#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gps s ILE 2 N 0.00 4.14 -0.59 0.58 1.09 -1.26 -0.61 121.20 124.56 1gps s ILE 2 Ca 0.00 -0.26 -0.28 0.00 -1.10 0.00 0.00 60.65 59.01 1gps s ILE 2 Cb 0.00 -2.85 0.03 0.00 -1.06 0.00 0.00 42.46 38.58 1gps s ILE 2 CO 0.00 0.46 1.16 0.00 -0.10 0.00 0.00 174.94 176.47 1gps s ARG 4 N 4.86 1.59 0.19 0.00 3.52 -1.26 -1.81 118.95 126.05 1gps s ARG 4 Ca 0.41 -2.12 0.07 0.00 -0.13 0.00 0.00 55.73 53.95 1gps s ARG 4 Cb -0.08 -3.06 -0.05 0.00 -1.56 0.00 0.00 34.95 30.20 1gps s ARG 4 CO 0.24 -1.03 -0.12 1.03 -0.81 0.00 0.00 175.30 174.60 1gps s ARG 5 N 0.43 1.27 -0.27 5.12 0.52 -0.53 -4.85 118.95 120.63 1gps s ARG 5 Ca 0.14 -1.57 -0.20 0.00 -0.52 0.00 0.00 55.73 53.58 1gps s ARG 5 Cb -0.22 -0.96 -0.02 0.00 0.52 0.00 0.00 34.95 34.27 1gps s ARG 5 CO -0.05 0.14 0.61 -0.98 0.02 0.00 0.00 175.30 175.03 1gps s ARG 6 N -3.69 4.02 -0.63 3.54 1.70 -1.26 -0.26 118.95 122.37 1gps s ARG 6 Ca 0.21 0.42 -0.31 0.00 -0.47 0.00 0.00 55.73 55.59 1gps s ARG 6 Cb 0.01 -3.68 -0.14 0.00 -0.57 0.00 0.00 34.95 30.57 1gps s ARG 6 CO 0.05 -0.46 2.45 0.45 -1.08 0.00 0.00 175.30 176.72 1gps n SER 7 N 5.74 1.52 0.30 -2.89 2.88 -0.87 -4.85 113.62 115.46 1gps n SER 7 Ca -0.01 -0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.69 1gps n SER 7 Cb 0.49 -1.25 0.95 0.00 -0.75 0.00 0.00 64.21 63.65 1gps n SER 7 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1gps h ALA 8 N 14.85 1.24 -0.38 -1.46 0.00 -1.93 -3.03 119.26 128.56 1gps h ALA 8 Ca -0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1gps h ALA 8 Cb 1.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1gps h ALA 8 CO 1.20 0.04 0.00 0.41 0.00 0.00 0.00 179.25 180.90 1gps n GLY 9 N -0.96 2.10 3.10 0.00 0.00 -1.26 -4.86 105.19 103.30 1gps n GLY 9 Ca -0.02 -0.55 -0.31 0.00 0.00 0.00 0.00 46.02 45.14 1gps n GLY 9 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1gps s PHE 10 N -1.91 2.38 -0.48 1.61 2.19 -1.15 -5.01 117.98 115.61 1gps s PHE 10 Ca 0.33 -1.26 -0.16 0.00 0.33 0.00 0.00 56.93 56.17 1gps s PHE 10 Cb 0.23 -1.68 0.07 0.00 -1.31 0.00 0.00 43.02 40.34 1gps s PHE 10 CO 0.13 -0.62 0.44 0.15 1.83 0.00 0.00 175.22 177.14 1gps s LYS 11 N 1.10 3.00 7.30 10.12 -0.14 -1.26 -4.99 119.74 134.86 1gps s LYS 11 Ca -0.02 -1.31 0.00 0.00 -1.36 0.00 0.00 55.97 53.27 1gps s LYS 11 Cb -0.14 -4.14 0.00 0.00 -1.68 0.00 0.00 37.83 31.87 1gps s LYS 11 CO -0.06 -1.08 0.00 0.41 -0.76 0.00 0.00 175.35 173.86 1gps n GLY 12 N 5.20 2.79 3.56 -3.33 0.00 -1.26 -4.77 105.19 107.38 