#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2tgp n PRO 2 N 0.00 1.50 -0.03 -0.14 -0.04 -1.26 -4.32 135.00 130.70 2tgp n PRO 2 Ca 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.39 2tgp n PRO 2 Cb 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 2tgp n PRO 2 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2tgp n ASP 3 N 0.00 1.40 0.25 3.54 4.64 -1.26 -4.35 116.55 120.76 2tgp n ASP 3 Ca 0.00 0.05 0.15 0.00 -1.38 0.00 0.00 54.79 53.61 2tgp n ASP 3 Cb 0.00 -0.18 0.84 0.00 -1.04 0.00 0.00 41.12 40.74 2tgp n ASP 3 CO 0.00 0.00 0.00 2.19 -0.82 0.00 0.00 177.20 178.57 2tgp h PHE 4 N -0.18 0.00 0.00 -0.67 -5.15 -1.99 0.49 116.94 109.44 2tgp h PHE 4 Ca -0.17 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.60 2tgp h PHE 4 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.35 2tgp h PHE 4 CO -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 178.31 176.30 2tgp n LEU 6 N -2.18 0.81 -4.76 0.00 4.77 0.16 -4.62 117.00 111.18 2tgp n LEU 6 Ca 0.01 -0.41 -0.35 0.00 -0.03 0.00 0.00 56.01 55.23 2tgp n LEU 6 Cb 0.14 -0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.26 2tgp n LEU 6 CO 0.15 0.20 0.80 -1.61 -1.33 0.00 0.00 177.39 175.60 2tgp s GLU 7 N -3.10 2.95 0.64 3.23 2.02 -0.97 -4.91 118.70 118.57 2tgp s GLU 7 Ca 0.05 1.69 -0.14 0.00 0.02 0.00 0.00 54.97 56.59 2tgp s GLU 7 Cb 0.16 -1.94 -0.01 0.00 0.10 0.00 0.00 34.13 32.43 2tgp s GLU 7 CO 0.88 -1.19 1.07 -1.25 0.02 0.00 0.00 175.26 174.79 2tgp s PRO 8 N -3.50 3.10 0.41 0.39 0.04 -1.26 -4.92 135.00 129.25 2tgp s PRO 8 Ca 0.74 1.16 -0.27 0.00 0.04 0.00 0.00 61.00 62.67 2tgp s PRO 8 Cb -0.27 -2.00 -0.10 0.00 0.04 0.00 0.00 34.50 32.17 2tgp s PRO 8 CO 0.34 -0.99 1.44 -1.25 0.04 0.00 0.00 177.00 176.59 2tgp s PRO 9 N -4.38 3.95 -0.25 0.56 0.04 -1.26 -4.99 135.00 128.66 2tgp s PRO 9 Ca 0.62 2.47 0.03 0.00 0.04 0.00 0.00 61.00 64.16 2tgp s PRO 9 Cb -0.16 -2.84 0.06 0.00 0.04 0.00 0.00 34.50 31.60 2tgp s PRO 9 CO 0.43 -0.63 -0.11 -0.47 0.04 0.00 0.00 177.00 176.26 2tgp s TYR 10 N -1.16 3.22 0.12 0.56 6.14 -1.26 -4.98 117.35 119.99 2tgp s TYR 10 Ca 0.56 -2.24 -0.17 0.00 0.64 0.00 0.00 57.07 55.86 2tgp s TYR 10 Cb -0.45 -1.94 -0.03 0.00 0.42 0.00 0.00 41.96 39.96 2tgp s TYR 10 CO 0.59 -0.87 1.67 1.15 0.64 0.00 0.00 175.55 178.74 2tgp h THR 11 N 6.67 1.18 0.00 4.34 2.02 -1.95 -3.44 112.91 121.73 2tgp h THR 11 Ca -0.22 -0.53 0.00 0.00 0.77 0.00 0.00 66.41 66.43 2tgp h THR 11 Cb 1.05 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 68.38 2tgp h THR 11 CO 0.48 0.19 0.00 0.61 0.37 0.00 0.00 175.52 177.17 2tgp n GLY 12 N -0.78 -2.30 0.06 2.16 0.00 -1.26 -1.16 105.19 101.90 2tgp n GLY 12 Ca -0.01 -1.54 0.11 0.00 0.00 0.00 0.00 46.02 44.58 2tgp n GLY 