#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 5.45 -3.82 0.62 0.00 -1.26 -4.86 120.51 116.64 1psm n ALA 2 Ca 0.00 -4.75 -0.03 0.00 0.00 0.00 0.00 53.44 48.67 1psm n ALA 2 Cb 0.00 -2.25 0.01 0.00 0.00 0.00 0.00 19.45 17.20 1psm n ALA 2 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1psm s TYR 3 N -3.30 -0.01 0.00 0.00 1.13 -1.26 -5.18 117.35 108.74 1psm s TYR 3 Ca 0.34 -0.34 0.00 0.00 -1.41 0.00 0.00 57.07 55.66 1psm s TYR 3 Cb 0.10 0.67 0.00 0.00 -1.10 0.00 0.00 41.96 41.63 1psm s TYR 3 CO 0.03 -0.85 0.00 1.63 -2.51 0.00 0.00 175.55 173.85 1psm n LYS 4 N -0.60 0.00 -0.53 -3.49 4.76 -1.26 -4.98 118.16 112.05 1psm n LYS 4 Ca -0.04 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.46 1psm n LYS 4 Cb 0.60 0.00 0.20 0.00 -1.84 0.00 0.00 35.03 33.99 1psm n LYS 4 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1psm n LYS 5 N 0.00 1.52 -3.34 1.97 5.02 -1.26 -4.90 118.16 117.17 1psm n LYS 5 Ca 0.00 -3.18 -0.38 0.00 -2.02 0.00 0.00 58.31 52.73 1psm n LYS 5 Cb 0.00 -1.58 -0.06 0.00 -0.02 0.00 0.00 35.03 33.37 1psm n LYS 5 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1psm s ALA 6 N -3.13 3.56 -0.11 7.82 0.00 -1.26 -5.03 121.76 123.60 1psm s ALA 6 Ca 0.37 -0.11 0.20 0.00 0.00 0.00 0.00 51.96 52.42 1psm s ALA 6 Cb 0.36 -2.59 -0.27 0.00 0.00 0.00 0.00 23.12 20.61 1psm s ALA 6 CO -0.06 0.25 0.37 0.36 0.00 0.00 0.00 175.76 176.69 1psm n LYS 7 N 2.55 0.67 0.00 0.00 2.85 -1.26 -4.95 118.16 118.02 1psm n LYS 7 Ca -0.10 -0.07 0.00 0.00 -1.05 0.00 0.00 58.31 57.09 1psm n LYS 7 Cb 0.51 -1.56 0.00 0.00 -0.65 0.00 0.00 35.03 33.34 1psm n LYS 7 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 1psm n GLN 8 N -2.52 0.00 0.00 -1.58 -0.06 -1.26 -5.12 117.38 106.84 1psm n GLN 8 Ca -0.16 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.84 1psm n GLN 8 Cb 0.82 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 27.00 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 0.00 0.00 -2.70 1.69 0.00 -1.26 -5.03 120.51 113.21 1psm n ALA 9 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1psm n ALA 9 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.53 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 -0.14 0.06 0.00 7.64 -1.26 -4.86 113.62 115.06 1psm n SER 10 Ca 0.00 -2.44 0.11 0.00 1.01 0.00 0.00 58.87 57.55 1psm n SER 10 Cb 0.00 0.20 -0.00 0.00 -1.01 0.00 0.00 64.21 63.39 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 -0.56 0.51 0.00 1.43 10.64 -1.26 -3.86 117.38 124.28 1psm n GLN 11 Ca 0.00 0.04 0.10 0.00 -1.83 0.00 0.00 57.00 55.32 1psm n GLN 11 Cb 0.84 -1.71 -0.07 0.00 -0.86 0.00 0.00 30.24 28.44 1psm n GLN 11 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1psm n ASP 12 N -2.38 1.43 -0.00 2.61 -0.08 -1.26 -3.88 116.55 112.99 1psm n ASP 12 Ca 0.00 -1.22 0.10 0.00 -1.51 0.00 0.00 54.79 52.17 1psm n ASP 12 Cb 0.51 0.77 -0.12 0.00 2.34 0.00 0.00 41.12 44.62 1psm n ASP 12 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1psm n ALA 13 N -0.85 3.91 0.06 -1.67 0.00 -1.25 -3.62 120.51 117.09 1psm n ALA 13 Ca 0.06 -0.55 -0.16 0.00 0.00 0.00 0.00 53.44 52.79 1psm n ALA 13 Cb 0.38 -0.78 -0.14 0.00 0.00 0.00 0.00 19.45 18.91 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 0.22 0.00 0.00 