1gps n GLY 12 Ca -0.12 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 1gps n GLY 12 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gps s PRO 13 N 0.00 3.12 -1.17 1.61 0.04 -1.26 -4.45 135.00 132.90 1gps s PRO 13 Ca 0.00 0.23 -0.11 0.00 0.04 0.00 0.00 61.00 61.16 1gps s PRO 13 Cb 0.00 -4.20 0.23 0.00 0.04 0.00 0.00 34.50 30.57 1gps s PRO 13 CO 0.00 -2.18 1.30 0.00 0.04 0.00 0.00 177.00 176.16 1gps n MET 15 N 4.03 0.11 -4.16 0.00 2.81 -1.24 -4.48 117.12 114.18 1gps n MET 15 Ca 0.31 0.40 -0.16 0.00 -1.81 0.00 0.00 57.70 56.44 1gps n MET 15 Cb 0.40 -1.72 -0.14 0.00 -0.71 0.00 0.00 33.22 31.05 1gps n MET 15 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1gps s SER 16 N -3.69 0.69 0.57 7.83 0.15 -1.26 -5.03 113.70 112.96 1gps s SER 16 Ca 0.04 -0.16 0.28 0.00 0.70 0.00 0.00 55.95 56.81 1gps s SER 16 Cb 0.08 -0.06 1.69 0.00 -1.71 0.00 0.00 66.02 66.02 1gps s SER 16 CO 0.29 0.03 2.21 -0.55 1.20 0.00 0.00 173.24 176.42 1gps h ASN 17 N 5.81 0.00 -0.56 5.45 -1.07 -1.88 -2.55 115.58 120.78 1gps h ASN 17 Ca -0.29 0.00 0.02 0.00 0.07 0.00 0.00 56.30 56.10 1gps h ASN 17 Cb 1.19 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 37.41 1gps h ASN 17 CO 0.49 0.03 0.34 0.50 0.07 0.00 0.00 177.43 178.86 1gps h LYS 18 N 0.00 0.66 -0.54 4.14 3.11 -1.96 0.12 116.57 122.10 1gps h LYS 18 Ca -0.00 -0.04 0.01 0.00 -2.81 0.00 0.00 60.65 57.81 1gps h LYS 18 Cb 0.07 -0.15 -0.03 0.00 -1.00 0.00 0.00 32.23 31.12 1gps h LYS 18 CO 0.00 0.44 0.36 -0.91 -2.81 0.00 0.00 179.45 176.53 1gps h ASN 19 N 0.68 0.60 -0.03 4.20 4.21 -1.84 0.39 115.58 123.79 1gps h ASN 19 Ca 0.22 -0.01 -0.09 0.00 1.21 0.00 0.00 56.30 57.63 1gps h ASN 19 Cb 0.01 -0.15 0.01 0.00 -1.12 0.00 0.00 38.32 37.07 1gps h ASN 19 CO -0.09 0.43 -0.32 0.00 -1.29 0.00 0.00 177.43 176.15 1gps h ALA 21 N 0.35 1.42 -0.26 0.00 0.00 -0.45 -2.48 119.26 117.84 1gps h ALA 21 Ca -0.03 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.89 1gps h ALA 21 Cb 1.02 -0.33 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 1gps h ALA 21 CO 0.07 0.51 -0.24 0.37 0.00 0.00 0.00 179.25 179.96 1gps h GLN 22 N 1.13 -0.23 -0.45 0.00 4.15 -0.95 0.17 115.11 118.94 1gps h GLN 22 Ca 0.34 0.02 -0.07 0.00 0.77 0.00 0.00 58.65 59.70 1gps h GLN 22 Cb -0.04 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 1gps h GLN 22 CO -0.09 -0.15 -0.01 0.28 -1.93 0.00 0.00 178.83 176.93 1gps h VAL 23 N -0.24 1.26 -0.04 2.39 2.07 -1.54 -3.05 116.25 117.11 1gps h VAL 23 Ca 0.14 -1.06 -0.15 0.00 0.82 0.00 0.00 66.70 66.46 1gps