12 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2tgp n PRO 13 N -0.65 0.45 -1.97 1.61 -0.04 -1.26 -4.72 135.00 128.41 2tgp n PRO 13 Ca 0.00 0.02 -0.34 0.00 -0.04 0.00 0.00 63.50 63.14 2tgp n PRO 13 Cb 0.00 -1.67 0.03 0.00 -0.04 0.00 0.00 33.50 31.82 2tgp n PRO 13 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2tgp n LYS 15 N -1.94 3.07 -3.27 0.00 5.02 -1.21 -4.41 118.16 115.43 2tgp n LYS 15 Ca 0.11 -3.69 -0.26 0.00 -2.02 0.00 0.00 58.31 52.45 2tgp n LYS 15 Cb 0.52 -2.25 -0.02 0.00 -0.02 0.00 0.00 35.03 33.26 2tgp n LYS 15 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2tgp s ALA 16 N -3.68 3.64 -0.85 7.82 0.00 -0.44 -5.03 121.76 123.21 2tgp s ALA 16 Ca 0.57 -0.76 0.00 0.00 0.00 0.00 0.00 51.96 51.77 2tgp s ALA 16 Cb 0.46 -2.23 0.24 0.00 0.00 0.00 0.00 23.12 21.59 2tgp s ALA 16 CO 0.02 0.01 0.88 -2.13 0.00 0.00 0.00 175.76 174.53 2tgp n ARG 17 N -1.62 2.87 -3.65 0.00 0.00 -1.26 -4.11 116.66 108.90 2tgp n ARG 17 Ca -0.03 -4.54 -0.38 0.00 -0.00 0.00 0.00 57.85 52.90 2tgp n ARG 17 Cb 0.55 -2.38 -0.12 0.00 0.00 0.00 0.00 32.46 30.52 2tgp n ARG 17 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2tgp s ILE 18 N -1.91 4.86 -0.26 5.15 1.01 -0.70 -4.91 121.20 124.44 2tgp s ILE 18 Ca 0.31 -0.06 -0.19 0.00 0.00 0.00 0.00 60.65 60.71 2tgp s ILE 18 Cb 0.01 -3.34 -0.02 0.00 0.01 0.00 0.00 42.46 39.11 2tgp s ILE 18 CO -0.06 0.24 0.58 -0.63 0.00 0.00 0.00 174.94 175.06 2tgp s ILE 19 N 1.69 5.02 0.43 2.92 1.01 -1.26 0.13 121.20 131.14 2tgp s ILE 19 Ca 0.06 0.99 0.03 0.00 0.00 0.00 0.00 60.65 61.74 2tgp s ILE 19 Cb -0.16 -3.89 -0.03 0.00 0.01 0.00 0.00 42.46 38.39 2tgp s ILE 19 CO 0.08 0.04 0.06 -0.13 0.00 0.00 0.00 174.94 174.99 2tgp s ARG 20 N 2.42 1.99 0.08 2.79 1.81 -1.04 -4.97 118.95 122.03 2tgp s ARG 20 Ca 0.24 -2.21 0.08 0.00 -1.72 0.00 0.00 55.73 52.11 2tgp s ARG 20 Cb -0.16 -1.07 -0.03 0.00 -0.45 0.00 0.00 34.95 33.24 2tgp s ARG 20 CO 0.09 -0.35 -0.21 0.71 -0.68 0.00 0.00 175.30 174.86 2tgp s TYR 21 N -3.05 1.77 0.04 -0.53 1.51 0.26 -2.55 117.35 114.79 2tgp s TYR 21 Ca 0.20 -0.40 0.02 0.00 -1.01 0.00 0.00 57.07 55.88 2tgp s TYR 21 Cb 0.04 -1.00 -0.02 0.00 -0.11 0.00 0.00 41.96 40.87 2tgp s TYR 21 CO 0.11 0.16 -0.06 -0.59 -1.11 0.00 0.00 175.55 174.06 2tgp s PHE 22 N -1.04 0.57 -0.21 2.71 -0.12 0.93 -0.92 117.98 119.90 2tgp s PHE 22 Ca 0.06 -0.53 -0.29 0.00 -0.05 0.00 0.00 56.93 56.12 2tgp s PHE 22 Cb -0.10 -0.35 0.01 0.00 -0.63 0.00 0.00 43.02 41.95 2tgp s PHE 22 CO 0.03 -0.12 1.03 -0.47 -0.05 0.00 0.00 175.22 175.65 2tgp s TYR 23 N -1.52 3.37 -0.47 3.49 6.14 -1.26 -0.64 117.35 126.45 2tgp s TYR 23 Ca -0.10 1.48 -0.14 0.00 0.64 0.00 0.00 57.07 58.95 2tgp s TYR 23 Cb -0.09 -3.25 0.09 0.00 0.42 0.00 