#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 3.36 0.01 0.00 2.01 -1.26 -4.77 115.64 115.00 2d49 s THR 2 Ca 0.00 0.42 -0.25 0.00 0.31 0.00 0.00 61.69 62.16 2d49 s THR 2 Cb 0.00 -3.35 0.06 0.00 0.01 0.00 0.00 72.50 69.22 2d49 s THR 2 CO 0.00 -0.12 0.57 0.00 -0.69 0.00 0.00 174.62 174.38 2d49 s ALA 4 N -1.99 2.92 0.14 0.00 0.00 -1.26 -5.05 121.76 116.52 2d49 s ALA 4 Ca -0.08 -1.52 -0.32 0.00 0.00 0.00 0.00 51.96 50.05 2d49 s ALA 4 Cb -0.01 -0.69 -0.11 0.00 0.00 0.00 0.00 23.12 22.31 2d49 s ALA 4 CO 0.02 0.44 1.79 -2.37 0.00 0.00 0.00 175.76 175.64 2d49 n THR 5 N -0.05 0.24 -1.53 0.00 5.66 -1.26 -3.16 114.28 114.19 2d49 n THR 5 Ca -0.10 -0.04 -0.42 0.00 -3.05 0.00 0.00 64.05 60.43 2d49 n THR 5 Cb 0.56 -2.03 0.00 0.00 -1.55 0.00 0.00 70.33 67.32 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 5.04 -0.77 -1.56 1.79 0.00 -1.26 -1.85 120.51 121.89 2d49 n ALA 6 Ca 0.18 0.23 -0.41 0.00 0.00 0.00 0.00 53.44 53.43 2d49 n ALA 6 Cb 0.36 -1.91 0.01 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 -0.57 0.61 -3.68 0.00 -0.00 -0.99 -4.67 117.44 108.14 2d49 n TRP 7 Ca 0.11 0.57 -0.24 0.00 -0.00 0.00 0.00 57.50 57.94 2d49 n TRP 7 Cb 0.38 -2.14 -0.17 0.00 -0.00 0.00 0.00 31.31 29.37 2d49 n TRP 7 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 177.69 176.57 2d49 s SER 8 N -0.84 2.06 0.38 5.87 0.01 -1.26 -4.99 113.70 114.93 2d49 s SER 8 Ca 0.64 -0.41 0.27 0.00 1.31 0.00 0.00 55.95 57.76 2d49 s SER 8 Cb -0.57 -0.33 1.34 0.00 0.21 0.00 0.00 66.02 66.67 2d49 s SER 8 CO 0.56 -0.29 1.82 0.77 0.41 0.00 0.00 173.24 176.52 2d49 h SER 9 N 8.37 0.00 -0.69 2.44 4.64 -1.95 -1.65 113.55 124.71 2d49 h SER 9 Ca -0.15 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 60.88 2d49 h SER 9 Cb 1.13 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.05 2d49 h SER 9 CO 0.26 0.00 0.37 -0.24 -0.87 0.00 0.00 176.83 176.35 2d49 n SER 10 N -2.47 3.95 -3.29 4.97 2.88 -1.26 -4.48 113.62 113.92 2d49 n SER 10 Ca -0.00 -3.11 0.01 0.00 -1.33 0.00 0.00 58.87 54.43 2d49 n SER 10 Cb 0.12 -0.73 -0.03 0.00 -0.75 0.00 0.00 64.21 62.82 2d49 n SER 10 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2d49 s SER 11 N -0.76 -1.08 0.14 -3.46 1.04 -0.62 -5.14 113.70 103.82 2d49 s SER 11 Ca 0.45 0.93 -0.30 0.00 0.48 0.00 0.00 55.95 57.50 2d49 s SER 11 Cb 0.36 2.02 -0.07 0.00 0.10 0.00 0.00 66.02 68.43 2d49 s SER 11 CO 0.10 -0.26 1.22 0.54 0.98 0.00 0.00 173.24 175.82 2d49 s VAL 12 N 2.82 3.68 0.39 5.02 0.11 -1.26 -4.72 120.40 126.43 2d49 s VAL 12 Ca 0.14 1.31 0.08 0.00 -2.93 0.00 0.00 61.98 60.58 2d49 s VAL 12 Cb -0.14 -3.84 -0.02 0.00 -1.53 0.00 0.00 36.38 30.85 2d49 s VAL 12 CO -0.20 0.16 0.37 -0.31 -3.33 0.00 0.00 175.10 171.80 2d49 s TYR 13 N 0.43 2.78 0.10 1.54 2.02 -0.79 -4.97 117.35 118.45 2d49 s TYR 13 Ca 0.56 -0.43 -0.00 0.00 -0.37 0.00 0.00 57.07 56.83 2d49 s TYR 13 Cb -0.32 -2.09 0.00 0.00 -0.40 0.00 0.00 41.96 39.15 2d49 s TYR 13 CO 0.34 -0.06 0.12 0.25 -1.57 0.00 0.00 175.55 174.63 2d49 n THR 14 N -1.53 0.00 -1.68 -0.71 -2.24 -1.26 -0.37 114.28 106.49 2d49 n THR 14 Ca 0.02 -0.51 -0.49 0.00 -2.27 0.00 0.00 64.05 60.80 2d49 n THR 14 Cb 0.61 0.30 -0.05 0.00 -2.10 0.00 0.00 70.33 69.09 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 -2.10 3.34 0.00 3.42 6.94 -1.23 -1.07 115.26 124.56 2d49 n ASN 15 Ca 0.00 0.98 0.00 0.00 -0.02 0.00 0.00 54.58 55.55 2d49 n ASN 15 Cb 0.16 -1.35 0.00 0.00 -2.36 0.00 0.00 39.78 36.23 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 4.38 2.56 3.67 4.83 0.00 -1.24 -4.91 105.19 114.47 2d49 n GLY 16 Ca 0.23 -0.40 -0.51 0.00 0.00 0.00 0.00 46.02 45.34 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 0.00 1.06 3.40 -0.02 0.00 -0.23 -4.78 105.19 104.62 2d49 n GLY 17 Ca 0.00 0.80 -0.33 0.00 0.00 0.00 0.00 46.02 46.50 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 2.58 2.93 0.18 2.61 2.01 -1.26 -1.83 115.64 122.86 2d49 s THR 18 Ca 0.89 -0.74 0.02 0.00 0.31 0.00 0.00 61.69 62.18 2d49 s THR 18 Cb -0.83 -2.18 -0.01 0.00 0.01 0.00 0.00 72.50 69.49 2d49 s THR 18 CO 0.51 0.56 0.09 1.33 -0.69 0.00 0.00 174.62 176.42 2d49 n VAL 19 N 3.01 0.00 -4.34 3.82 0.24 0.34 -4.01 118.33 117.39 2d49 n VAL 19 Ca -0.18 -1.12 -0.23 0.00 -2.04 0.00 0.00 64.34 60.77 2d49 n VAL 19 Cb 0.52 0.45 -0.12 0.00 -1.47 0.00 0.00 33.84 33.23 2d49 n VAL 19 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2d49 s SER 20 N -2.14 2.78 -0.30 -1.34 0.01 -0.77 -0.29 113.70 111.66 2d49 s SER 20 Ca 0.13 -0.82 -0.22 0.00 1.31 0.00 0.00 55.95 56.35 2d49 s SER 20 Cb 0.01 -0.17 0.19 0.00 0.21 0.00 0.00 66.02 66.25 2d49 s SER 20 CO 0.09 0.02 1.32 -0.47 0.41 0.00 0.00 173.24 174.61 2d49 s TYR 21 N -1.74 -0.13 -1.93 2.43 5.04 0.45 -2.36 117.35 119.12 2d49 s TYR 21 Ca 0.14 0.29 0.00 0.00 -2.44 0.00 0.00 57.07 55.06 2d49 s TYR 21 Cb -0.07 0.33 0.00 0.00 0.35 0.00 0.00 41.96 42.56 2d49 s TYR 21 CO 0.06 -0.06 0.00 -1.71 -1.34 0.00 0.00 175.55 172.50 2d49 n ASN 22 N 2.25 -5.29 0.00 4.32 2.85 -1.26 -0.91 115.26 117.22 2d49 n ASN 22 Ca -0.13 0.38 0.00 0.00 -0.11 0.00 0.00 54.58 54.72 2d49 n ASN 22 Cb 0.57 -4.42 0.00 0.00 1.24 0.00 0.00 39.78 37.16 2d49 n ASN 22 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2d49 n GLY 23 N -0.73 0.96 1.45 8.20 0.00 -1.26 -5.02 105.19 108.79 2d49 n GLY 23 Ca -0.19 0.00 -0.12 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 1.36 -4.89 1.61 3.00 -0.08 -0.96 116.66 114.69 2d49 n ARG 24 Ca 0.00 -1.40 -0.32 0.00 -0.01 0.00 0.00 57.85 56.12 2d49 n ARG 24 Cb 0.00 0.27 -0.16 0.00 0.00 0.00 0.00 32.46 32.57 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 -2.17 3.24 -0.17 0.55 0.01 -0.73 -0.41 114.94 115.26 2d49 s ASN 25 Ca 0.06 -0.55 -0.04 0.00 -0.71 0.00 0.00 52.86 51.62 2d49 s ASN 25 Cb -0.00 -1.46 -0.03 0.00 0.41 0.00 0.00 41.25 40.17 2d49 s ASN 25 CO 0.04 0.12 -0.02 -0.31 -1.51 0.00 0.00 177.10 175.42 2d49 s TYR 26 N 0.58 3.05 -0.20 2.20 2.02 0.61 -0.10 117.35 125.51 2d49 s TYR 26 Ca -0.12 -0.29 -0.03 0.00 -0.37 0.00 0.00 57.07 56.26 2d49 s TYR 26 Cb -0.17 -2.00 -0.01 0.00 -0.40 0.00 0.00 41.96 39.39 2d49 s TYR 26 CO 0.03 -0.05 -0.07 0.99 -1.57 0.00 0.00 175.55 174.88 2d49 s THR 27 N 0.48 3.21 0.99 -0.71 2.01 0.57 -0.51 115.64 121.69 2d49 s THR 27 Ca -0.02 -0.56 -0.13 0.00 0.31 0.00 0.00 61.69 61.29 2d49 s THR 27 Cb -0.14 -2.43 0.19 0.00 0.01 0.00 0.00 72.50 70.13 2d49 s THR 27 CO 0.02 0.46 1.10 0.00 -0.69 0.00 0.00 174.62 175.51 2d49 s ALA 28 N 1.19 1.05 -0.02 7.40 0.00 -0.76 -2.45 121.76 128.17 2d49 s ALA 28 Ca 0.02 -0.43 0.05 0.00 0.00 0.00 0.00 51.96 51.60 2d49 s ALA 28 Cb -0.14 -3.09 -0.07 0.00 0.00 0.00 0.00 23.12 19.82 2d49 s ALA 28 CO -0.02 -2.79 0.08 1.63 0.00 0.00 0.00 175.76 174.66 2d49 n LYS 29 N -4.14 1.02 -2.82 0.00 4.76 -1.10 -3.72 118.16 112.17 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 -1.11 0.01 0.00 -1.84 0.00 0.00 35.03 32.67 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 -1.81 -1.27 -1.64 2.13 2.14 -1.26 -4.21 117.44 111.53 2d49 n TRP 30 Ca -0.03 -0.86 -0.50 0.00 2.07 0.00 0.00 57.50 58.18 2d49 n TRP 30 Cb 0.27 0.42 -0.05 0.00 -0.81 0.00 0.00 31.31 31.14 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 -0.40 1.90 -3.74 -2.67 -0.00 -1.26 -3.55 117.44 107.72 2d49 n TRP 31 Ca -0.02 0.44 -0.12 0.00 -0.00 0.00 0.00 57.50 57.80 2d49 n TRP 31 Cb 0.35 -2.45 -0.11 0.00 -0.00 0.00 0.00 31.31 29.10 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 1.19 -0.01 0.54 5.87 -1.32 0.50 -4.94 