#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 -0.48 -2.63 0.62 0.00 -1.26 -5.01 120.51 111.75 1psm n ALA 2 Ca 0.00 0.06 -0.42 0.00 0.00 0.00 0.00 53.44 53.09 1psm n ALA 2 Cb 0.00 -1.61 -0.05 0.00 0.00 0.00 0.00 19.45 17.79 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 -3.10 3.25 0.00 0.00 5.04 -1.26 -4.86 117.35 116.43 1psm s TYR 3 Ca 0.10 0.93 -0.04 0.00 -2.44 0.00 0.00 57.07 55.62 1psm s TYR 3 Cb -0.04 -3.11 0.01 0.00 0.35 0.00 0.00 41.96 39.17 1psm s TYR 3 CO 0.22 -0.47 0.19 1.17 -1.34 0.00 0.00 175.55 175.31 1psm n LYS 4 N 6.07 0.04 -3.55 4.97 0.00 -1.26 -5.09 118.16 119.34 1psm n LYS 4 Ca 0.04 -0.14 -0.28 0.00 0.00 0.00 0.00 58.31 57.93 1psm n LYS 4 Cb 0.48 0.21 -0.11 0.00 0.00 0.00 0.00 35.03 35.61 1psm n LYS 4 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1psm s LYS 5 N -2.00 1.10 0.00 1.64 2.20 -1.26 -4.93 119.74 116.49 1psm s LYS 5 Ca 0.04 -2.05 0.26 0.00 -0.36 0.00 0.00 55.97 53.87 1psm s LYS 5 Cb -0.00 -1.86 0.73 0.00 -1.51 0.00 0.00 37.83 35.19 1psm s LYS 5 CO 0.00 -1.28 1.55 0.00 -0.36 0.00 0.00 175.35 175.27 1psm n ALA 6 N 3.20 3.04 -2.95 3.13 0.00 -1.26 -4.86 120.51 120.81 1psm n ALA 6 Ca 0.19 -0.43 -0.21 0.00 0.00 0.00 0.00 53.44 52.99 1psm n ALA 6 Cb 0.40 -1.11 -0.02 0.00 0.00 0.00 0.00 19.45 18.72 1psm n ALA 6 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1psm s LYS 7 N -2.43 3.38 0.00 0.00 -2.85 -1.26 -4.77 119.74 111.81 1psm s LYS 7 Ca 0.26 -0.80 0.00 0.00 -1.00 0.00 0.00 55.97 54.43 1psm s LYS 7 Cb 0.19 -2.85 0.00 0.00 -2.06 0.00 0.00 37.83 33.11 1psm s LYS 7 CO 0.50 0.42 0.00 0.94 0.10 0.00 0.00 175.35 177.31 1psm n GLN 8 N -1.39 0.00 -0.13 1.78 7.27 -1.26 -5.07 117.38 118.59 1psm n GLN 8 Ca -0.09 0.00 -0.23 0.00 0.07 0.00 0.00 57.00 56.76 1psm n GLN 8 Cb 0.57 -0.67 -0.10 0.00 2.41 0.00 0.00 30.24 32.45 1psm n GLN 8 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1psm n ALA 9 N -0.43 1.40 0.00 1.69 0.00 -1.26 -5.07 120.51 116.84 1psm n ALA 9 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.41 1psm n ALA 9 Cb 0.13 0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.64 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 -3.70 0.00 -0.21 0.00 7.64 -1.26 -4.96 113.62 111.13 1psm n SER 10 Ca -0.47 0.00 0.26 0.00 1.01 0.00 0.00 58.87 59.67 1psm n SER 10 Cb 0.91 0.00 0.66 0.00 -1.01 0.00 0.00 64.21 64.77 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 0.11 -0.71 1.43 -0.00 -1.99 -0.33 115.11 113.62 1psm h GLN 11 Ca 0.00 -0.01 0.02 0.00 -0.00 0.00 0.00 58.65 58.66 1psm h GLN 11 Cb 0.00 -0.03 -0.04 0.00 -0.00 0.00 0.00 27.48 27.41 1psm h GLN 11 CO 0.00 0.08 0.46 -0.44 -0.00 0.00 0.00 178.83 178.93 1psm h ASP 12 N 0.12 0.77 0.42 0.06 5.19 -1.98 -0.12 116.42 120.89 1psm h ASP 12 Ca 0.45 -0.01 -0.20 0.00 -0.62 0.00 0.00 57.03 56.65 1psm h ASP 12 Cb 1.59 -0.18 -0.04 0.00 0.18 0.00 0.00 39.33 40.88 1psm h ASP 12 CO -0.06 0.55 -1.75 0.00 -3.12 0.00 0.00 179.24 174.85 1psm n ALA 13 N -2.31 1.94 0.13 3.45 0.00 -0.36 -2.09 120.51 121.27 1psm n ALA 13 Ca 0.07 -0.74 0.03 0.00 0.00 0.00 0.00 53.44 52.80 1psm n ALA 13 Cb 0.06 -0.74 0.02 0.00 0.00 0.00 0.00 19.45 18.78 1psm n ALA 13 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1psm h GLU 14 N 0.00 0.00 0.11 0.00 3.07 -1.11 -2.78 