#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d49 s THR 2 N 0.00 1.83 -0.28 0.00 -1.32 -1.26 -5.02 115.64 109.58 2d49 s THR 2 Ca 0.00 -1.27 -0.26 0.00 -1.21 0.00 0.00 61.69 58.95 2d49 s THR 2 Cb 0.00 -1.58 0.17 0.00 -1.51 0.00 0.00 72.50 69.58 2d49 s THR 2 CO 0.00 0.26 1.32 0.00 -2.21 0.00 0.00 174.62 173.99 2d49 s ALA 4 N -0.28 3.67 0.21 0.00 0.00 -1.26 -5.03 121.76 119.07 2d49 s ALA 4 Ca 0.06 -0.63 -0.32 0.00 0.00 0.00 0.00 51.96 51.08 2d49 s ALA 4 Cb -0.04 -2.23 -0.12 0.00 0.00 0.00 0.00 23.12 20.73 2d49 s ALA 4 CO -0.11 0.28 1.69 -2.37 0.00 0.00 0.00 175.76 175.25 2d49 n THR 5 N -0.90 0.12 -1.51 0.00 5.66 -1.26 -2.91 114.28 113.48 2d49 n THR 5 Ca -0.02 -0.03 -0.41 0.00 -3.05 0.00 0.00 64.05 60.53 2d49 n THR 5 Cb 0.54 -1.93 0.01 0.00 -1.55 0.00 0.00 70.33 67.40 2d49 n THR 5 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2d49 n ALA 6 N 3.69 -0.85 -1.57 1.79 0.00 -1.26 -1.90 120.51 120.41 2d49 n ALA 6 Ca 0.15 0.18 -0.43 0.00 0.00 0.00 0.00 53.44 53.34 2d49 n ALA 6 Cb 0.34 -1.90 0.00 0.00 0.00 0.00 0.00 19.45 17.90 2d49 n ALA 6 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 2d49 n TRP 7 N -0.79 0.83 -3.66 0.00 -0.00 -0.94 -4.66 117.44 108.21 2d49 n TRP 7 Ca 0.11 0.63 -0.26 0.00 -0.00 0.00 0.00 57.50 57.98 2d49 n TRP 7 Cb 0.40 -2.18 -0.17 0.00 -0.00 0.00 0.00 31.31 29.36 2d49 n TRP 7 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 2d49 s SER 8 N -0.73 2.39 0.01 5.87 0.15 -1.26 -4.99 113.70 115.14 2d49 s SER 8 Ca 0.62 -0.60 0.17 0.00 0.70 0.00 0.00 55.95 56.84 2d49 s SER 8 Cb -0.62 -0.35 0.71 0.00 -1.71 0.00 0.00 66.02 64.04 2d49 s SER 8 CO 0.58 -0.32 1.53 -1.54 1.20 0.00 0.00 173.24 174.69 2d49 n SER 9 N 5.20 0.03 0.25 5.45 3.41 -1.26 -2.56 113.62 124.14 2d49 n SER 9 Ca -0.07 0.51 0.13 0.00 -0.26 0.00 0.00 58.87 59.17 2d49 n SER 9 Cb 0.49 -0.51 0.65 0.00 -0.26 0.00 0.00 64.21 64.57 2d49 n SER 9 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2d49 h SER 10 N 0.00 0.00 -4.80 4.04 4.64 -2.01 -3.41 113.55 112.01 2d49 h SER 10 Ca 0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 2d49 h SER 10 Cb 0.29 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.19 2d49 h SER 10 CO 0.00 0.14 -0.71 -0.55 -0.87 0.00 0.00 176.83 174.83 2d49 s SER 11 N -6.05 0.80 0.31 4.97 0.15 -1.06 -5.10 113.70 107.73 2d49 s SER 11 Ca -0.01 -0.70 -0.16 0.00 0.70 0.00 0.00 55.95 55.78 2d49 s SER 11 Cb 0.11 0.08 -0.09 0.00 -1.71 0.00 0.00 66.02 64.41 2d49 s SER 11 CO 0.59 -0.32 0.75 0.68 1.20 0.00 0.00 173.24 176.14 2d49 s VAL 12 N -2.21 4.63 -0.07 4.45 -7.23 -1.26 -4.68 120.40 114.04 2d49 s VAL 12 Ca -0.04 1.05 0.01 