#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 4.63 -0.07 -0.18 -1.09 -1.26 -0.29 121.20 122.93 1gps s ILE 2 Ca 0.00 -0.55 -0.29 0.00 -2.23 0.00 0.00 60.65 57.57 1gps s ILE 2 Cb 0.00 -4.52 -0.02 0.00 -1.58 0.00 0.00 42.46 36.34 1gps s ILE 2 CO 0.00 -1.16 0.98 0.00 -1.23 0.00 0.00 174.94 173.52 1gps s ARG 4 N 1.65 1.49 -0.18 0.00 1.81 -1.26 -0.93 118.95 121.52 1gps s ARG 4 Ca 0.48 -0.32 -0.14 0.00 -1.72 0.00 0.00 55.73 54.03 1gps s ARG 4 Cb -0.19 -1.70 0.05 0.00 -0.45 0.00 0.00 34.95 32.66 1gps s ARG 4 CO 0.21 -0.32 0.47 0.50 -0.68 0.00 0.00 175.30 175.48 1gps s ARG 5 N 1.69 0.52 -0.35 3.54 3.52 -0.70 -4.97 118.95 122.19 1gps s ARG 5 Ca 0.04 0.72 -0.44 0.00 -0.13 0.00 0.00 55.73 55.92 1gps s ARG 5 Cb -0.13 0.18 -0.19 0.00 -1.56 0.00 0.00 34.95 33.25 1gps s ARG 5 CO -0.08 -0.10 1.50 -2.13 -0.81 0.00 0.00 175.30 173.69 1gps n ARG 6 N 3.30 0.19 -0.06 5.12 3.00 -1.26 -0.52 116.66 126.42 1gps n ARG 6 Ca -0.16 0.07 0.16 0.00 -0.00 0.00 0.00 57.85 57.92 1gps n ARG 6 Cb 0.56 -1.60 0.59 0.00 0.00 0.00 0.00 32.46 32.01 1gps n ARG 6 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1gps h SER 7 N 4.86 0.21 0.00 6.15 4.64 -1.30 -3.47 113.55 124.64 1gps h SER 7 Ca -0.46 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1gps h SER 7 Cb 1.37 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1gps h SER 7 CO 0.90 0.11 0.00 0.00 -0.87 0.00 0.00 176.83 176.98 1gps n ALA 8 N -2.57 0.00 -0.24 5.18 0.00 -1.26 -4.42 120.51 117.20 1gps n ALA 8 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.47 1gps n ALA 8 Cb 0.51 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.00 1gps n ALA 8 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1gps h GLY 9 N 0.00 1.20 -7.63 0.00 0.00 -1.98 -3.35 103.07 91.31 1gps h GLY 9 Ca 0.00 -0.81 -0.75 0.00 0.00 0.00 0.00 47.33 45.77 1gps h GLY 9 CO 0.00 0.75 0.82 -0.12 0.00 0.00 0.00 176.54 177.99 1gps s PHE 10 N -5.18 3.64 -0.68 5.60 2.19 -1.26 -4.96 117.98 117.32 1gps s PHE 10 Ca -0.12 -2.07 -0.27 0.00 0.33 0.00 0.00 56.93 54.80 1gps s PHE 10 Cb 0.14 -4.12 0.00 0.00 -1.31 0.00 0.00 43.02 37.73 1gps s PHE 10 CO 0.85 -1.25 1.62 -1.59 1.83 0.00 0.00 175.22 176.69 1gps s LYS 11 N 0.94 2.87 4.50 10.12 -2.85 -1.26 -4.64 119.74 129.42 1gps s LYS 11 Ca 0.34 0.21 0.00 0.00 -1.00 0.00 0.00 55.97 55.52 1gps s LYS 11 Cb -0.06 -4.34 0.00 0.00 -2.06 0.00 0.00 37.83 31.37 1gps s LYS 11 CO -0.06 -2.51 0.00 0.41 0.10 0.00 0.00 175.35 173.30 1gps n GLY 12 N 5.62 1.62 