114.58 113.86 1psm h GLU 14 Ca -0.24 0.00 -0.35 0.00 -0.50 0.00 0.00 59.36 58.27 1psm h GLU 14 Cb 1.68 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.57 1psm h GLU 14 CO 0.04 0.43 -1.94 0.94 -1.40 0.00 0.00 179.01 177.08 1psm n GLN 15 N -3.15 0.74 0.15 2.33 0.00 -0.06 -3.68 117.38 113.71 1psm n GLN 15 Ca 0.00 0.27 0.03 0.00 -0.00 0.00 0.00 57.00 57.31 1psm n GLN 15 Cb 0.73 -1.73 0.14 0.00 0.00 0.00 0.00 30.24 29.38 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 0.24 0.77 -0.00 1.69 0.00 -1.51 -2.81 119.26 117.63 1psm h ALA 16 Ca -0.40 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.07 1psm h ALA 16 Cb 2.03 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1psm h ALA 16 CO 0.09 0.61 -0.42 0.00 0.00 0.00 0.00 179.25 179.53 1psm n ALA 17 N -2.26 3.40 0.07 0.00 0.00 -1.05 -3.28 120.51 117.40 1psm n ALA 17 Ca 0.01 -0.37 -0.22 0.00 0.00 0.00 0.00 53.44 52.86 1psm n ALA 17 Cb 0.66 -1.12 -0.15 0.00 0.00 0.00 0.00 19.45 18.84 1psm n ALA 17 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1psm h LYS 18 N 0.38 0.38 -0.01 0.00 3.64 -1.57 -0.53 116.57 118.86 1psm h LYS 18 Ca 0.00 -0.65 -0.18 0.00 -1.27 0.00 0.00 60.65 58.55 1psm h LYS 18 Cb 0.50 0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 1psm h LYS 18 CO 0.00 1.31 -0.79 0.22 -2.27 0.00 0.00 179.45 177.92 1psm h ASP 19 N -0.10 0.18 0.55 4.20 3.58 -1.70 -2.93 116.42 120.20 1psm h ASP 19 Ca -0.26 -0.13 -0.25 0.00 0.42 0.00 0.00 57.03 56.81 1psm h ASP 19 Cb 1.93 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 42.88 1psm h ASP 19 CO 0.17 0.90 -1.62 0.00 -2.88 0.00 0.00 179.24 175.81 1psm n ALA 20 N -2.44 1.64 0.23 -0.78 0.00 -1.21 -3.56 120.51 114.39 1psm n ALA 20 Ca -0.02 -0.70 0.12 0.00 0.00 0.00 0.00 53.44 52.83 1psm n ALA 20 Cb 0.75 -0.88 0.03 0.00 0.00 0.00 0.00 19.45 19.35 1psm n ALA 20 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1psm n GLU 21 N -2.99 0.52 0.08 0.00 1.02 -0.21 -4.32 120.64 114.74 1psm n GLU 21 Ca -0.15 0.10 -0.04 0.00 -0.02 0.00 0.00 57.16 57.05 1psm n GLU 21 Cb 0.98 -1.78 -0.07 0.00 -0.02 0.00 0.00 31.44 30.56 1psm n GLU 21 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1psm h ASN 22 N 0.00 0.00 0.67 1.62 2.35 -1.63 -3.24 115.58 115.35 1psm h ASN 22 Ca 0.00 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.67 1psm h ASN 22 Cb 0.93 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.29 1psm h ASN 22 CO 0.00 0.85 -0.39 0.00 -1.65 0.00 0.00 177.43 176.24 1psm h ALA 23 N 1.15 1.09 -0.00 -0.83 0.00 -1.75 -0.27 119.26 118.64 1psm h ALA 23 Ca -0.01 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1psm h ALA 23 Cb 1.64 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1psm h ALA 23 CO 0.11 0.49 -0.43 0.45 0.00 0.00 0.00 179.25 179.87 1psm n SER 24 N -3.69 0.79 -0.02 0.00 2.88 -1.25 -3.83 113.62 108.50 1psm n SER 24 Ca -0.01 -0.59 -0.07 0.00 -1.33 0.00 0.00 58.87 56.87 1psm n SER 24 Cb 0.48 0.25 -0.13 0.00 -0.75 0.00 0.00 64.21 64.06 1psm n SER 24 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1psm n LYS 25 N -1.11 0.63 0.00 -1.46 4.76 -0.72 -3.83 118.16 116.44 1psm n LYS 25 Ca 0.08 0.26 0.12 0.00 -2.87 0.00 0.00 58.31 55.90 1psm n LYS 25 Cb 0.34 -1.77 0.66 0.00 -1.84 0.00 0.00 35.03 32.42 1psm n LYS 25 