0.00 41.96 39.12 2tgp s TYR 23 CO -0.00 -0.44 0.38 1.21 0.64 0.00 0.00 175.55 177.34 2tgp s ASN 24 N 1.19 6.01 0.50 4.32 3.84 0.88 -4.82 114.94 126.86 2tgp s ASN 24 Ca 0.44 -1.50 0.26 0.00 0.21 0.00 0.00 52.86 52.28 2tgp s ASN 24 Cb -0.15 -2.13 1.28 0.00 -0.55 0.00 0.00 41.25 39.70 2tgp s ASN 24 CO 0.08 -0.67 1.99 0.00 -2.79 0.00 0.00 177.10 175.71 2tgp h ALA 25 N 8.68 1.19 -0.02 1.71 0.00 -1.82 0.17 119.26 129.18 2tgp h ALA 25 Ca -0.27 -0.14 -0.21 0.00 0.00 0.00 0.00 54.91 54.29 2tgp h ALA 25 Cb 1.10 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.88 2tgp h ALA 25 CO 0.88 0.20 -0.81 0.87 0.00 0.00 0.00 179.25 180.39 2tgp h LYS 26 N 0.00 0.57 -0.14 0.00 1.57 -1.93 -2.69 116.57 113.95 2tgp h LYS 26 Ca -0.00 -0.60 -0.07 0.00 -1.87 0.00 0.00 60.65 58.11 2tgp h LYS 26 Cb 0.47 0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 2tgp h LYS 26 CO 0.02 1.21 -0.22 0.00 -0.57 0.00 0.00 179.45 179.89 2tgp h ALA 27 N 0.38 1.37 -3.40 3.86 0.00 -1.98 -3.47 119.26 116.01 2tgp h ALA 27 Ca -0.10 -0.28 -0.25 0.00 0.00 0.00 0.00 54.91 54.29 2tgp h ALA 27 Cb 1.48 -0.09 0.06 0.00 0.00 0.00 0.00 17.79 19.24 2tgp h ALA 27 CO 0.16 0.44 -0.40 0.41 0.00 0.00 0.00 179.25 179.86 2tgp n GLY 28 N -0.64 -0.04 3.42 0.00 0.00 0.54 -5.03 105.19 103.45 2tgp n GLY 28 Ca -0.01 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.75 2tgp n GLY 28 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2tgp s LEU 29 N -4.60 0.70 -0.13 0.99 0.05 -0.90 -5.01 118.68 109.78 2tgp s LEU 29 Ca 0.26 -1.04 -0.18 0.00 0.05 0.00 0.00 54.13 53.22 2tgp s LEU 29 Cb -0.12 1.25 -0.04 0.00 -2.05 0.00 0.00 46.19 45.23 2tgp s LEU 29 CO 0.32 -1.00 0.47 0.00 -0.55 0.00 0.00 176.35 175.60 2tgp s GLN 31 N 0.73 2.01 0.27 0.00 -0.21 0.19 -4.91 119.66 117.74 2tgp s GLN 31 Ca 0.25 -1.94 0.01 0.00 0.02 0.00 0.00 55.36 53.70 2tgp s GLN 31 Cb -0.15 -1.78 -0.04 0.00 1.00 0.00 0.00 33.01 32.04 2tgp s GLN 31 CO 0.10 0.02 0.45 0.95 -2.12 0.00 0.00 175.29 174.69 2tgp s THR 32 N -2.62 5.17 0.10 -0.19 -4.23 -1.26 -0.05 115.64 112.55 2tgp s THR 32 Ca 0.36 -0.56 -0.25 0.00 -1.18 0.00 0.00 61.69 60.05 2tgp s THR 32 Cb 0.05 -3.82 0.07 0.00 1.34 0.00 0.00 72.50 70.14 2tgp s THR 32 CO 0.19 -0.38 0.63 0.72 -0.54 0.00 0.00 174.62 175.24 2tgp s PHE 33 N -2.09 -0.57 -0.44 3.99 -0.12 -1.06 -4.93 117.98 112.76 2tgp s PHE 33 Ca 0.38 0.55 -0.26 0.00 -0.05 0.00 0.00 56.93 57.56 2tgp s PHE 33 Cb -0.10 0.52 0.02 0.00 -0.63 0.00 0.00 43.02 42.83 2tgp s PHE 33 CO 0.32 -0.77 0.94 0.08 -0.05 0.00 0.00 175.22 175.73 2tgp s VAL 34 N -3.00 4.49 -0.19 -2.49 1.01 -1.26 -2.50 120.40 116.45 2tgp s VAL 34 Ca -0.02 0.90 -0.09 0.00 0.00 0.00 0.00 61.98 62.77 2tgp s VAL 34 Cb -0.01 -4.41 -0.05 0.00 0.00 0.00 