4.81 -1.71 -3.11 114.58 114.78 1psm h GLU 14 Ca 0.00 -0.37 -0.17 0.00 -0.13 0.00 0.00 59.36 58.69 1psm h GLU 14 Cb 0.71 0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.20 1psm h GLU 14 CO 0.00 1.07 -1.11 0.37 -0.73 0.00 0.00 179.01 178.61 1psm h GLN 15 N 0.06 0.00 0.00 1.92 -0.00 -1.74 -2.89 115.11 112.46 1psm h GLN 15 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.42 1psm h GLN 15 Cb 2.00 0.00 0.00 0.00 0.00 0.00 0.00 27.48 29.48 1psm h GLN 15 CO 0.15 0.47 0.00 0.00 0.00 0.00 0.00 178.83 179.45 1psm n ALA 16 N -2.35 2.20 0.01 3.38 0.00 -1.24 -1.79 120.51 120.71 1psm n ALA 16 Ca -0.06 -0.11 -0.04 0.00 0.00 0.00 0.00 53.44 53.24 1psm n ALA 16 Cb 0.84 -1.39 -0.11 0.00 0.00 0.00 0.00 19.45 18.79 1psm n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1psm n ALA 17 N -1.33 1.74 0.09 0.00 0.00 -1.10 -4.03 120.51 115.87 1psm n ALA 17 Ca 0.10 -0.66 -0.18 0.00 0.00 0.00 0.00 53.44 52.71 1psm n ALA 17 Cb 0.21 -0.89 -0.14 0.00 0.00 0.00 0.00 19.45 18.63 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 0.30 -0.12 0.00 1.57 -1.21 0.22 116.57 117.32 1psm h LYS 18 Ca -0.22 -0.52 0.00 0.00 -1.87 0.00 0.00 60.65 58.04 1psm h LYS 18 Cb 1.78 0.19 0.00 0.00 0.08 0.00 0.00 32.23 34.28 1psm h LYS 18 CO 0.06 1.21 0.00 -0.25 -0.57 0.00 0.00 179.45 179.90 1psm n ASP 19 N -3.53 1.66 -0.09 0.86 8.00 -0.89 -1.22 116.55 121.33 1psm n ASP 19 Ca -0.13 -1.65 -0.16 0.00 0.71 0.00 0.00 54.79 53.56 1psm n ASP 19 Cb 1.04 -0.07 -0.08 0.00 -0.02 0.00 0.00 41.12 41.99 1psm n ASP 19 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1psm n ALA 20 N 0.31 0.70 -0.31 2.24 0.00 -1.17 -4.63 120.51 117.64 1psm n ALA 20 Ca 0.17 -0.51 -0.03 0.00 0.00 0.00 0.00 53.44 53.08 1psm n ALA 20 Cb 0.34 -0.32 0.13 0.00 0.00 0.00 0.00 19.45 19.60 1psm n ALA 20 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1psm h GLU 21 N -1.00 1.20 0.00 0.00 5.08 -0.91 -3.16 114.58 115.80 1psm h GLU 21 Ca -0.25 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1psm h GLU 21 Cb 1.05 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1psm h GLU 21 CO -0.15 0.86 0.00 0.09 -1.00 0.00 0.00 179.01 178.81 1psm n ASN 22 N -4.35 0.38 0.11 1.42 3.02 -0.36 -1.91 115.26 113.57 1psm n ASN 22 Ca 0.10 0.65 -0.02 0.00 -0.03 0.00 0.00 54.58 55.27 1psm n ASN 22 Cb 0.07 -0.71 0.07 0.00 -0.61 0.00 0.00 39.78 38.60 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 2.10 0.70 0.01 5.41 0.00 -1.81 -3.32 119.26 122.36 1psm h ALA 23 Ca 0.00 -0.65 -0.30 0.00 0.00 0.00 0.00 54.91 53.95 1psm h ALA 23 Cb 0.09 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 1psm h ALA 23 CO 0.00 0.90 -1.78 0.43 0.00 0.00 0.00 179.25 178.80 1psm n SER 24 N -3.53 0.94 0.00 0.00 7.64 -0.80 -4.51 113.62 113.36 1psm n SER 24 Ca -0.00 0.37 0.01 0.00 1.01 0.00 0.00 58.87 60.25 1psm n SER 24 Cb 0.74 -0.08 0.03 0.00 -1.01 0.00 0.00 64.21 63.89 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 -3.07 0.01 -0.00 1.43 4.76 -1.08 -1.07 118.16 119.14 1psm n LYS 25 Ca -0.19 0.41 -0.00 0.00 -2.87 0.00 0.00 58.31 55.66 1psm n LYS 25 Cb 1.06 -1.50 -0.00 0.00 -1.84 0.00 0.00 35.03 32.75 1psm n LYS 25 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 1psm h GLU 26 N 0.00 -0.00 0.00 1.97 4.22 -1.79 -3.38 114.58 