0.00 -1.81 0.00 0.00 61.98 61.20 2d49 s VAL 12 Cb -0.04 -3.65 -0.03 0.00 0.56 0.00 0.00 36.38 33.22 2d49 s VAL 12 CO -0.02 -0.13 -0.09 -0.31 -0.31 0.00 0.00 175.10 174.24 2d49 s TYR 13 N -1.92 2.86 0.56 2.82 2.02 -0.67 -4.97 117.35 118.05 2d49 s TYR 13 Ca 0.53 -0.11 0.05 0.00 -0.37 0.00 0.00 57.07 57.17 2d49 s TYR 13 Cb -0.11 -1.71 0.05 0.00 -0.40 0.00 0.00 41.96 39.78 2d49 s TYR 13 CO 0.18 0.22 0.42 0.25 -1.57 0.00 0.00 175.55 175.04 2d49 n THR 14 N 2.44 0.00 -1.64 -0.71 -2.24 -1.26 -0.42 114.28 110.45 2d49 n THR 14 Ca -0.18 -2.21 -0.47 0.00 -2.27 0.00 0.00 64.05 58.92 2d49 n THR 14 Cb 0.53 -0.02 -0.04 0.00 -2.10 0.00 0.00 70.33 68.70 2d49 n THR 14 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2d49 n ASN 15 N -1.83 2.38 0.00 3.42 6.94 -1.25 -0.97 115.26 123.96 2d49 n ASN 15 Ca -0.02 1.12 0.00 0.00 -0.02 0.00 0.00 54.58 55.66 2d49 n ASN 15 Cb 0.63 -1.34 0.00 0.00 -2.36 0.00 0.00 39.78 36.72 2d49 n ASN 15 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2d49 n GLY 16 N 2.65 2.91 3.49 4.83 0.00 -1.25 -4.94 105.19 112.87 2d49 n GLY 16 Ca 0.16 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.68 2d49 n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d49 n GLY 17 N -0.26 0.66 3.89 -0.02 0.00 -0.14 -4.77 105.19 104.54 2d49 n GLY 17 Ca 0.00 0.90 -0.34 0.00 0.00 0.00 0.00 46.02 46.58 2d49 n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d49 s THR 18 N 7.17 5.44 0.22 2.61 2.01 -1.26 -2.53 115.64 129.30 2d49 s THR 18 Ca 1.07 -0.05 0.03 0.00 0.31 0.00 0.00 61.69 63.04 2d49 s THR 18 Cb -0.76 -3.49 -0.01 0.00 0.01 0.00 0.00 72.50 68.25 2d49 s THR 18 CO 0.47 0.42 0.24 1.33 -0.69 0.00 0.00 174.62 176.39 2d49 n VAL 19 N 1.28 0.00 -4.30 3.82 0.24 0.23 -4.15 118.33 115.44 2d49 n VAL 19 Ca -0.14 -1.42 -0.23 0.00 -2.04 0.00 0.00 64.34 60.51 2d49 n VAL 19 Cb 0.53 0.77 -0.12 0.00 -1.47 0.00 0.00 33.84 33.55 2d49 n VAL 19 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2d49 s SER 20 N -2.48 2.58 -0.30 -1.34 0.15 -0.80 -0.38 113.70 111.13 2d49 s SER 20 Ca 0.23 -0.73 -0.23 0.00 0.70 0.00 0.00 55.95 55.92 2d49 s SER 20 Cb 0.00 -0.14 0.18 0.00 -1.71 0.00 0.00 66.02 64.36 2d49 s SER 20 CO 0.17 0.04 1.36 -0.47 1.20 0.00 0.00 173.24 175.53 2d49 s TYR 21 N -1.38 -0.12 -1.93 3.44 5.04 0.53 -2.21 117.35 120.72 2d49 s TYR 21 Ca 0.09 0.28 0.00 0.00 -2.44 0.00 0.00 57.07 55.00 2d49 s TYR 21 Cb -0.09 0.40 0.00 0.00 0.35 0.00 0.00 41.96 42.62 2d49 s TYR 21 CO 0.05 -0.06 0.00 -1.71 -1.34 0.00 0.00 175.55 172.49 2d49 n ASN 22 N 1.95 -5.29 0.00 4.32 5.15 -1.26 -0.94 115.26 119.18 2d49 n ASN 22 Ca -0.12 0.38 0.00 0.00 -0.60 0.00 