3.65 0.59 0.00 -1.26 -4.97 105.19 110.45 1gps n GLY 12 Ca 0.14 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 45.04 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 3.94 -0.06 1.61 0.04 -1.26 -3.41 135.00 135.86 1gps s PRO 13 Ca 0.00 2.39 0.05 0.00 0.04 0.00 0.00 61.00 63.49 1gps s PRO 13 Cb 0.00 -4.17 -0.02 0.00 0.04 0.00 0.00 34.50 30.35 1gps s PRO 13 CO 0.00 -1.17 -0.21 0.00 0.04 0.00 0.00 177.00 175.66 1gps n MET 15 N 2.82 0.66 -4.97 0.00 2.81 -1.26 -4.54 117.12 112.64 1gps n MET 15 Ca -0.17 0.25 -0.30 0.00 -1.81 0.00 0.00 57.70 55.67 1gps n MET 15 Cb 0.52 -1.59 -0.15 0.00 -0.71 0.00 0.00 33.22 31.29 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 -6.90 3.08 0.33 7.83 0.15 -1.26 -5.00 113.70 111.93 1gps s SER 16 Ca -0.32 -0.56 0.11 0.00 0.70 0.00 0.00 55.95 55.88 1gps s SER 16 Cb 0.09 -0.29 1.00 0.00 -1.71 0.00 0.00 66.02 65.11 1gps s SER 16 CO 0.62 0.26 1.62 0.78 1.20 0.00 0.00 173.24 177.73 1gps h ASN 17 N 4.94 0.15 -0.91 5.45 4.21 -1.90 -0.90 115.58 126.63 1gps h ASN 17 Ca -0.45 0.23 0.01 0.00 1.21 0.00 0.00 56.30 57.29 1gps h ASN 17 Cb 1.14 0.27 -0.05 0.00 -1.12 0.00 0.00 38.32 38.56 1gps h ASN 17 CO 0.44 -0.26 0.61 0.50 -1.29 0.00 0.00 177.43 177.43 1gps h LYS 18 N 0.15 1.20 -0.23 0.81 3.11 -1.96 -0.38 116.57 119.27 1gps h LYS 18 Ca 0.69 -0.07 -0.01 0.00 -2.81 0.00 0.00 60.65 58.45 1gps h LYS 18 Cb 1.60 -0.27 -0.01 0.00 -1.00 0.00 0.00 32.23 32.55 1gps h LYS 18 CO -0.72 0.79 0.11 -0.91 -2.81 0.00 0.00 179.45 175.92 1gps h ASN 19 N 1.23 0.30 0.19 4.20 -0.26 -1.54 0.19 115.58 119.89 1gps h ASN 19 Ca 0.34 -0.12 -0.01 0.00 -0.56 0.00 0.00 56.30 55.95 1gps h ASN 19 Cb -0.13 -0.08 0.00 0.00 -1.06 0.00 0.00 38.32 37.05 1gps h ASN 19 CO -0.08 0.33 -0.09 0.00 -1.06 0.00 0.00 177.43 176.53 1gps h ALA 21 N 0.50 1.50 -0.28 0.00 0.00 -0.84 -2.83 119.26 117.30 1gps h ALA 21 Ca -0.03 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1gps h ALA 21 Cb 0.24 -0.28 -0.08 0.00 0.00 0.00 0.00 17.79 17.67 1gps h ALA 21 CO 0.04 0.40 -0.49 0.37 0.00 0.00 0.00 179.25 179.57 1gps h GLN 22 N 1.04 -0.43 -0.53 0.00 4.15 -0.55 0.24 115.11 119.02 1gps h GLN 22 Ca 0.36 0.03 0.04 0.00 0.77 0.00 0.00 58.65 59.85 1gps h GLN 22 Cb 0.11 0.10 -0.04 0.00 0.21 0.00 0.00 27.48 27.85 1gps h GLN 22 CO -0.12 -0.29 0.28 0.28 -1.93 0.00 0.00 178.83 177.05 1gps h VAL 23 N -0.45 0.97 -0.14 2.39 2.07 -1.56 -2.97 116.25 116.56 1gps h VAL 23 Ca 0.08 -0.19 -0.12 0.00 0.82 0.00 0.00 66.70 67.29 1gps h VAL 23 