#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1psm s ALA 2 N 0.00 0.87 0.00 0.62 0.00 -1.26 -5.05 121.76 116.94 1psm s ALA 2 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1psm s ALA 2 Cb 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.92 1psm s ALA 2 CO 0.00 0.20 0.00 0.98 0.00 0.00 0.00 175.76 176.94 1psm n TYR 3 N 2.68 0.00 -3.61 0.00 9.36 -1.26 -5.16 117.16 119.17 1psm n TYR 3 Ca -0.14 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 60.97 1psm n TYR 3 Cb 0.56 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 39.21 1psm n TYR 3 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1psm s LYS 4 N 0.65 0.61 -0.03 2.98 1.02 -1.26 -5.16 119.74 118.56 1psm s LYS 4 Ca 0.00 0.49 -0.19 0.00 0.02 0.00 0.00 55.97 56.29 1psm s LYS 4 Cb 0.00 0.29 0.04 0.00 -0.52 0.00 0.00 37.83 37.64 1psm s LYS 4 CO 0.00 -0.12 0.41 0.15 -0.92 0.00 0.00 175.35 174.86 1psm s LYS 5 N -0.24 0.76 0.00 1.68 3.01 -1.26 -5.19 119.74 118.50 1psm s LYS 5 Ca 0.00 -0.06 0.00 0.00 -1.01 0.00 0.00 55.97 54.90 1psm s LYS 5 Cb -0.03 0.35 0.00 0.00 -1.01 0.00 0.00 37.83 37.13 1psm s LYS 5 CO -0.02 -0.22 0.00 0.00 0.51 0.00 0.00 175.35 175.62 1psm n ALA 6 N 1.21 0.00 -2.64 5.17 0.00 -1.26 -5.08 120.51 117.91 1psm n ALA 6 Ca -0.21 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.85 1psm n ALA 6 Cb 0.56 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.90 1psm n ALA 6 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1psm s LYS 7 N 2.70 3.76 0.21 0.00 3.01 -1.26 -4.89 119.74 123.27 1psm s LYS 7 Ca 0.00 -0.45 0.00 0.00 -1.01 0.00 0.00 55.97 54.51 1psm s LYS 7 Cb 0.00 -3.66 0.00 0.00 -1.01 0.00 0.00 37.83 33.16 1psm s LYS 7 CO 0.00 -0.27 0.00 0.94 0.51 0.00 0.00 175.35 176.53 1psm n GLN 8 N 5.05 0.00 0.00 1.68 -0.06 -1.26 -5.12 117.38 117.68 1psm n GLN 8 Ca -0.14 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.86 1psm n GLN 8 Cb 0.51 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.69 1psm n GLN 8 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1psm n ALA 9 N -3.09 0.00 -0.91 1.69 0.00 -1.26 -5.03 120.51 111.92 1psm n ALA 9 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 1psm n ALA 9 Cb 0.00 0.00 0.31 0.00 0.00 0.00 0.00 19.45 19.76 1psm n ALA 9 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1psm n SER 10 N 0.00 4.54 -0.07 0.00 7.64 -1.26 -4.62 113.62 119.84 1psm n SER 10 Ca 0.00 -2.91 0.14 0.00 1.01 0.00 0.00 58.87 57.11 1psm n SER 10 Cb 0.00 -0.58 0.61 0.00 -1.01 0.00 0.00 64.21 63.23 1psm n SER 10 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1psm n GLN 11 N 0.02 0.49 -0.10 1.43 -0.00 -1.26 -1.09 117.38 116.88 1psm n GLN 11 Ca 0.23 -0.14 -0.10 0.00 -0.00 0.00 0.00 57.00 57.00 1psm n GLN 11 Cb 0.98 -1.50 -0.16 0.00 -0.00 0.00 0.00 30.24 29.56 1psm n GLN 11 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 1psm n ASP 12 N -1.13 0.04 0.05 2.61 2.03 -1.26 -4.02 116.55 114.86 1psm n ASP 12 Ca 0.13 0.02 -0.03 0.00 0.52 0.00 0.00 54.79 55.43 1psm n ASP 12 Cb 0.28 0.95 -0.08 0.00 -0.72 0.00 0.00 41.12 41.56 1psm n ASP 12 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1psm h ALA 13 N 1.00 0.62 0.00 -1.67 0.00 -1.80 0.02 119.26 117.43 1psm h ALA 13 Ca -0.54 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 53.47 1psm h ALA 13 Cb 2.24 0.15 0.00 0.00 0.00 0.00 0.00 17.79 20.18 1psm h ALA 13 CO 0.03 