115.64 117.47 2d49 s THR 32 Ca 0.84 0.05 -0.03 0.00 -1.21 0.00 0.00 61.69 61.34 2d49 s THR 32 Cb -0.84 -0.50 0.11 0.00 -1.51 0.00 0.00 72.50 69.76 2d49 s THR 32 CO 0.46 0.02 0.74 0.00 -2.21 0.00 0.00 174.62 173.63 2d49 n GLN 33 N 3.45 -0.14 -1.50 7.08 1.13 -1.26 -1.89 117.38 124.25 2d49 n GLN 33 Ca -0.18 -1.74 -0.42 0.00 -1.94 0.00 0.00 57.00 52.73 2d49 n GLN 33 Cb 0.56 -0.58 -0.08 0.00 0.11 0.00 0.00 30.24 30.25 2d49 n GLN 33 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 2d49 n ASN 34 N -3.11 1.56 -3.87 1.08 6.94 -1.26 -4.86 115.26 111.74 2d49 n ASN 34 Ca 0.11 0.00 -0.12 0.00 -0.02 0.00 0.00 54.58 54.56 2d49 n ASN 34 Cb 0.40 -1.26 -0.12 0.00 -2.36 0.00 0.00 39.78 36.44 2d49 n ASN 34 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2d49 s GLU 35 N 7.89 0.19 -0.17 -3.83 2.02 -1.26 -5.06 118.70 118.47 2d49 s GLU 35 Ca 1.14 -0.09 -0.29 0.00 0.02 0.00 0.00 54.97 55.76 2d49 s GLU 35 Cb -0.76 0.08 -0.05 0.00 0.10 0.00 0.00 34.13 33.50 2d49 s GLU 35 CO 0.41 -0.03 2.04 1.03 0.02 0.00 0.00 175.26 178.73 2d49 s ARG 36 N -0.43 3.46 0.48 1.61 0.52 -1.26 -4.95 118.95 118.38 2d49 s ARG 36 Ca -0.05 2.05 -0.22 0.00 -0.52 0.00 0.00 55.73 56.99 2d49 s ARG 36 Cb -0.03 -4.27 -0.07 0.00 0.52 0.00 0.00 34.95 31.10 2d49 s ARG 36 CO 0.00 -1.73 1.15 -1.25 0.02 0.00 0.00 175.30 173.50 2d49 s PRO 37 N 5.65 3.66 0.00 3.54 0.04 -1.26 -3.25 135.00 143.38 2d49 s PRO 37 Ca 0.92 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.69 2d49 s PRO 37 Cb -0.33 -2.30 0.00 0.00 0.04 0.00 0.00 34.50 31.91 2d49 s PRO 37 CO 0.36 -0.63 0.00 0.41 0.04 0.00 0.00 177.00 177.18 2d49 n GLY 38 N 0.36 2.98 0.04 0.56 0.00 -1.26 -4.77 105.19 103.10 2d49 n GLY 38 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 -2.00 0.51 -4.07 2.61 -1.04 -1.20 -4.98 114.28 104.11 2d49 n THR 39 Ca 0.00 -0.50 -0.33 0.00 -2.04 0.00 0.00 64.05 61.18 2d49 n THR 39 Cb 0.00 -0.23 -0.07 0.00 -1.82 0.00 0.00 70.33 68.21 2d49 n THR 39 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2d49 s SER 40 N -4.35 5.77 0.61 8.00 0.15 -1.24 -4.99 113.70 117.65 2d49 s SER 40 Ca -0.07 0.17 0.38 0.00 0.70 0.00 0.00 55.95 57.14 2d49 s SER 40 Cb 0.07 -1.68 1.99 0.00 -1.71 0.00 0.00 66.02 64.69 2d49 s SER 40 CO 0.64 0.27 2.23 0.44 1.20 0.00 0.00 173.24 178.02 2d49 h ASP 41 N 4.06 0.00 -0.81 5.45 5.19 -1.95 -2.38 116.42 125.97 2d49 h ASP 41 Ca -0.49 0.00 0.04 0.00 -0.62 0.00 0.00 57.03 55.96 2d49 h ASP 41 Cb 1.18 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 