Cb 0.63 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1gps h VAL 23 CO -0.51 0.10 -0.44 0.00 0.02 0.00 0.00 177.57 176.73 1gps h GLN 25 N 0.28 1.12 -0.66 0.00 4.20 -0.46 0.29 115.11 119.88 1gps h GLN 25 Ca 0.02 -0.30 -0.07 0.00 0.06 0.00 0.00 58.65 58.37 1gps h GLN 25 Cb 0.90 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.52 1gps h GLN 25 CO 0.07 1.02 0.14 0.37 -0.67 0.00 0.00 178.83 179.77 1gps h GLN 26 N 1.05 1.04 -0.08 1.46 4.15 -1.27 -3.12 115.11 118.34 1gps h GLN 26 Ca 0.21 -0.25 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1gps h GLN 26 Cb 0.44 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.99 1gps h GLN 26 CO 0.01 0.93 0.00 0.39 -1.93 0.00 0.00 178.83 178.24 1gps n GLU 27 N -4.24 1.25 -1.70 1.69 1.02 0.04 -4.93 120.64 113.78 1gps n GLU 27 Ca 0.05 -0.39 0.00 0.00 -0.02 0.00 0.00 57.16 56.80 1gps n GLU 27 Cb 0.26 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 1gps n GLU 27 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gps n GLY 28 N 0.82 0.44 3.58 0.62 0.00 -0.31 -4.99 105.19 105.35 1gps n GLY 28 Ca 0.11 -0.89 -0.33 0.00 0.00 0.00 0.00 46.02 44.91 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 -2.00 2.90 0.00 1.61 0.52 0.88 -5.01 118.94 117.83 1gps s TRP 29 Ca 0.00 -0.02 -0.01 0.00 0.02 0.00 0.00 56.10 56.09 1gps s TRP 29 Cb 0.00 -1.65 -0.02 0.00 -1.15 0.00 0.00 33.47 30.64 1gps s TRP 29 CO 0.00 0.35 1.99 0.41 0.02 0.00 0.00 176.95 179.72 1gps n GLY 30 N 1.87 2.39 0.00 0.98 0.00 0.51 -3.14 105.19 107.80 1gps n GLY 30 Ca -0.17 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 1.64 -0.37 0.00 -0.02 0.00 -1.22 -4.75 105.19 100.47 1gps n GLY 31 Ca 0.04 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.86 1gps n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gps n GLY 32 N 0.00 1.49 3.22 -0.02 0.00 -1.26 -1.37 105.19 107.24 1gps n GLY 32 Ca 0.00 -0.90 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 1gps n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gps s ASN 33 N 0.00 1.46 -0.47 1.61 4.22 0.11 -3.38 114.94 118.49 1gps s ASN 33 Ca 0.00 -1.03 -0.24 0.00 -2.14 0.00 0.00 52.86 49.45 1gps s ASN 33 Cb 0.00 0.05 0.03 0.00 1.28 0.00 0.00 41.25 42.61 1gps s ASN 33 CO 0.00 -0.42 0.85 0.00 -2.04 0.00 0.00 177.10 175.50 1gps s ASP 35 N 2.32 6.16 1.90 0.00 1.11 -0.22 -4.89 116.67 123.05 1gps s ASP 35 Ca 0.32 0.30 0.00 0.00 0.18 0.00 0.00 52.55 53.35 1gps s ASP 35 Cb -0.12 -1.89 0.00 0.00 1.07 0.00 0.00 42.92 41.98 1gps