1.07 -0.72 -0.85 0.00 0.00 0.00 179.25 178.78 1psm n GLU 14 N -3.10 0.24 -0.00 0.00 0.28 -0.25 -4.19 120.64 113.62 1psm n GLU 14 Ca -0.06 0.05 -0.17 0.00 -0.16 0.00 0.00 57.16 56.81 1psm n GLU 14 Cb 0.88 -1.63 -0.14 0.00 1.43 0.00 0.00 31.44 31.98 1psm n GLU 14 CO 0.00 0.00 0.00 0.94 -0.16 0.00 0.00 177.13 177.91 1psm n GLN 15 N -1.97 0.72 0.30 3.44 0.00 -1.15 -4.04 117.38 114.67 1psm n GLN 15 Ca 0.03 0.27 0.19 0.00 -0.00 0.00 0.00 57.00 57.50 1psm n GLN 15 Cb 0.42 -1.74 0.87 0.00 0.00 0.00 0.00 30.24 29.79 1psm n GLN 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1psm h ALA 16 N 0.38 1.01 0.00 1.69 0.00 -1.15 0.16 119.26 121.34 1psm h ALA 16 Ca -0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1psm h ALA 16 Cb 2.03 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.82 1psm h ALA 16 CO 0.09 0.01 -0.61 0.00 0.00 0.00 0.00 179.25 178.74 1psm h ALA 17 N 1.99 0.63 0.03 0.00 0.00 -1.75 -3.29 119.26 116.87 1psm h ALA 17 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.67 1psm h ALA 17 Cb 0.33 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1psm h ALA 17 CO 0.00 0.00 -1.20 0.87 0.00 0.00 0.00 179.25 178.92 1psm h LYS 18 N 0.00 0.07 -0.06 0.00 1.57 -0.84 -2.67 116.57 114.64 1psm h LYS 18 Ca 0.00 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1psm h LYS 18 Cb 0.82 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.18 1psm h LYS 18 CO 0.00 0.98 0.00 -3.47 -0.57 0.00 0.00 179.45 176.39 1psm n ASP 19 N -3.35 0.94 -0.00 0.86 2.03 -0.99 -0.35 116.55 115.69 1psm n ASP 19 Ca -0.06 -1.46 -0.18 0.00 0.52 0.00 0.00 54.79 53.61 1psm n ASP 19 Cb 0.98 -0.04 -0.14 0.00 -0.72 0.00 0.00 41.12 41.21 1psm n ASP 19 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1psm n ALA 20 N -0.21 1.04 -0.02 -1.67 0.00 -1.15 -4.24 120.51 114.26 1psm n ALA 20 Ca 0.18 -0.65 -0.21 0.00 0.00 0.00 0.00 53.44 52.76 1psm n ALA 20 Cb 0.23 -0.71 -0.13 0.00 0.00 0.00 0.00 19.45 18.84 1psm n ALA 20 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1psm h GLU 21 N 0.05 0.18 0.00 0.00 4.11 -1.12 -3.35 114.58 114.46 1psm h GLU 21 Ca -0.40 -0.30 0.00 0.00 0.07 0.00 0.00 59.36 58.74 1psm h GLU 21 Cb 2.03 0.11 0.00 0.00 0.50 0.00 0.00 28.75 31.39 1psm h GLU 21 CO 0.08 1.14 0.00 0.09 0.07 0.00 0.00 179.01 180.40 1psm n ASN 22 N -4.06 0.04 0.10 3.06 3.02 0.53 -2.40 115.26 115.55 1psm n ASN 22 Ca -0.25 0.51 -0.05 0.00 -0.03 0.00 0.00 54.58 54.76 1psm n ASN 22 Cb 0.83 -0.52 0.03 0.00 -0.61 0.00 0.00 39.78 39.51 1psm n ASN 22 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1psm h ALA 23 N 2.24 0.66 0.00 5.41 0.00 -1.74 -3.26 119.26 122.57 1psm h ALA 23 Ca 0.00 -0.71 -0.05 0.00 0.00 0.00 0.00 54.91 54.15 1psm h ALA 23 Cb 0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1psm h ALA 23 CO 0.00 0.96 -1.22 0.45 0.00 0.00 0.00 179.25 179.43 1psm n SER 24 N -3.63 0.76 0.26 0.00 2.88 -1.01 -4.50 113.62 108.38 1psm n SER 24 Ca -0.01 0.31 0.14 0.00 -1.33 0.00 0.00 58.87 57.97 1psm n SER 24 Cb 0.76 0.52 0.64 0.00 -0.75 0.00 0.00 64.21 65.39 1psm n SER 24 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1psm h LYS 25 N 0.00 0.00 0.00 -1.46 1.79 -1.60 -0.12 116.57 115.18 1psm h LYS 25 Ca -0.05 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.37 1psm h LYS 25 Cb 1.17 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.81 1psm h LYS 25 CO 0.01 0.11 -0.51 1.49 -1.08 0.00 0.00 179.45 179.48 1psm h GLU 26 N 0.00 0.00 0.12 3.15 4.81 -1.79 -3.21 114.58 117.66 1psm h GLU 26 Ca -0.00 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.86 1psm h GLU 26 Cb 0.54 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.90 1psm h GLU 26 CO 0.01 0.18 -2.01 0.00 -0.73 0.00 0.00 179.01 176.47 1psm n ALA 27 N -2.19 0.90 1.37 2.92 0.00 -0.26 -4.01 120.51 119.25 1psm n ALA 27 Ca 0.01 -0.60 0.12 0.00 0.00 0.00 0.00 53.44 52.97 1psm n ALA 27 Cb 0.63 -0.67 0.67 0.00 0.00 0.00 0.00 19.45 20.08 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 -3.48 0.61 0.05 0.00 1.02 -0.22 -3.22 120.64 115.41 1psm n GLU 28 Ca -0.32 0.02 -0.13 0.00 -0.02 0.00 0.00 57.16 56.71 1psm n GLU 28 Cb 1.05 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.83 1psm n GLU 28 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1psm h GLU 29 N 0.00 0.16 0.00 3.49 4.22 -1.68 -3.27 114.58 117.50 1psm h GLU 29 Ca 0.00 -0.27 0.00 0.00 0.08 0.00 0.00 59.36 59.17 1psm h GLU 29 Cb 0.07 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1psm h GLU 29 CO 0.00 1.01 -0.13 0.00 -2.18 0.00 0.00 179.01 177.71 1psm h ALA 30 N 0.68 0.92 0.00 2.92 0.00 -1.74 -2.19 119.26 119.86 1psm h ALA 30 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1psm h ALA 30 Cb 1.96 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1psm h ALA 30 CO 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 179.25 179.39 1psm h ALA 31 N 2.31 1.00 0.05 0.00 0.00 -1.69 -2.93 119.26 118.00 1psm h ALA 31 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1psm h ALA 31 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1psm h ALA 31 CO 0.00 0.00 -0.48 -0.22 0.00 0.00 0.00 179.25 178.55 1psm h LYS 32 N 0.00 0.11 -0.01 0.00 3.64 -1.44 -3.33 116.57 115.54 1psm h LYS 32 Ca 0.00 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 1psm h LYS 32 Cb 0.87 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 1psm h LYS 32 CO 0.00 1.09 -0.64 0.39 -2.27 0.00 0.00 179.45 178.02 1psm n GLU 33 N -4.39 0.88 -0.11 1.90 1.02 -1.20 -4.18 120.64 114.57 1psm n GLU 33 Ca -0.15 -0.66 -0.23 0.00 -0.02 0.00 0.00 57.16 56.11 1psm n GLU 33 Cb 0.64 -1.47 -0.11 0.00 -0.02 0.00 0.00 31.44 30.48 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 -0.52 0.86 0.81 0.62 0.00 -1.11 -4.78 120.51 116.39 1psm n ALA 34 Ca 0.07 -0.61 0.11 0.00 0.00 0.00 0.00 53.44 53.01 1psm n ALA 34 Cb 0.41 -0.41 -0.02 0.00 0.00 0.00 0.00 19.45 19.44 1psm n ALA 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1psm n VAL 35 N -4.40 0.04 -3.89 0.00 0.31 -1.25 -4.83 118.33 104.31 1psm n VAL 35 Ca -0.36 -0.10 -0.08 0.00 -0.01 0.00 0.00 64.34 63.79 1psm n VAL 35 Cb 0.71 0.57 -0.03 0.00 -0.91 0.00 0.00 33.84 34.18 1psm n VAL 35 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1psm s ASN 36 N -3.36 -0.21 -0.42 4.52 2.20 -1.26 -5.09 114.94 111.32 1psm s ASN 36 Ca 0.06 -0.70 0.09 0.00 -0.94 0.00 0.00 52.86 51.37 1psm s ASN 36 Cb 0.16 0.67 0.34 0.00 -2.00 0.00 0.00 41.25 40.42 1psm s ASN 36 CO 0.82 -1.26 0.98 0.18 -2.94 0.00 0.00 177.10 174.89 1psm n LEU 37 N -0.43 -1.06 -0.90 3.54 4.32 -1.26 -4.18 117.00 117.03 1psm n LEU 37 Ca -0.04 -4.17 0.11 0.00 -0.02 0.00 0.00 56.01 51.89 1psm n LEU 37 Cb 0.60 0.80 0.09 0.00 -1.62 0.00 0.00 43.42 43.30 1psm n LEU 37 CO 0.17 2.13 0.61 0.29 -1.22 0.00 0.00 177.39 179.37