#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2df0 s LYS 2 N 0.00 2.98 0.41 0.38 2.20 -1.26 -5.06 119.74 119.39 2df0 s LYS 2 Ca 0.00 -1.08 -0.25 0.00 -0.36 0.00 0.00 55.97 54.28 2df0 s LYS 2 Cb 0.00 -4.02 -0.08 0.00 -1.51 0.00 0.00 37.83 32.22 2df0 s LYS 2 CO 0.00 -0.83 1.18 -1.25 -0.36 0.00 0.00 175.35 174.10 2df0 s PRO 3 N 1.71 3.98 -1.04 4.03 0.04 -1.26 -4.91 135.00 137.56 2df0 s PRO 3 Ca 0.05 1.86 -0.24 0.00 0.04 0.00 0.00 61.00 62.72 2df0 s PRO 3 Cb -0.20 -2.63 -0.06 0.00 0.04 0.00 0.00 34.50 31.65 2df0 s PRO 3 CO 0.09 -0.39 1.92 -1.21 0.04 0.00 0.00 177.00 177.46 2df0 s GLU 4 N -2.37 2.60 -0.24 4.56 8.01 -1.26 -4.67 118.70 125.33 2df0 s GLU 4 Ca 0.58 -0.74 -0.10 0.00 0.01 0.00 0.00 54.97 54.72 2df0 s GLU 4 Cb -0.31 -5.16 -0.16 0.00 -4.31 0.00 0.00 34.13 24.18 2df0 s GLU 4 CO 0.39 -3.57 -0.14 0.00 0.01 0.00 0.00 175.26 171.95 2df0 n ALA 5 N 13.84 1.15 -1.99 5.21 0.00 -1.26 -4.79 120.51 132.66 2df0 n ALA 5 Ca 0.42 -0.94 -0.28 0.00 0.00 0.00 0.00 53.44 52.65 2df0 n ALA 5 Cb 0.47 -0.15 -0.05 0.00 0.00 0.00 0.00 19.45 19.72 2df0 n ALA 5 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2df0 s PRO 6 N -2.49 2.47 -0.05 0.00 0.04 -1.26 -4.78 135.00 128.94 2df0 s PRO 6 Ca -0.34 -0.02 -0.03 0.00 0.04 0.00 0.00 61.00 60.65 2df0 s PRO 6 Cb 0.11 -4.91 -0.01 0.00 0.04 0.00 0.00 34.50 29.73 2df0 s PRO 6 CO 0.57 -3.35 -0.06 0.41 0.04 0.00 0.00 177.00 174.61 2df0 n GLY 7 N 6.62 -0.68 2.49 0.56 0.00 -1.26 -4.90 105.19 108.02 2df0 n GLY 7 Ca 0.37 -0.06 -0.21 0.00 0.00 0.00 0.00 46.02 46.13 2df0 n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2df0 s GLU 8 N -1.41 0.94 -0.08 1.61 2.02 -1.26 -5.02 118.70 115.50 2df0 s GLU 8 Ca -0.05 -1.81 -0.05 0.00 0.02 0.00 0.00 54.97 53.08 2df0 s GLU 8 Cb 0.01 -1.05 0.02 0.00 0.10 0.00 0.00 34.13 33.21 2df0 s GLU 8 CO 0.07 -1.37 0.10 -3.47 0.02 0.00 0.00 175.26 170.62 2df0 n ASP 9 N 2.91 -1.33 -1.92 -0.19 2.03 -1.26 -4.82 116.55 111.97 2df0 n ASP 9 Ca 0.26 0.56 -0.10 0.00 0.52 0.00 0.00 54.79 56.03 2df0 n ASP 9 Cb 0.50 -2.76 -0.14 0.00 -0.72 0.00 0.00 41.12 38.00 2df0 n ASP 9 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2df0 n ALA 10 N 0.71 5.96 -0.77 -1.67 0.00 -1.26 -4.96 120.51 118.52 2df0 n ALA 10 Ca -0.18 -1.52 0.00 0.00 0.00 0.00 0.00 53.44 51.74 2df0 n ALA 10 Cb 0.27 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.62 2df0 n ALA 10 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2df0 n SER 11 N 2.34 -4.10 -3.24 0.00 7.64 -1.26 -0.18 113.62 114.82 2df0 n SER 11 Ca 0.36 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 60.02 2df0 n SER 11 Cb 0.85 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 64.01 2df0 n SER 11 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2df0 n PRO 12 N -1.20 0.95 -3.18 1.43 -0.04 -1.26 -4.18 135.00 127.52 2df0 n PRO 12 Ca 0.00 -1.12 -0.15 0.00 -0.04 0.00 0.00 63.50 62.19 2df0 n PRO 12 Cb 0.00 -2.38 0.05 0.00 -0.04 0.00 0.00 33.50 31.13 2df0 n PRO 12 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2df0 