0.00 54.58 54.25 2d49 n ASN 22 Cb 0.57 -4.43 0.00 0.00 -0.53 0.00 0.00 39.78 35.38 2d49 n ASN 22 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2d49 n GLY 23 N -0.72 1.29 1.45 8.20 0.00 -1.26 -5.02 105.19 109.12 2d49 n GLY 23 Ca -0.19 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 2d49 n GLY 23 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d49 n ARG 24 N -2.00 1.32 -4.86 1.61 3.00 -0.12 -0.91 116.66 114.69 2d49 n ARG 24 Ca 0.00 -1.37 -0.33 0.00 -0.01 0.00 0.00 57.85 56.14 2d49 n ARG 24 Cb 0.00 0.24 -0.16 0.00 0.00 0.00 0.00 32.46 32.54 2d49 n ARG 24 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 2d49 s ASN 25 N -2.18 3.35 -0.18 0.55 0.01 -0.77 -0.34 114.94 115.37 2d49 s ASN 25 Ca 0.07 -0.52 -0.05 0.00 -0.71 0.00 0.00 52.86 51.65 2d49 s ASN 25 Cb -0.01 -1.48 -0.03 0.00 0.41 0.00 0.00 41.25 40.14 2d49 s ASN 25 CO 0.05 0.12 0.01 -0.31 -1.51 0.00 0.00 177.10 175.46 2d49 s TYR 26 N 0.57 3.11 -0.20 2.20 2.02 0.49 -0.08 117.35 125.46 2d49 s TYR 26 Ca -0.12 -0.20 -0.02 0.00 -0.37 0.00 0.00 57.07 56.37 2d49 s TYR 26 Cb -0.16 -2.04 -0.00 0.00 -0.40 0.00 0.00 41.96 39.35 2d49 s TYR 26 CO 0.04 -0.02 -0.10 0.99 -1.57 0.00 0.00 175.55 174.89 2d49 s THR 27 N 0.55 2.99 0.98 -0.71 2.01 0.50 -0.60 115.64 121.36 2d49 s THR 27 Ca -0.00 -0.63 -0.12 0.00 0.31 0.00 0.00 61.69 61.24 2d49 s THR 27 Cb -0.14 -2.32 0.18 0.00 0.01 0.00 0.00 72.50 70.23 2d49 s THR 27 CO 0.02 0.47 1.11 0.00 -0.69 0.00 0.00 174.62 175.52 2d49 s ALA 28 N 1.26 1.16 -0.03 7.40 0.00 -1.05 -2.46 121.76 128.03 2d49 s ALA 28 Ca 0.03 -0.44 0.05 0.00 0.00 0.00 0.00 51.96 51.61 2d49 s ALA 28 Cb -0.14 -3.08 -0.08 0.00 0.00 0.00 0.00 23.12 19.81 2d49 s ALA 28 CO -0.04 -2.71 0.08 1.63 0.00 0.00 0.00 175.76 174.72 2d49 n LYS 29 N -4.08 1.46 -2.79 0.00 4.76 -1.09 -3.81 118.16 112.61 2d49 n LYS 29 Ca 0.05 -0.03 -0.03 0.00 -2.87 0.00 0.00 58.31 55.43 2d49 n LYS 29 Cb 0.58 -1.14 0.01 0.00 -1.84 0.00 0.00 35.03 32.64 2d49 n LYS 29 CO 0.00 0.00 0.00 -2.67 -1.37 0.00 0.00 177.40 173.36 2d49 n TRP 30 N -1.92 -1.31 -1.63 2.13 2.14 -1.26 -4.47 117.44 111.11 2d49 n TRP 30 Ca -0.05 -0.88 -0.49 0.00 2.07 0.00 0.00 57.50 58.15 2d49 n TRP 30 Cb 0.38 0.43 -0.05 0.00 -0.81 0.00 0.00 31.31 31.26 2d49 n TRP 30 CO 0.00 0.00 0.00 1.87 2.07 0.00 0.00 177.69 181.63 2d49 n TRP 31 N -0.39 1.86 -3.74 -2.67 -0.00 -1.26 -3.88 117.44 107.36 2d49 n TRP 31 Ca -0.03 0.47 -0.13 0.00 -0.00 0.00 0.00 57.50 57.81 2d49 n TRP 31 Cb 0.35 -2.43 -0.10 0.00 -0.00 0.00 0.00 31.31 29.13 2d49 n TRP 31 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 177.69 177.61 2d49 s THR 32 N 0.74 -0.00 