0.00 36.38 31.91 2tgp s VAL 34 CO -0.06 -0.76 0.10 -0.47 0.00 0.00 0.00 175.10 173.91 2tgp s TYR 35 N 3.71 3.33 -1.02 5.22 5.04 0.34 -4.32 117.35 129.66 2tgp s TYR 35 Ca 0.38 0.21 0.19 0.00 -2.44 0.00 0.00 57.07 55.40 2tgp s TYR 35 Cb -0.10 -2.13 0.81 0.00 0.35 0.00 0.00 41.96 40.88 2tgp s TYR 35 CO 0.24 0.21 1.60 0.41 -1.34 0.00 0.00 175.55 176.68 2tgp n GLY 36 N 3.58 -1.13 0.00 8.97 0.00 -0.31 -1.72 105.19 114.58 2tgp n GLY 36 Ca -0.16 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2tgp n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2tgp n GLY 37 N 0.43 2.11 3.25 -0.02 0.00 -1.26 -1.33 105.19 108.36 2tgp n GLY 37 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 2tgp n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2tgp n ARG 39 N 0.88 -2.59 -1.54 0.00 1.74 -1.26 -4.37 116.66 109.52 2tgp n ARG 39 Ca -0.20 0.62 -0.39 0.00 -0.77 0.00 0.00 57.85 57.11 2tgp n ARG 39 Cb 0.58 -4.84 0.04 0.00 -1.02 0.00 0.00 32.46 27.22 2tgp n ARG 39 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2tgp n ALA 40 N -2.56 -0.51 -2.00 7.54 0.00 -1.26 -4.91 120.51 116.80 2tgp n ALA 40 Ca -0.10 0.04 -0.21 0.00 0.00 0.00 0.00 53.44 53.18 2tgp n ALA 40 Cb 0.59 -1.96 0.06 0.00 0.00 0.00 0.00 19.45 18.14 2tgp n ALA 40 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2tgp s LYS 41 N -2.26 2.32 0.36 0.00 1.02 -1.26 -5.03 119.74 114.89 2tgp s LYS 41 Ca 0.70 -1.15 0.26 0.00 0.02 0.00 0.00 55.97 55.80 2tgp s LYS 41 Cb -0.47 -2.54 0.81 0.00 -0.52 0.00 0.00 37.83 35.11 2tgp s LYS 41 CO 0.52 -0.85 1.76 0.00 -0.92 0.00 0.00 175.35 175.86 2tgp h ARG 42 N 0.05 0.00 -3.14 1.68 3.08 -1.96 -3.34 114.38 110.75 2tgp h ARG 42 Ca -0.37 0.00 -0.73 0.00 0.07 0.00 0.00 59.98 58.94 2tgp h ARG 42 Cb 1.28 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.23 2tgp h ARG 42 CO 0.45 0.00 2.55 -1.71 -1.07 0.00 0.00 179.97 180.19 2tgp n ASN 43 N -2.69 6.62 -3.16 7.04 2.85 -1.26 -4.74 115.26 119.92 2tgp n ASN 43 Ca 0.03 -3.02 0.03 0.00 -0.11 0.00 0.00 54.58 51.52 2tgp n ASN 43 Cb 0.40 -1.46 -0.01 0.00 1.24 0.00 0.00 39.78 39.95 2tgp n ASN 43 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 2tgp s ASN 44 N 1.08 -1.40 0.02 1.20 3.84 -1.25 -4.58 114.94 113.85 2tgp s ASN 44 Ca 0.50 0.55 0.08 0.00 0.21 0.00 0.00 52.86 54.21 2tgp s ASN 44 Cb 0.15 2.06 -0.02 0.00 -0.55 0.00 0.00 41.25 42.88 2tgp s ASN 44 CO -0.05 -0.28 -0.25 -0.36 -2.79 0.00 0.00 177.10 173.37 2tgp s PHE 45 N 2.83 2.18 -0.62 0.43 0.40 -0.09 -4.90 117.98 118.20 2tgp s PHE 45 Ca 0.16 -0.41 0.25 0.00 -0.60 0.00 0.00 56.93 56.34 2tgp s PHE 45 Cb -0.13 -1.34 0.63 0.00 0.51 0.00 0.00 43.02 42.69 2tgp s PHE 45 CO -0.23 0.06 1.71 0.87 0.70 0.00 0.00 175.22 178.32 2tgp h LYS 46 N 5.10 