n GLU 13 N 5.53 -5.11 0.00 0.54 -0.58 -1.12 -4.88 120.64 115.02 2df0 n GLU 13 Ca 0.30 0.55 0.07 0.00 -0.42 0.00 0.00 57.16 57.66 2df0 n GLU 13 Cb 0.18 -4.72 0.44 0.00 -0.57 0.00 0.00 31.44 26.76 2df0 n GLU 13 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2df0 n GLU 14 N -3.40 0.90 0.00 3.49 1.02 0.75 -2.21 120.64 121.18 2df0 n GLU 14 Ca -0.02 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.17 2df0 n GLU 14 Cb 0.55 -1.26 0.01 0.00 -0.02 0.00 0.00 31.44 30.73 2df0 n GLU 14 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2df0 n LEU 15 N -0.76 1.48 -0.21 -4.62 7.94 -1.25 -4.64 117.00 114.95 2df0 n LEU 15 Ca 0.11 -0.83 -0.05 0.00 -1.11 0.00 0.00 56.01 54.13 2df0 n LEU 15 Cb 0.05 0.00 0.05 0.00 0.53 0.00 0.00 43.42 44.05 2df0 n LEU 15 CO 0.08 0.29 1.11 -1.13 -1.11 0.00 0.00 177.39 176.63 2df0 h ASN 16 N 1.54 0.64 1.05 1.96 -0.73 -1.80 -0.43 115.58 117.82 2df0 h ASN 16 Ca 0.00 -0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.16 2df0 h ASN 16 Cb 0.41 -0.15 0.00 0.00 0.27 0.00 0.00 38.32 38.86 2df0 h ASN 16 CO 0.00 0.45 -0.03 0.54 -0.37 0.00 0.00 177.43 178.02 2df0 n ARG 17 N -4.71 0.05 -0.06 6.67 5.12 -1.26 -1.07 116.66 121.40 2df0 n ARG 17 Ca 0.05 0.04 -0.16 0.00 -1.93 0.00 0.00 57.85 55.85 2df0 n ARG 17 Cb 0.05 -1.55 -0.06 0.00 -1.16 0.00 0.00 32.46 29.74 2df0 n ARG 17 CO 0.00 0.00 0.00 -0.92 -1.93 0.00 0.00 177.63 174.78 2df0 h TYR 18 N 0.00 1.07 0.00 -1.55 3.20 -1.39 0.40 116.97 118.70 2df0 h TYR 18 Ca 0.00 -0.42 -0.08 0.00 3.14 0.00 0.00 58.73 61.37 2df0 h TYR 18 Cb 0.54 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 2df0 h TYR 18 CO 0.00 1.25 -0.37 1.88 -1.64 0.00 0.00 178.16 179.28 2df0 h TYR 19 N 0.59 0.00 0.08 -3.82 0.05 -0.79 0.38 116.97 113.46 2df0 h TYR 19 Ca -0.01 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.62 2df0 h TYR 19 Cb 1.24 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.99 2df0 h TYR 19 CO 0.08 0.37 -0.72 0.00 -1.05 0.00 0.00 178.16 176.84 2df0 h ALA 20 N 1.63 0.02 -0.05 3.88 0.00 -0.95 0.21 119.26 124.00 2df0 h ALA 20 Ca -0.00 -0.76 -0.11 0.00 0.00 0.00 0.00 54.91 54.04 2df0 h ALA 20 Cb 0.82 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2df0 h ALA 20 CO 0.05 0.38 -0.48 0.66 0.00 0.00 0.00 179.25 179.86 2df0 h SER 21 N -0.61 0.14 0.29 0.00 4.64 -0.22 0.35 113.55 118.14 2df0 h SER 21 Ca -0.15 -0.06 -0.14 0.00 -0.47 0.00 0.00 61.79 60.97 2df0 h SER 21 Cb 1.44 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.48 2df0 h SER 21 CO 0.06 0.60 -0.56 0.25 -0.87 0.00 0.00 176.83 176.30 2df0 h LEU 22 N 0.10 0.32 -0.93 5.97 5.85 -0.99 -1.44 115.31 124.19 2df0 h LEU 22 Ca 0.00 -0.17 -0.11 0.00 0.84 0.00 0.00 57.88 58.44 2df0 h LEU 22 Cb 0.89 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 2df0 h LEU 22 CO 0.07 0.81 -0.50 -0.09 -0.34 0.00 0.00 178.44 178.39 2df0 h ARG 23 N 0.22 0.09 -0.39 1.25 2.43 0.61 0.33 114.38 118.92 2df0 h ARG 23 Ca 0.00 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.02 2df0 h ARG 23 Cb 