0.58 5.87 -1.32 0.44 -4.98 115.64 116.97 2d49 s THR 32 Ca 0.82 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 61.27 2d49 s THR 32 Cb -0.83 -0.55 0.12 0.00 -1.51 0.00 0.00 72.50 69.72 2d49 s THR 32 CO 0.43 0.00 0.79 1.67 -2.21 0.00 0.00 174.62 175.30 2d49 n GLN 33 N 2.88 -0.17 -1.51 7.08 0.00 -1.26 -1.66 117.38 122.74 2d49 n GLN 33 Ca -0.13 -1.85 -0.41 0.00 -0.00 0.00 0.00 57.00 54.60 2d49 n GLN 33 Cb 0.57 -0.61 -0.08 0.00 0.00 0.00 0.00 30.24 30.12 2d49 n GLN 33 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 2d49 n ASN 34 N -3.11 1.66 -3.89 1.69 0.23 -1.26 -4.83 115.26 105.75 2d49 n ASN 34 Ca 0.12 -0.07 -0.11 0.00 -0.53 0.00 0.00 54.58 53.99 2d49 n ASN 34 Cb 0.43 -1.30 -0.12 0.00 -2.08 0.00 0.00 39.78 36.70 2d49 n ASN 34 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2d49 s GLU 35 N 7.99 0.21 -0.18 -3.83 2.02 -1.26 -5.06 118.70 118.59 2d49 s GLU 35 Ca 1.13 -0.20 -0.29 0.00 0.02 0.00 0.00 54.97 55.63 2d49 s GLU 35 Cb -0.67 0.08 -0.05 0.00 0.10 0.00 0.00 34.13 33.59 2d49 s GLU 35 CO 0.39 -0.04 2.04 1.03 0.02 0.00 0.00 175.26 178.70 2d49 s ARG 36 N -0.65 3.45 0.44 1.61 3.00 -1.26 -4.95 118.95 120.58 2d49 s ARG 36 Ca -0.07 2.03 -0.24 0.00 0.00 0.00 0.00 55.73 57.45 2d49 s ARG 36 Cb -0.04 -4.27 -0.08 0.00 0.00 0.00 0.00 34.95 30.56 2d49 s ARG 36 CO 0.00 -1.74 1.17 -1.25 0.00 0.00 0.00 175.30 173.49 2d49 s PRO 37 N 5.67 3.87 0.00 3.54 0.04 -1.26 -3.23 135.00 143.63 2d49 s PRO 37 Ca 0.92 1.82 0.00 0.00 0.04 0.00 0.00 61.00 63.78 2d49 s PRO 37 Cb -0.33 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 31.69 2d49 s PRO 37 CO 0.35 -0.47 0.00 0.41 0.04 0.00 0.00 177.00 177.34 2d49 n GLY 38 N 0.52 3.13 0.06 0.56 0.00 -1.26 -4.77 105.19 103.44 2d49 n GLY 38 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2d49 n GLY 38 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2d49 n THR 39 N -1.21 0.70 -3.98 2.61 -1.04 -1.20 -4.95 114.28 105.20 2d49 n THR 39 Ca 0.00 -0.68 -0.33 0.00 -2.04 0.00 0.00 64.05 61.01 2d49 n THR 39 Cb 0.00 -0.23 -0.06 0.00 -1.82 0.00 0.00 70.33 68.22 2d49 n THR 39 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2d49 s SER 40 N -4.99 6.06 0.60 8.00 0.01 -1.22 -4.99 113.70 117.16 2d49 s SER 40 Ca -0.09 0.23 0.37 0.00 1.31 0.00 0.00 55.95 57.77 2d49 s SER 40 Cb 0.10 -1.82 1.91 0.00 0.21 0.00 0.00 66.02 66.42 2d49 s SER 40 CO 0.86 0.24 2.21 0.44 0.41 0.00 0.00 173.24 177.41 2d49 h ASP 41 N 3.73 0.00 -0.64 2.44 5.19 -1.95 -2.27 116.42 122.93 2d49 h ASP 41 Ca -0.48 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 55.92 2d49 h ASP 41 Cb 1.18 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.66 