0.00 -3.89 0.44 1.57 -1.94 0.76 116.57 118.61 2tgp h LYS 46 Ca -0.44 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.20 2tgp h LYS 46 Cb 1.14 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.26 2tgp h LYS 46 CO 0.45 0.00 -0.60 -1.54 -0.57 0.00 0.00 179.45 177.19 2tgp s SER 47 N -5.15 0.23 0.43 0.86 1.04 -1.26 -4.83 113.70 105.02 2tgp s SER 47 Ca 0.09 -0.55 0.22 0.00 0.48 0.00 0.00 55.95 56.19 2tgp s SER 47 Cb 0.10 0.18 1.20 0.00 0.10 0.00 0.00 66.02 67.60 2tgp s SER 47 CO 0.63 -0.44 1.79 0.00 0.98 0.00 0.00 173.24 176.20 2tgp h ALA 48 N 3.97 2.42 0.00 5.32 0.00 -1.97 -2.55 119.26 126.45 2tgp h ALA 48 Ca -0.32 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.50 2tgp h ALA 48 Cb 1.19 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 2tgp h ALA 48 CO 0.49 -0.79 -0.59 0.93 0.00 0.00 0.00 179.25 179.28 2tgp h GLU 49 N 0.30 0.00 -0.01 0.00 3.07 -1.99 -0.96 114.58 115.00 2tgp h GLU 49 Ca 0.57 0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 59.25 2tgp h GLU 49 Cb 1.62 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.52 2tgp h GLU 49 CO -0.22 0.59 -0.82 -0.44 -1.40 0.00 0.00 179.01 176.72 2tgp h ASP 50 N 0.00 0.21 0.04 1.42 3.32 -1.90 -0.79 116.42 118.72 2tgp h ASP 50 Ca -0.01 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 56.88 2tgp h ASP 50 Cb 1.27 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.76 2tgp h ASP 50 CO 0.08 0.93 -0.02 0.00 -1.72 0.00 0.00 179.24 178.51 2tgp h MET 52 N -0.11 0.00 -0.30 0.00 4.05 -1.06 0.13 114.93 117.65 2tgp h MET 52 Ca -0.01 0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 59.35 2tgp h MET 52 Cb 0.09 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 2tgp h MET 52 CO 0.01 0.49 -0.07 -0.09 0.23 0.00 0.00 176.91 177.48 2tgp h ARG 53 N 0.00 0.57 0.15 0.39 2.43 -0.94 -1.29 114.38 115.69 2tgp h ARG 53 Ca -0.00 -0.22 -0.20 0.00 -0.81 0.00 0.00 59.98 58.75 2tgp h ARG 53 Cb 0.90 -0.03 0.02 0.00 -0.42 0.00 0.00 29.97 30.44 2tgp h ARG 53 CO 0.06 0.77 -0.88 1.15 -1.51 0.00 0.00 179.97 179.56 2tgp h THR 54 N 0.34 1.49 0.00 0.20 2.02 -1.03 -3.41 112.91 112.52 2tgp h THR 54 Ca 0.08 -2.54 0.00 0.00 0.77 0.00 0.00 66.41 64.72 2tgp h THR 54 Cb 0.55 3.17 0.00 0.00 -1.74 0.00 0.00 68.15 70.13 2tgp h THR 54 CO 0.03 0.72 -1.69 0.00 0.37 0.00 0.00 175.52 174.95 2tgp s GLY 56 N -3.82 1.50 0.00 0.00 0.00 -0.49 -1.80 107.32 102.71 2tgp s GLY 56 Ca -0.05 0.33 0.00 0.00 0.00 0.00 0.00 44.72 45.00 2tgp s GLY 56 CO 0.69 2.60 0.00 0.61 0.00 0.00 0.00 173.10 177.00 2tgp n GLY 57 N 4.01 1.06 0.32 0.20 0.00 -1.26 -3.68 105.19 105.84 2tgp n GLY 57 Ca 0.15 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.21 2tgp n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32