h VAL 23 Cb 0.46 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1gps h VAL 23 CO -0.40 0.36 -0.63 0.00 0.02 0.00 0.00 177.57 176.93 1gps h GLN 25 N 0.12 0.88 0.00 0.00 4.20 -0.62 -1.18 115.11 118.51 1gps h GLN 25 Ca -0.01 -0.26 -0.06 0.00 0.06 0.00 0.00 58.65 58.38 1gps h GLN 25 Cb 1.13 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.82 1gps h GLN 25 CO 0.09 0.89 -0.28 0.37 -0.67 0.00 0.00 178.83 179.24 1gps h GLN 26 N 0.81 0.00 -0.01 1.46 -0.00 -1.36 -3.31 115.11 112.69 1gps h GLN 26 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.80 1gps h GLN 26 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.00 1gps h GLN 26 CO 0.03 0.28 -0.47 -1.91 0.00 0.00 0.00 178.83 176.75 1gps n GLU 27 N -3.96 1.04 0.00 1.69 2.13 -0.57 -4.96 120.64 116.00 1gps n GLU 27 Ca -0.02 -0.82 0.00 0.00 0.66 0.00 0.00 57.16 56.98 1gps n GLU 27 Cb 0.35 -1.48 0.00 0.00 0.27 0.00 0.00 31.44 30.58 1gps n GLU 27 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1gps n GLY 28 N 1.41 1.12 3.86 8.31 0.00 -0.75 -5.04 105.19 114.09 1gps n GLY 28 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 1gps n GLY 28 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1gps s TRP 29 N -2.01 3.46 -0.65 1.61 0.52 -0.55 -5.01 118.94 116.30 1gps s TRP 29 Ca 0.00 1.30 -0.02 0.00 0.02 0.00 0.00 56.10 57.40 1gps s TRP 29 Cb 0.00 -2.65 0.45 0.00 -1.15 0.00 0.00 33.47 30.12 1gps s TRP 29 CO 0.00 -0.25 2.03 0.41 0.02 0.00 0.00 176.95 179.16 1gps n GLY 30 N -1.43 5.75 0.00 0.98 0.00 -0.73 -3.14 105.19 106.62 1gps n GLY 30 Ca 0.05 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.86 1gps n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gps n GLY 31 N -0.89 1.20 3.63 -0.02 0.00 -1.22 -4.88 105.19 103.01 1gps n GLY 31 Ca 0.62 -2.03 -0.05 0.00 0.00 0.00 0.00 46.02 44.57 1gps n GLY 31 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gps s GLY 32 N 0.00 0.08 0.02 -0.02 0.00 -1.26 -1.89 107.32 104.26 1gps s GLY 32 Ca 0.00 2.88 0.04 0.00 0.00 0.00 0.00 44.72 47.64 1gps s GLY 32 CO 0.00 1.42 -0.12 0.54 0.00 0.00 0.00 173.10 174.94 1gps s ASN 33 N -0.59 1.37 -0.56 1.64 2.20 0.42 -3.53 114.94 115.89 1gps s ASN 33 Ca 0.06 -0.37 -0.24 0.00 -0.94 0.00 0.00 52.86 51.37 1gps s ASN 33 Cb -0.02 -0.09 0.04 0.00 -2.00 0.00 0.00 41.25 39.17 1gps s ASN 33 CO -0.08 0.03 0.96 0.00 -2.94 0.00 0.00 177.10 175.07 1gps s ASP 35 N 2.92 6.28 0.83 0.00 1.47 0.06 -4.83 116.67 123.40 1gps s ASP 35 Ca 0.30 0.18 0.00 0.00 1.18 0.00 0.00 52.55 54.22 1gps s ASP 35 Cb -0.13 -2.23 0.00 0.00 -0.34 0.00 0.00 42.92 40.23 1gps s ASP 35 CO 0.19 -0.28 0.00 0.61 0.68 0.00 0.00 175.17 176.37 1gps n GLY 36 N 4.71 1.67 3.75 2.12 0.00 -1.26 -4.45 105.19 111.72 1gps n GLY 36 Ca -0.07 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 1gps n GLY 36 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1gps s PRO 37 N 0.00 4.22 0.00 1.61 0.02 -1.26 -4.88 135.00 134.71 1gps s PRO 37 Ca 0.00 2.40 0.00 0.00 0.02 0.00 0.00 61.00 63.42 1gps s PRO 37 Cb 0.00 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.45 1gps s PRO 37 CO 0.00 -0.47 1.24 1.19 -0.33 0.00 0.00 177.00 178.63 1gps n PHE 38 N 1.99 0.00 0.00 6.54 3.01 -1.26 -2.51 117.46 125.23 1gps n PHE 38 Ca 0.06 -0.62 0.00 0.00 1.01 0.00 0.00 57.45 57.90 1gps n PHE 38 Cb 0.39 -0.37 0.00 0.00 -0.01 0.00 0.00 39.48 39.49 1gps n PHE 38 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1gps n ARG 39 N 1.37 2.44 -2.71 -1.08 3.00 -1.26 -0.77 116.66 117.65 1gps n ARG 39 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.85 57.41 1gps n ARG 39 Cb 0.36 -0.97 -0.02 0.00 0.00 0.00 0.00 32.46 31.83 1gps n ARG 39 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1gps s ARG 40 N -1.94 4.23 -0.57 5.56 1.81 -1.05 -4.36 118.95 122.63 1gps s ARG 40 Ca 0.00 1.25 -0.10 0.00 -1.72 0.00 0.00 55.73 55.16 1gps s ARG 40 Cb 0.00 -3.65 0.15 0.00 -0.45 0.00 0.00 34.95 31.00 1gps s ARG 40 CO 0.00 -0.63 0.46 0.00 -0.68 0.00 0.00 175.30 174.45 1gps s LYS 42 N 0.92 3.94 0.11 0.00 1.02 -0.68 -2.04 119.74 123.00 1gps s LYS 42 Ca 0.10 -0.05 0.10 0.00 0.02 0.00 0.00 55.97 56.14 1gps s LYS 42 Cb -0.23 -3.33 -0.04 0.00 -0.52 0.00 0.00 37.83 33.72 1gps s LYS 42 CO -0.02 0.48 -0.26 0.00 -0.92 0.00 0.00 175.35 174.62 1gps s ILE 44 N -1.02 1.54 -0.15 0.00 -4.36 -0.79 -1.45 121.20 114.97 1gps s ILE 44 Ca 0.13 -0.91 -0.29 0.00 -0.26 0.00 0.00 60.65 59.32 1gps s ILE 44 Cb -0.10 -1.29 0.10 0.00 1.25 0.00 0.00 42.46 42.42 1gps s ILE 44 CO 0.05 0.37 0.87 0.00 0.24 0.00 0.00 174.94 176.47 1gps s ARG 45 N -0.63 0.76 -0.40 0.37 1.70 -0.75 -1.78 118.95 118.23 1gps s ARG 45 Ca 0.07 0.33 -0.29 0.00 -0.47 0.00 0.00 55.73 55.38 1gps s ARG 45 Cb -0.08 0.36 0.01 0.00 -0.57 0.00 0.00 34.95 34.67 1gps s ARG 45 CO -0.00 -0.21 1.42 -0.65 -1.08 0.00 0.00 175.30 174.78 1gps s GLN 46 N -0.80 3.60 0.00 3.89 -1.52 -1.26 -0.62 119.66 122.95 1gps s GLN 46 Ca -0.04 0.99 0.22 0.00 -1.95 0.00 0.00 55.36 54.58 1gps s GLN 46 Cb -0.01 -4.02 0.17 0.00 -0.22 0.00 0.00 33.01 28.93 1gps s GLN 46 CO 0.03 -1.53 1.19 0.00 -0.25 0.00 0.00 175.29 174.74