#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1psm n ALA 2 N 0.00 4.74 -3.69 4.31 0.00 -1.26 -4.83 120.51 119.78 1psm n ALA 2 Ca 0.00 -4.20 -0.03 0.00 0.00 0.00 0.00 53.44 49.21 1psm n ALA 2 Cb 0.00 -3.13 -0.01 0.00 0.00 0.00 0.00 19.45 16.31 1psm n ALA 2 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1psm s TYR 3 N 1.46 -0.15 -0.61 0.00 5.04 -1.26 -5.06 117.35 116.77 1psm s TYR 3 Ca 0.43 -0.09 -0.01 0.00 -2.44 0.00 0.00 57.07 54.97 1psm s TYR 3 Cb 0.06 0.60 0.45 0.00 0.35 0.00 0.00 41.96 43.42 1psm s TYR 3 CO -0.00 -0.67 1.90 1.17 -1.34 0.00 0.00 175.55 176.61 1psm n LYS 4 N -0.42 2.84 -0.03 4.97 4.81 -1.26 -3.80 118.16 125.26 1psm n LYS 4 Ca -0.07 -3.44 0.02 0.00 -0.87 0.00 0.00 58.31 53.96 1psm n LYS 4 Cb 0.61 -2.29 -0.13 0.00 0.02 0.00 0.00 35.03 33.25 1psm n LYS 4 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1psm n LYS 5 N -0.88 0.86 -3.20 1.64 0.00 -1.26 -4.72 118.16 110.60 1psm n LYS 5 Ca 0.60 -0.10 -0.40 0.00 0.00 0.00 0.00 58.31 58.41 1psm n LYS 5 Cb 0.70 -1.40 -0.07 0.00 0.00 0.00 0.00 35.03 34.26 1psm n LYS 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1psm s ALA 6 N -2.87 3.59 0.00 3.14 0.00 -1.25 -5.06 121.76 119.31 1psm s ALA 6 Ca -0.07 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.37 1psm s ALA 6 Cb 0.08 -2.91 0.00 0.00 0.00 0.00 0.00 23.12 20.29 1psm s ALA 6 CO 0.68 -0.71 0.00 0.36 0.00 0.00 0.00 175.76 176.09 1psm n LYS 7 N 5.46 3.69 0.14 0.00 2.85 -1.26 -4.94 118.16 124.10 1psm n LYS 7 Ca -0.03 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.26 1psm n LYS 7 Cb 0.50 0.00 0.03 0.00 -0.65 0.00 0.00 35.03 34.91 1psm n LYS 7 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 1psm h GLN 8 N 0.00 0.00 -4.01 -1.58 4.20 -1.98 -3.40 115.11 108.34 1psm h GLN 8 Ca 0.00 0.00 -0.76 0.00 0.06 0.00 0.00 58.65 57.95 1psm h GLN 8 Cb 0.00 0.00 -0.25 0.00 0.30 0.00 0.00 27.48 27.53 1psm h GLN 8 CO 0.00 0.44 -0.14 0.00 -0.67 0.00 0.00 178.83 178.46 1psm s ALA 9 N -2.98 3.76 0.00 3.87 0.00 -1.26 -2.37 121.76 122.78 1psm s ALA 9 Ca 0.04 -2.81 0.00 0.00 0.00 0.00 0.00 51.96 49.19 1psm s ALA 9 Cb 0.07 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1psm s ALA 9 CO 0.74 -2.09 0.00 0.43 0.00 0.00 0.00 175.76 174.84 1psm n SER 10 N 4.76 0.00 0.16 0.00 7.64 -1.26 -4.94 113.62 119.99 1psm n SER 10 Ca -0.04 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.86 1psm n SER 10 Cb 0.42 0.00 0.27 0.00 -1.01 0.00 0.00 64.21 63.89 1psm n SER 10 CO 0.00 0.00 0.00 0.06 -3.01 0.00 0.00 175.04 172.09 1psm h GLN 11 N 0.00 0.00 -0.09 1.43 -0.00 -1.87 -2.32 115.11 112.27 1psm h GLN 11 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1psm h GLN 11 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 1psm h GLN 11 CO 0.00 0.48 0.00 -0.25 -0.00 0.00 0.00 178.83 179.06 1psm n ASP 12 N -3.78 0.69 -0.05 0.06 9.92 -1.26 -0.11 116.55 122.01 1psm n ASP 12 Ca -0.01 -1.66 -0.01 0.00 -0.53 0.00 0.00 54.79 52.58 1psm n ASP 12 Cb 0.53 -0.06 -0.13 0.00 -0.64 0.00 0.00 41.12 40.82 1psm n ASP 12 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1psm n ALA 13 N -0.28 2.05 -0.02 2.24 0.00 -0.90 -4.74 120.51 118.87 1psm n ALA 13 Ca 0.12 -0.81 -0.21 0.00 0.00 0.00 0.00 53.44 52.54 1psm n ALA 13 Cb 0.16 -0.32 -0.13 0.00 0.00 0.00 0.00 19.45 19.15 1psm n ALA 13 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1psm h GLU 14 N 0.00 0.19 0.00 0.00 4.81 -0.94 -3.25 114.58 115.39 1psm h GLU 14 Ca -0.26 -0.32 -0.02 0.00 -0.13 0.00 0.00 59.36 58.63 1psm h GLU 14 Cb 1.51 0.12 -0.00 0.00 0.63 0.00 0.00 28.75 31.00 1psm h GLU 14 CO 0.01 1.15 -0.11 0.37 -0.73 0.00 0.00 179.01 179.71 1psm h GLN 15 N -0.43 0.00 0.00 1.92 5.75 -0.82 0.93 115.11 122.47 1psm h GLN 15 Ca -0.31 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.19 1psm h GLN 15 Cb 1.67 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.22 1psm h GLN 15 CO 0.01 0.11 -0.49 0.00 -2.65 0.00 0.00 178.83 175.80 1psm h ALA 16 N 1.89 0.75 0.00 3.38 0.00 -1.79 -3.12 119.26 120.37 1psm h ALA 16 Ca -0.00 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 1psm h ALA 16 Cb 0.34 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1psm h ALA 16 CO 0.01 0.00 -1.37 0.00 0.00 0.00 0.00 179.25 177.90 1psm n ALA 17 N -2.10 2.09 0.32 0.00 0.00 -0.03 -4.30 120.51 116.50 1psm n ALA 17 Ca 0.02 -0.49 0.13 0.00 0.00 0.00 0.00 53.44 53.11 1psm n ALA 17 Cb 0.53 -0.97 0.32 0.00 0.00 0.00 0.00 19.45 19.33 1psm n ALA 17 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1psm h LYS 18 N 0.00 0.00 0.00 0.00 1.57 -0.93 -3.08 116.57 114.13 1psm h LYS 18 Ca -0.13 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.50 1psm h LYS 18 Cb 1.44 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.73 1psm h LYS 18 CO 0.03 0.00 -0.82 0.22 -0.57 0.00 0.00 179.45 178.31 1psm h ASP 19 N 0.00 0.00 0.74 0.86 3.58 -1.73 -2.65 116.42 117.23 1psm h ASP 19 Ca 0.00 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 57.20 1psm h ASP 19 Cb 0.83 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.84 1psm h ASP 19 CO 0.00 0.66 -1.36 0.00 -2.88 0.00 0.00 179.24 175.66 1psm h ALA 20 N 1.34 0.59 -0.01 -0.78 0.00 -1.76 -3.20 119.26 115.44 1psm h ALA 20 Ca -0.04 -1.18 0.00 0.00 0.00 0.00 0.00 54.91 53.68 1psm h ALA 20 Cb 1.54 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.52 1psm h ALA 20 CO 0.08 1.40 -0.33 -0.85 0.00 0.00 0.00 179.25 179.55 1psm n GLU 21 N -3.18 0.56 0.11 0.00 0.28 -1.19 -3.94 120.64 113.28 1psm n GLU 21 Ca -0.09 -0.32 0.12 0.00 -0.16 0.00 0.00 57.16 56.71 1psm n GLU 21 Cb 0.99 -1.49 0.20 0.00 1.43 0.00 0.00 31.44 32.57 1psm n GLU 21 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 1psm h ASN 22 N 0.79 0.00 0.54 -1.84 2.35 -1.46 -3.36 115.58 112.60 1psm h ASN 22 Ca 0.00 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 1psm h ASN 22 Cb 0.50 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.87 1psm h ASN 22 CO 0.00 0.04 -0.06 0.00 -1.65 0.00 0.00 177.43 175.77 1psm h ALA 23 N 2.34 1.10 0.00 -0.83 0.00 -1.68 -2.15 119.26 118.04 1psm h ALA 23 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1psm h ALA 23 Cb 0.83 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1psm h ALA 23 CO 0.00 0.07 -0.98 0.43 0.00 0.00 0.00 179.25 178.77 1psm n SER 24 N -3.29 0.72 0.05 0.00 7.64 -1.26 -4.35 113.62 113.12 1psm n SER 24 Ca -0.01 0.15 0.03 0.00 1.01 0.00 0.00 58.87 60.05 1psm n SER 24 Cb 0.23 0.54 -0.07 0.00 -1.01 0.00 0.00 64.21 63.91 1psm n SER 24 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1psm n LYS 25 N -2.38 0.62 0.00 1.43 5.02 -0.86 -3.81 118.16 118.18 1psm n LYS 25 Ca 0.01 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 1psm n LYS 25 Cb 0.50 -1.79 0.00 0.00 -0.02 0.00 0.00 35.03 33.72 1psm n LYS 25 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1psm n