 121.40 1gpt n GLU 27 Ca 0.18 -3.11 0.00 0.00 -0.01 0.00 0.00 57.16 54.22 1gpt n GLU 27 Cb 0.60 -2.23 0.00 0.00 -1.01 0.00 0.00 31.44 28.80 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 -0.01 3.06 3.64 0.62 0.00 0.11 -4.98 105.19 107.62 1gpt n GLY 28 Ca 0.38 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 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 1.44 -0.87 1.61 7.02 0.17 -4.78 117.44 122.03 1gpt n TRP 29 Ca 0.00 0.54 -0.09 0.00 -1.02 0.00 0.00 57.50 56.93 1gpt n TRP 29 Cb 0.00 -2.27 -0.13 0.00 -2.42 0.00 0.00 31.31 26.50 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 1.08 2.86 0.00 6.99 0.00 -0.16 -2.81 105.19 113.15 1gpt n GLY 30 Ca 0.09 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 2.26 -1.07 3.19 -0.02 0.00 -1.23 -4.61 105.19 103.71 1gpt n GLY 31 Ca 0.32 -2.25 -0.04 0.00 0.00 0.00 0.00 46.02 44.05 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 0.00 -0.63 0.54 -0.02 0.00 -1.26 -0.40 107.32 105.55 1gpt s GLY 32 Ca 0.00 1.57 0.08 0.00 0.00 0.00 0.00 44.72 46.37 1gpt s GLY 32 CO 0.00 2.89 0.75 -2.01 0.00 0.00 0.00 173.10 174.73 1gpt n ASN 33 N 5.40 1.82 -4.02 1.64 5.15 -0.31 -3.53 115.26 121.41 1gpt n ASN 33 Ca -0.05 -2.34 -0.22 0.00 -0.60 0.00 0.00 54.58 51.36 1gpt n ASN 33 Cb 0.50 -0.41 -0.16 0.00 -0.53 0.00 0.00 39.78 39.18 1gpt n ASN 33 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1gpt n ASP 35 N 3.50 3.72 -0.11 0.00 2.03 0.12 -4.87 116.55 120.93 1gpt n ASP 35 Ca -0.20 0.99 -0.09 0.00 0.52 0.00 0.00 54.79 56.01 1gpt n ASP 35 Cb 0.53 -1.47 -0.06 0.00 -0.72 0.00 0.00 41.12 39.39 1gpt n ASP 35 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1gpt h GLY 36 N 8.44 -1.36 -0.96 0.27 0.00 -1.99 -3.20 103.07 104.26 1gpt h GLY 36 Ca -0.47 0.78 -0.46 0.00 0.00 0.00 0.00 47.33 47.18 1gpt h GLY 36 CO 0.94 -0.34 0.30 2.56 0.00 0.00 0.00 176.54 180.00 1gpt s PRO 37 N -4.70 1.84 0.00 4.80 0.04 -1.26 -4.40 135.00 131.32 1gpt s PRO 37 Ca -0.09 -0.25 0.00 0.00 0.04 0.00 0.00 61.00 60.70 1gpt s PRO 37 Cb 0.06 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1gpt s PRO 37 CO 0.40 -1.54 0.00 1.28 0.04 0.00 0.00 177.00 177.18 1gpt n LEU 38 N -3.16 0.00 -3.25 -3.56 4.32 -1.26 -4.24 117.00 105.84 1gpt n LEU 38 Ca 0.10 0.00 -0.15 0.00 -0.02 0.00 0.00 56.01 55.94 1gpt n LEU 38 Cb 0.60 0.00 0.06 0.00 -1.62 0.00 0.00 43.42 42.47 1gpt n LEU 38 CO 0.52 0.00 0.05 -1.14 -1.22 0.00 0.00 177.39 175.59 1gpt n ARG 39 N -0.39 -2.15 -4.26 3.23 0.63 -1.21 -4.90 116.66 107.61 1gpt n ARG 39 Ca 0.00 0.90 -0.17 0.00 -0.92 0.00 0.00 57.85 57.65 1gpt n ARG 39 Cb 0.00 -5.77 -0.14 0.00 0.45 0.00 0.00 32.46 27.01 1gpt n ARG 39 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 1gpt s ARG 40 N -4.36 0.66 0.31 -0.14 3.52 -1.25 -0.03 118.95 117.66 1gpt s ARG 40 Ca 0.43 -0.45 -0.29 0.00 -0.13 0.00 0.00 55.73 55.29 1gpt s ARG 40 Cb -0.06 -0.60 -0.12 0.00 -1.56 0.00 0.00 34.95 32.60 1gpt s ARG 40 CO 0.75 0.15 1.37 0.00 -0.81 0.00 0.00 175.30 176.76 1gpt s LYS 42 N -1.37 0.23 0.24 0.00 2.20 0.13 -0.41 119.74 120.76 1gpt s LYS 42 Ca 0.59 0.26 -0.05 0.00 -0.36 0.00 0.00 55.97 56.41 1gpt s LYS 42 Cb -0.57 -1.05 -0.05 0.00 -1.51 0.00 0.00 37.83 34.64 1gpt s LYS 42 CO 0.58 -0.66 0.50 0.00 -0.36 0.00 0.00 175.35 175.40 1gpt s MET 44 N -3.25 3.53 -0.14 0.00 1.00 0.46 -1.00 119.30 119.91 1gpt s MET 44 Ca 0.43 -0.40 0.01 0.00 0.00 0.00 0.00 55.69 55.73 1gpt s MET 44 Cb -0.11 -2.99 0.02 0.00 0.00 0.00 0.00 34.83 31.75 1gpt s MET 44 CO 0.27 0.44 -0.15 0.50 0.00 0.00 0.00 175.02 176.08 1gpt s ARG 45 N -0.13 2.32 -0.85 2.03 6.06 0.91 -0.98 118.95 128.31 1gpt s ARG 45 Ca 0.05 -0.57 -0.27 0.00 -2.50 0.00 0.00 55.73 52.43 1gpt s ARG 45 Cb -0.12 -2.07 -0.18 0.00 0.06 0.00 0.00 34.95 32.63 1gpt s ARG 45 CO 0.02 -0.19 2.56 0.54 -2.50 0.00 0.00 175.30 175.73 1gpt n ARG 46 N 4.61 0.32 0.00 5.12 1.74 -1.26 -0.53 116.66 126.66 1gpt n ARG 46 Ca -0.18 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 56.86 1gpt n ARG 46 Cb 0.50 -2.11 0.00 0.00 -1.02 0.00 0.00 32.46 29.83 1gpt n ARG 46 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11