1.06 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.59 2df0 h ARG 23 CO 0.09 0.57 -0.18 1.25 -1.51 0.00 0.00 179.97 180.19 2df0 h HIS 24 N 0.07 0.81 -0.47 2.20 2.76 -0.11 0.44 115.15 120.86 2df0 h HIS 24 Ca 0.00 -0.17 -0.04 0.00 -2.20 0.00 0.00 60.37 57.97 2df0 h HIS 24 Cb 0.91 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.65 2df0 h HIS 24 CO 0.01 0.85 0.15 -0.92 -1.30 0.00 0.00 177.93 176.73 2df0 h TYR 25 N 0.65 0.75 0.25 5.26 3.20 -0.64 -1.20 116.97 125.24 2df0 h TYR 25 Ca 0.10 -0.07 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 2df0 h TYR 25 Cb 0.66 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.72 2df0 h TYR 25 CO 0.03 0.66 -0.12 -0.07 -1.64 0.00 0.00 178.16 177.02 2df0 h LEU 26 N 0.62 -0.29 -0.99 2.82 3.38 -0.05 -0.20 115.31 120.60 2df0 h LEU 26 Ca 0.15 -0.06 0.29 0.00 0.09 0.00 0.00 57.88 58.36 2df0 h LEU 26 Cb 0.25 0.07 -0.14 0.00 0.09 0.00 0.00 40.66 40.94 2df0 h LEU 26 CO -0.01 -0.13 0.55 -1.13 0.09 0.00 0.00 178.44 177.82 2df0 h ASN 27 N -0.43 0.53 0.35 -0.43 -1.24 -0.05 -1.12 115.58 113.19 2df0 h ASN 27 Ca -0.03 0.17 -0.02 0.00 0.71 0.00 0.00 56.30 57.13 2df0 h ASN 27 Cb 0.33 0.11 0.00 0.00 0.73 0.00 0.00 38.32 39.49 2df0 h ASN 27 CO 0.06 -0.06 -0.17 0.25 -1.29 0.00 0.00 177.43 176.22 2df0 h LEU 28 N 0.40 -0.40 -1.63 0.34 5.85 -0.70 -3.28 115.31 115.88 2df0 h LEU 28 Ca 0.69 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 59.26 2df0 h LEU 28 Cb 1.49 0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.62 2df0 h LEU 28 CO -0.57 0.01 0.03 -0.37 -0.34 0.00 0.00 178.44 177.20 2df0 h VAL 29 N -0.90 0.00 0.00 1.05 -1.51 0.21 1.12 116.25 116.22 2df0 h VAL 29 Ca -0.05 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.42 2df0 h VAL 29 Cb 0.53 0.54 0.00 0.00 -2.13 0.00 0.00 31.29 30.24 2df0 h VAL 29 CO 0.08 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.77 2df0 n THR 30 N -2.38 1.30 -0.08 7.19 -2.24 -0.90 -0.18 114.28 117.00 2df0 n THR 30 Ca -0.02 0.33 -0.07 0.00 -2.27 0.00 0.00 64.05 62.02 2df0 n THR 30 Cb 0.07 -1.20 -0.00 0.00 -2.10 0.00 0.00 70.33 67.09 2df0 n THR 30 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2df0 h ARG 31 N 0.00 -0.13 0.00 -0.78 9.65 0.11 -3.35 114.38 119.89 2df0 h ARG 31 Ca 0.00 0.01 -0.11 0.00 -1.10 0.00 0.00 59.98 58.78 2df0 h ARG 31 Cb 0.11 0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 28.70 2df0 h ARG 31 CO 0.00 -0.09 -1.43 0.00 2.80 0.00 0.00 179.97 181.25 2df0 n GLN 32 N -5.34 0.51 0.00 0.20 -0.00 -1.16 -5.02 117.38 106.57 2df0 n GLN 32 Ca 0.00 0.04 0.00 0.00 -0.00 0.00 0.00 57.00 57.04 2df0 n GLN 32 Cb 0.25 -1.15 0.00 0.00 -0.00 0.00 0.00 30.24 29.34 2df0 n GLN 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 2df0 n ARG 33 N -2.67 0.00 -0.45 2.61 1.74 0.75 -5.17 116.66 113.48 2df0 n ARG 33 Ca -0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 2df0 n ARG 33 Cb 0.65 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.09 2df0 n ARG 33 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77