GLU 26 N -2.80 0.88 0.01 1.97 0.28 -0.92 -2.76 120.64 117.29 1psm n GLU 26 Ca -0.08 0.00 -0.03 0.00 -0.16 0.00 0.00 57.16 56.89 1psm n GLU 26 Cb 0.76 -1.36 -0.11 0.00 1.43 0.00 0.00 31.44 32.17 1psm n GLU 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1psm n ALA 27 N -0.04 1.79 1.79 -1.84 0.00 -1.25 -4.44 120.51 116.52 1psm n ALA 27 Ca 0.00 -0.64 0.04 0.00 0.00 0.00 0.00 53.44 52.84 1psm n ALA 27 Cb 0.18 -0.89 0.20 0.00 0.00 0.00 0.00 19.45 18.94 1psm n ALA 27 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1psm n GLU 28 N -2.92 1.17 0.05 0.00 1.02 -1.11 -3.21 120.64 115.63 1psm n GLU 28 Ca -0.13 -0.25 -0.07 0.00 -0.02 0.00 0.00 57.16 56.69 1psm n GLU 28 Cb 0.92 -1.15 -0.12 0.00 -0.02 0.00 0.00 31.44 31.07 1psm n GLU 28 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 1psm h GLU 29 N 0.45 0.00 0.00 3.49 -0.00 -1.82 -3.29 114.58 113.41 1psm h GLU 29 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1psm h GLU 29 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.85 1psm h GLU 29 CO 0.00 0.96 -0.11 0.00 -0.00 0.00 0.00 179.01 179.86 1psm h ALA 30 N 1.00 0.95 -0.01 1.06 0.00 -1.87 0.58 119.26 120.96 1psm h ALA 30 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1psm h ALA 30 Cb 1.79 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.58 1psm h ALA 30 CO 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 179.25 179.31 1psm n ALA 31 N -2.07 2.69 -0.14 0.00 0.00 -1.25 -3.70 120.51 116.04 1psm n ALA 31 Ca 0.04 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1psm n ALA 31 Cb 0.52 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.83 1psm n ALA 31 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1psm n LYS 32 N 0.05 0.00 -0.23 0.00 4.81 -0.75 -4.58 118.16 117.46 1psm n LYS 32 Ca 0.17 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.73 1psm n LYS 32 Cb 0.37 0.00 0.24 0.00 0.02 0.00 0.00 35.03 35.66 1psm n LYS 32 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1psm n GLU 33 N -2.30 2.54 -0.01 1.64 1.02 0.20 -1.47 120.64 122.26 1psm n GLU 33 Ca 0.00 -2.36 -0.01 0.00 -0.02 0.00 0.00 57.16 54.77 1psm n GLU 33 Cb 0.00 -1.51 -0.00 0.00 -0.02 0.00 0.00 31.44 29.91 1psm n GLU 33 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1psm n ALA 34 N 1.48 0.07 1.14 0.62 0.00 -1.10 -4.90 120.51 117.81 1psm n ALA 34 Ca 0.20 -0.20 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1psm n ALA 34 Cb 0.60 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.25 1psm n ALA 34 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1psm n VAL 35 N -2.60 0.00 0.00 0.00 0.24 -1.24 -4.72 118.33 110.01 1psm n VAL 35 Ca -0.01 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 1psm n VAL 35 Cb 0.04 0.85 0.00 0.00 -1.47 0.00 0.00 33.84 33.26 1psm n VAL 35 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1psm n ASN 36 N -0.22 0.00 -1.02 -1.34 2.85 -0.96 -4.98 115.26 109.59 1psm n ASN 36 Ca 0.11 0.00 -0.12 0.00 -0.11 0.00 0.00 54.58 54.46 1psm n ASN 36 Cb 0.42 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 41.39 1psm n ASN 36 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1psm n LEU 37 N -0.68 -1.00 -0.16 1.20 7.99 -0.54 -5.04 117.00 118.77 1psm n LEU 37 Ca 0.00 0.26 0.02 0.00 -0.01 0.00 0.00 56.01 56.28 1psm n LEU 37 Cb 0.00 -1.92 0.02 0.00 -0.11 0.00 0.00 43.42 41.41 1psm n LEU 37 CO 0.00 -0.58 0.31 0.29 -1.51 0.00 0.00 177.39 175.90