s ASP 35 CO 0.23 0.28 0.00 0.61 1.18 0.00 0.00 175.17 177.47 1gps n GLY 36 N 1.13 3.63 0.24 0.21 0.00 -1.26 -1.62 105.19 107.51 1gps n GLY 36 Ca -0.12 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1gps n GLY 36 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1gps n PRO 37 N 10.81 0.68 0.00 1.61 -0.04 -1.26 -4.84 135.00 141.96 1gps n PRO 37 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1gps n PRO 37 Cb 0.00 -1.16 0.00 0.00 -0.04 0.00 0.00 33.50 32.30 1gps n PRO 37 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1gps n PHE 38 N -0.18 0.00 0.84 0.54 3.72 -0.64 -4.69 117.46 117.04 1gps n PHE 38 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1gps n PHE 38 Cb 0.08 -0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.42 1gps n PHE 38 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1gps n ARG 39 N -1.14 0.84 -3.72 -1.08 3.00 -1.26 -0.65 116.66 112.66 1gps n ARG 39 Ca 0.00 0.00 -0.21 0.00 -0.01 0.00 0.00 57.85 57.63 1gps n ARG 39 Cb 0.00 -1.17 -0.18 0.00 0.00 0.00 0.00 32.46 31.11 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 -0.16 0.24 -0.36 5.56 3.00 -1.22 -4.29 118.95 121.72 1gps s ARG 40 Ca 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 55.73 55.95 1gps s ARG 40 Cb 0.00 -0.72 0.08 0.00 0.00 0.00 0.00 34.95 34.30 1gps s ARG 40 CO 0.00 -0.32 0.12 0.00 0.00 0.00 0.00 175.30 175.10 1gps s LYS 42 N 1.24 3.30 0.12 0.00 1.02 -0.79 -0.81 119.74 123.82 1gps s LYS 42 Ca 0.02 -0.72 0.07 0.00 0.02 0.00 0.00 55.97 55.36 1gps s LYS 42 Cb -0.21 -2.64 -0.04 0.00 -0.52 0.00 0.00 37.83 34.42 1gps s LYS 42 CO -0.02 0.10 -0.09 0.00 -0.92 0.00 0.00 175.35 174.42 1gps s ILE 44 N -1.34 3.20 -0.01 0.00 -4.36 -0.47 -1.72 121.20 116.49 1gps s ILE 44 Ca 0.22 -0.67 -0.06 0.00 -0.26 0.00 0.00 60.65 59.88 1gps s ILE 44 Cb -0.11 -2.27 0.00 0.00 1.25 0.00 0.00 42.46 41.34 1gps s ILE 44 CO 0.14 0.59 0.12 -0.60 0.24 0.00 0.00 174.94 175.44 1gps s ARG 45 N -0.74 0.39 -0.47 0.37 3.52 -0.11 -0.37 118.95 121.54 1gps s ARG 45 Ca 0.12 -0.27 -0.16 0.00 -0.13 0.00 0.00 55.73 55.28 1gps s ARG 45 Cb -0.11 0.16 0.06 0.00 -1.56 0.00 0.00 34.95 33.51 1gps s ARG 45 CO 0.01 -0.09 0.43 -1.14 -0.81 0.00 0.00 175.30 173.70 1gps s GLN 46 N -1.03 3.01 0.00 5.12 0.74 -1.26 -1.01 119.66 125.23 1gps s GLN 46 Ca -0.11 -1.19 0.28 0.00 0.05 0.00 0.00 55.36 54.39 1gps s GLN 46 Cb -0.06 -4.10 1.69 0.00 1.10 0.00 0.00 33.01 31.64 1gps s GLN 46 CO 0.01 -1.02 2.03 0.00 -0.55 0.00 0.00 175.29 175.77