115.60 1psm h GLU 26 Ca 0.00 0.00 -0.21 0.00 0.08 0.00 0.00 59.36 59.23 1psm h GLU 26 Cb 0.02 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 1psm h GLU 26 CO 0.00 -0.00 -1.52 0.00 -2.18 0.00 0.00 179.01 175.31 1psm n ALA 27 N -2.01 1.78 0.70 2.92 0.00 -1.09 -3.04 120.51 119.76 1psm n ALA 27 Ca -0.00 -0.62 0.12 0.00 0.00 0.00 0.00 53.44 52.94 1psm n ALA 27 Cb 0.00 -0.92 0.17 0.00 0.00 0.00 0.00 19.45 18.70 1psm n ALA 27 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1psm n GLU 28 N -2.94 0.20 0.02 0.00 0.00 -0.23 -0.66 120.64 117.03 1psm n GLU 28 Ca -0.12 0.04 -0.03 0.00 0.00 0.00 0.00 57.16 57.06 1psm n GLU 28 Cb 0.92 -1.61 -0.10 0.00 0.00 0.00 0.00 31.44 30.65 1psm n GLU 28 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 1psm h GLU 29 N 0.00 0.00 0.19 5.31 4.81 -1.69 -3.23 114.58 119.98 1psm h GLU 29 Ca 0.00 0.00 -0.26 0.00 -0.13 0.00 0.00 59.36 58.97 1psm h GLU 29 Cb 0.67 0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.08 1psm h GLU 29 CO 0.00 0.37 -1.16 0.00 -0.73 0.00 0.00 179.01 177.49 1psm h ALA 30 N 1.29 -0.10 -0.39 2.92 0.00 -1.52 -3.14 119.26 118.33 1psm h ALA 30 Ca -0.19 -0.80 -0.27 0.00 0.00 0.00 0.00 54.91 53.65 1psm h ALA 30 Cb 1.70 0.17 -0.11 0.00 0.00 0.00 0.00 17.79 19.54 1psm h ALA 30 CO 0.06 0.55 0.33 0.00 0.00 0.00 0.00 179.25 180.19 1psm n ALA 31 N -2.71 5.02 -1.18 0.00 0.00 0.16 -3.55 120.51 118.24 1psm n ALA 31 Ca -0.16 -1.44 0.00 0.00 0.00 0.00 0.00 53.44 51.84 1psm n ALA 31 Cb 0.96 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 19.04 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 0.62 0.00 0.12 0.00 3.00 -1.22 -4.88 118.16 115.80 1psm n LYS 32 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.57 1psm n LYS 32 Cb 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.59 1psm n LYS 32 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 1psm h GLU 33 N 0.00 0.00 -0.58 1.64 4.81 -1.72 -0.99 114.58 117.75 1psm h GLU 33 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1psm h GLU 33 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1psm h GLU 33 CO 0.00 0.61 0.00 0.00 -0.73 0.00 0.00 179.01 178.89 1psm n ALA 34 N -2.26 2.82 0.01 2.92 0.00 -1.23 -3.98 120.51 118.79 1psm n ALA 34 Ca 0.01 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.55 1psm n ALA 34 Cb 0.79 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 19.22 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 0.57 0.21 -0.09 0.00 0.31 -0.89 -4.96 118.33 113.48 1psm n VAL 35 Ca 0.15 0.07 -0.10 0.00 -0.01 0.00 0.00 64.34 64.45 1psm n VAL 35 Cb 0.55 -0.97 -0.12 0.00 -0.91 0.00 0.00 33.84 32.40 1psm n VAL 35 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1psm n ASN 36 N -2.70 1.51 -0.19 4.52 0.23 -0.43 -5.01 115.26 113.20 1psm n ASN 36 Ca 0.00 -0.04 -0.02 0.00 -0.53 0.00 0.00 54.58 53.99 1psm n ASN 36 Cb 0.00 0.47 -0.00 0.00 -2.08 0.00 0.00 39.78 38.17 1psm n ASN 36 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 1psm n LEU 37 N -2.77 -0.63 0.00 -4.53 -0.00 -1.25 -5.09 117.00 102.74 1psm n LEU 37 Ca -0.30 0.02 0.00 0.00 -0.00 0.00 0.00 56.01 55.74 1psm n LEU 37 Cb 0.98 -0.73 0.00 0.00 -0.00 0.00 0.00 43.42 43.67 1psm n LEU 37 CO 0.29 -0.06 0.01 0.29 -0.00 0.00 0.00 177.39 177.93