2d49 h ASP 41 CO 0.68 0.03 0.36 1.62 -3.12 0.00 0.00 179.24 178.80 2d49 h VAL 42 N 0.00 1.20 -3.55 -1.35 3.04 -1.96 -3.40 116.25 110.23 2d49 h VAL 42 Ca -0.00 -0.50 -0.63 0.00 -1.01 0.00 0.00 66.70 64.55 2d49 h VAL 42 Cb 0.19 0.31 -0.19 0.00 -2.01 0.00 0.00 31.29 29.59 2d49 h VAL 42 CO 0.00 0.22 -0.58 0.26 -1.01 0.00 0.00 177.57 176.47 2d49 s TRP 43 N -5.61 3.17 -0.04 3.17 0.52 -0.85 -2.69 118.94 116.61 2d49 s TRP 43 Ca -0.10 -0.13 0.02 0.00 0.02 0.00 0.00 56.10 55.91 2d49 s TRP 43 Cb 0.17 -2.20 0.01 0.00 -1.15 0.00 0.00 33.47 30.30 2d49 s TRP 43 CO 0.79 -0.12 -0.10 0.00 0.02 0.00 0.00 176.95 177.53 2d49 s ALA 44 N 1.14 1.05 0.03 0.98 0.00 -1.03 -4.16 121.76 119.77 2d49 s ALA 44 Ca 0.05 -0.36 -0.32 0.00 0.00 0.00 0.00 51.96 51.33 2d49 s ALA 44 Cb -0.14 -0.44 -0.10 0.00 0.00 0.00 0.00 23.12 22.43 2d49 s ALA 44 CO 0.04 0.13 1.90 -0.40 0.00 0.00 0.00 175.76 177.42 2d49 n ASP 45 N 3.56 3.87 -0.82 0.00 5.75 -1.26 -0.37 116.55 127.28 2d49 n ASP 45 Ca -0.21 0.95 0.09 0.00 -0.01 0.00 0.00 54.79 55.61 2d49 n ASP 45 Cb 0.53 -1.48 0.25 0.00 -1.03 0.00 0.00 41.12 39.39 2d49 n ASP 45 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 2d49 n LYS 46 N 6.63 2.81 -1.29 0.11 4.81 0.88 -4.86 118.16 127.25 2d49 n LYS 46 Ca 0.20 -2.80 0.00 0.00 -0.87 0.00 0.00 58.31 54.84 2d49 n LYS 46 Cb 0.36 -1.80 0.00 0.00 0.02 0.00 0.00 35.03 33.61 2d49 n LYS 46 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2d49 n GLY 47 N -0.55 0.46 3.51 3.14 0.00 -1.23 -4.96 105.19 105.56 2d49 n GLY 47 Ca 0.21 -1.64 -0.25 0.00 0.00 0.00 0.00 46.02 44.34 2d49 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d49 s ALA 48 N -1.00 2.82 -0.16 4.61 0.00 -1.26 -1.84 121.76 124.92 2d49 s ALA 48 Ca 0.00 -1.75 -0.05 0.00 0.00 0.00 0.00 51.96 50.16 2d49 s ALA 48 Cb 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 2d49 s ALA 48 CO 0.00 0.32 -0.00 0.00 0.00 0.00 0.00 175.76 176.08 2d49 s GLY 50 N 0.31 2.04 0.05 0.00 0.00 -0.98 -4.73 107.32 104.00 2d49 s GLY 50 Ca -0.01 -2.54 0.03 0.00 0.00 0.00 0.00 44.72 42.20 2d49 s GLY 50 CO 0.02 1.40 0.01 -0.51 0.00 0.00 0.00 173.10 174.02 2d49 s THR 51 N 1.89 4.14 -0.13 0.90 -4.23 -1.26 -3.95 115.64 112.99 2d49 s THR 51 Ca 0.10 -0.80 -0.02 0.00 -1.18 0.00 0.00 61.69 59.79 2d49 s THR 51 Cb -0.24 -2.92 -0.02 0.00 1.34 0.00 0.00 72.50 70.66 2d49 s THR 51 CO 0.02 0.22 -0.08 -0.83 -0.54 0.00 0.00 174.62 173.41 2d49 s GLY 52 N -2.02 1.64 0.00 3.99 0.00 -1.26 -5.05 107.32 104.62 2d49 s GLY 52 Ca 0.24 -0.86 0.18 0.00 0.00 0.00 0.00 44.72 44.28 2d49 s GLY 52 CO 0.16 -0.19 1.46 1.44 0.00 0.00 0.00 173.10 175.97