40.65 2d49 h ASP 41 CO 0.63 0.02 0.53 1.62 -3.12 0.00 0.00 179.24 178.92 2d49 h VAL 42 N 0.00 1.10 -3.50 -1.35 3.04 -1.96 -3.40 116.25 110.18 2d49 h VAL 42 Ca -0.00 -0.33 -0.63 0.00 -1.01 0.00 0.00 66.70 64.73 2d49 h VAL 42 Cb 0.17 0.05 -0.18 0.00 -2.01 0.00 0.00 31.29 29.32 2d49 h VAL 42 CO 0.00 0.18 -0.57 0.26 -1.01 0.00 0.00 177.57 176.43 2d49 s TRP 43 N -5.84 3.21 -0.05 3.17 0.52 -0.90 -2.70 118.94 116.34 2d49 s TRP 43 Ca -0.11 -0.04 0.02 0.00 0.02 0.00 0.00 56.10 55.99 2d49 s TRP 43 Cb 0.19 -2.18 0.01 0.00 -1.15 0.00 0.00 33.47 30.34 2d49 s TRP 43 CO 0.79 -0.04 -0.10 0.00 0.02 0.00 0.00 176.95 177.62 2d49 s ALA 44 N 0.98 1.07 0.05 0.98 0.00 -1.03 -4.39 121.76 119.42 2d49 s ALA 44 Ca 0.05 -0.32 -0.31 0.00 0.00 0.00 0.00 51.96 51.38 2d49 s ALA 44 Cb -0.14 -0.49 -0.10 0.00 0.00 0.00 0.00 23.12 22.39 2d49 s ALA 44 CO 0.03 0.09 1.91 -0.40 0.00 0.00 0.00 175.76 177.39 2d49 n ASP 45 N 3.78 3.98 -0.82 0.00 5.75 -1.26 -0.31 116.55 127.67 2d49 n ASP 45 Ca -0.23 0.95 0.09 0.00 -0.01 0.00 0.00 54.79 55.58 2d49 n ASP 45 Cb 0.52 -1.50 0.25 0.00 -1.03 0.00 0.00 41.12 39.35 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 6.66 2.79 -1.28 0.11 3.00 0.85 -4.87 118.16 125.43 2d49 n LYS 46 Ca 0.20 -2.81 0.00 0.00 -0.00 0.00 0.00 58.31 55.69 2d49 n LYS 46 Cb 0.37 -1.81 0.00 0.00 0.00 0.00 0.00 35.03 33.59 2d49 n LYS 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2d49 n GLY 47 N -0.57 0.36 3.51 3.14 0.00 -1.23 -4.96 105.19 105.44 2d49 n GLY 47 Ca 0.21 -1.67 -0.25 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.78 121.76 124.98 2d49 s ALA 48 Ca 0.00 -1.76 -0.05 0.00 0.00 0.00 0.00 51.96 50.15 2d49 s ALA 48 Cb 0.00 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.67 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 1.85 0.02 0.00 0.00 -1.15 -4.75 107.32 103.61 2d49 s GLY 50 Ca -0.01 -1.79 0.04 0.00 0.00 0.00 0.00 44.72 42.95 2d49 s GLY 50 CO 0.02 0.79 -0.12 -0.51 0.00 0.00 0.00 173.10 173.28 2d49 s THR 51 N 1.38 0.90 0.00 0.90 -4.23 -1.26 -4.63 115.64 108.71 2d49 s THR 51 Ca -0.01 -0.81 0.00 0.00 -1.18 0.00 0.00 61.69 59.68 2d49 s THR 51 Cb -0.20 -0.82 0.00 0.00 1.34 0.00 0.00 72.50 72.82 2d49 s THR 51 CO 0.02 0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 2d49 n GLY 52 N 2.14 2.46 0.17 3.99 0.00 -1.26 -5.22 105.19 107.48 2d49 n GLY 52 Ca -0.17 0.30 0.02 0.00 0.00 0.00 0.00 46.02 46.17 2d49 n GLY 52 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06