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1psm n GLU 26 N -2.98 0.49 0.00 1.97 1.02 -0.19 -3.57 120.64 117.37 1psm n GLU 26 Ca -0.17 0.04 0.15 0.00 -0.02 0.00 0.00 57.16 57.16 1psm n GLU 26 Cb 1.01 -1.50 0.77 0.00 -0.02 0.00 0.00 31.44 31.70 1psm n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1psm n ALA 27 N -1.20 2.63 -0.36 0.62 0.00 -1.25 -4.20 120.51 116.75 1psm n ALA 27 Ca 0.14 -0.21 0.02 0.00 0.00 0.00 0.00 53.44 53.39 1psm n ALA 27 Cb 0.16 -1.44 0.17 0.00 0.00 0.00 0.00 19.45 18.34 1psm n ALA 27 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1psm h GLU 28 N 0.27 1.10 0.00 0.00 5.08 -1.82 0.23 114.58 119.45 1psm h GLU 28 Ca 0.00 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.21 1psm h GLU 28 Cb 0.23 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1psm h GLU 28 CO 0.00 0.73 -1.24 -0.85 -1.00 0.00 0.00 179.01 176.65 1psm n GLU 29 N -4.53 0.61 0.01 2.33 0.28 -1.26 -3.61 120.64 114.48 1psm n GLU 29 Ca 0.15 0.16 -0.19 0.00 -0.16 0.00 0.00 57.16 57.12 1psm n GLU 29 Cb 0.18 -1.81 -0.14 0.00 1.43 0.00 0.00 31.44 31.10 1psm n GLU 29 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1psm h ALA 30 N 1.70 0.45 -0.55 -1.84 0.00 -1.77 -3.33 119.26 113.92 1psm h ALA 30 Ca -0.09 -1.36 -0.38 0.00 0.00 0.00 0.00 54.91 53.09 1psm h ALA 30 Cb 1.30 0.61 -0.16 0.00 0.00 0.00 0.00 17.79 19.55 1psm h ALA 30 CO 0.02 1.31 0.48 0.00 0.00 0.00 0.00 179.25 181.06 1psm n ALA 31 N -2.89 5.36 -1.74 0.00 0.00 0.80 -3.90 120.51 118.14 1psm n ALA 31 Ca -0.27 -1.97 0.00 0.00 0.00 0.00 0.00 53.44 51.19 1psm n ALA 31 Cb 1.05 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 19.03 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 0.22 0.00 0.00 0.00 0.00 -1.24 -4.76 118.16 112.38 1psm n LYS 32 Ca 0.35 0.00 0.13 0.00 0.00 0.00 0.00 58.31 58.79 1psm n LYS 32 Cb 0.58 0.00 0.37 0.00 0.00 0.00 0.00 35.03 35.98 1psm n LYS 32 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1psm n GLU 33 N 0.00 0.37 -0.03 1.64 2.13 -1.26 -1.53 120.64 121.97 1psm n GLU 33 Ca 0.00 -0.19 -0.09 0.00 0.66 0.00 0.00 57.16 57.53 1psm n GLU 33 Cb 0.00 -1.50 -0.14 0.00 0.27 0.00 0.00 31.44 30.07 1psm n GLU 33 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1psm n ALA 34 N -1.15 1.46 -0.08 4.31 0.00 -1.25 -4.26 120.51 119.54 1psm n ALA 34 Ca 0.09 -0.81 -0.17 0.00 0.00 0.00 0.00 53.44 52.55 1psm n ALA 34 Cb 0.33 -0.78 -0.06 0.00 0.00 0.00 0.00 19.45 18.94 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 -3.04 0.91 0.06 0.00 0.31 -1.12 -4.74 118.33 110.71 1psm n VAL 35 Ca -0.19 -0.25 0.05 0.00 -0.01 0.00 0.00 64.34 63.93 1psm n VAL 35 Cb 1.06 -1.62 -0.07 0.00 -0.91 0.00 0.00 33.84 32.30 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 -3.62 2.51 0.00 4.52 0.23 -0.58 -5.03 115.26 113.28 1psm n ASN 36 Ca -0.32 -0.12 0.00 0.00 -0.53 0.00 0.00 54.58 53.61 1psm n ASN 36 Cb 0.74 1.35 0.00 0.00 -2.08 0.00 0.00 39.78 39.79 1psm n ASN 36 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1psm n LEU 37 N -1.72 0.00 0.00 -4.53 4.32 -0.78 -5.01 117.00 109.28 1psm n LEU 37 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.98 1psm n LEU 37 Cb 0.22 -0.17 0.00 0.00 -1.62 0.00 0.00 43.42 41.85 1psm n LEU 37 CO 0.19 0.00 0.04 1.17 -1.22 0.00 0.00 177.39 177.57