#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 4.90 -0.19 0.00 2.01 -1.23 -5.00 115.64 116.14 2d49 s THR 2 Ca 0.00 0.13 -0.33 0.00 0.31 0.00 0.00 61.69 61.80 2d49 s THR 2 Cb 0.00 -4.13 0.14 0.00 0.01 0.00 0.00 72.50 68.52 2d49 s THR 2 CO 0.00 -0.49 1.18 0.00 -0.69 0.00 0.00 174.62 174.62 2d49 s ALA 4 N -2.11 3.27 0.09 0.00 0.00 -1.26 -5.05 121.76 116.69 2d49 s ALA 4 Ca 0.08 -1.37 -0.32 0.00 0.00 0.00 0.00 51.96 50.34 2d49 s ALA 4 Cb -0.01 -1.04 -0.11 0.00 0.00 0.00 0.00 23.12 21.96 2d49 s ALA 4 CO -0.05 0.45 1.84 2.41 0.00 0.00 0.00 175.76 180.41 2d49 n THR 5 N -0.28 0.41 -1.52 0.00 -1.04 -1.26 -3.22 114.28 107.36 2d49 n THR 5 Ca -0.09 -0.07 -0.44 0.00 -2.04 0.00 0.00 64.05 61.41 2d49 n THR 5 Cb 0.56 -2.05 -0.01 0.00 -1.82 0.00 0.00 70.33 67.01 2d49 n THR 5 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2d49 n ALA 6 N 5.78 -0.96 -1.53 2.41 0.00 -1.26 -1.83 120.51 123.12 2d49 n ALA 6 Ca 0.19 0.30 -0.40 0.00 0.00 0.00 0.00 53.44 53.53 2d49 n ALA 6 Cb 0.36 -1.89 0.03 0.00 0.00 0.00 0.00 19.45 17.94 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 -0.27 0.16 -4.20 0.00 -0.00 -1.02 -4.68 117.44 107.44 2d49 n TRP 7 Ca 0.11 0.51 -0.16 0.00 -0.00 0.00 0.00 57.50 57.96 2d49 n TRP 7 Cb 0.34 -2.07 -0.13 0.00 -0.00 0.00 0.00 31.31 29.45 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 -1.01 0.93 0.19 5.87 0.01 -1.26 -5.02 113.70 113.42 2d49 s SER 8 Ca 0.67 -0.30 0.18 0.00 1.31 0.00 0.00 55.95 57.81 2d49 s SER 8 Cb -0.51 -0.05 -0.00 0.00 0.21 0.00 0.00 66.02 65.67 2d49 s SER 8 CO 0.55 -0.01 1.12 0.77 0.41 0.00 0.00 173.24 176.08 2d49 h SER 9 N 5.37 0.00 -0.84 2.44 4.64 -1.98 -3.30 113.55 119.88 2d49 h SER 9 Ca -0.32 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.64 2d49 h SER 9 Cb 1.19 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.07 2d49 h SER 9 CO 0.46 0.36 0.44 -0.24 -0.87 0.00 0.00 176.83 176.98 2d49 n SER 10 N -2.95 4.19 -3.41 4.97 2.88 -1.26 -4.41 113.62 113.63 2d49 n SER 10 Ca -0.03 -3.44 -0.21 0.00 -1.33 0.00 0.00 58.87 53.87 2d49 n SER 10 Cb 0.71 -0.78 -0.10 0.00 -0.75 0.00 0.00 64.21 63.29 2d49 n SER 10 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2d49 s SER 11 N -1.25 1.93 0.29 -3.46 0.15 -1.25 -5.13 113.70 104.98 2d49 s SER 11 Ca 0.55 -1.43 -0.30 0.00 0.70 0.00 0.00 55.95 55.48 2d49 s SER 11 Cb 0.46 0.26 -0.11 0.00 -1.71 0.00 0.00 66.02 64.92 2d49 s SER 11 CO 0.12 -0.33 1.50 0.54 1.20 0.00 0.00 173.24 176.27 2d49 s VAL 12 N 1.70 2.35 0.36 4.45 0.11 -1.26 -4.72 120.40 123.40 2d49 s VAL 12 Ca 0.14 0.31 0.08 0.00 -2.93 0.00 0.00 61.98 59.58 2d49 s VAL 12 Cb -0.16 -3.20 -0.04 0.00 -1.53 0.00 0.00 36.38 31.45 2d49 s VAL 12 CO -0.15 0.05 0.17 -0.31 -3.33 0.00 0.00 175.10 171.53 2d49 s TYR 13 N -0.20 2.68 0.08 1.54 2.02 -0.90 -4.98 117.35 117.59 2d49 s TYR 13 Ca 0.59 -0.44 0.00 0.00 -0.37 0.00 0.00 57.07 56.86 2d49 s TYR 13 Cb -0.45 -1.75 -0.00 0.00 -0.40 0.00 0.00 41.96 39.36 2d49 s TYR 13 CO 0.48 0.27 0.10 0.25 -1.57 0.00 0.00 175.55 175.08 2d49 n THR 14 N -1.20 0.00 -1.54 -0.71 -2.24 -1.26 -0.36 114.28 106.98 2d49 n THR 14 Ca -0.02 -0.48 -0.51 0.00 -2.27 0.00 0.00 64.05 60.78 2d49 n THR 14 Cb 0.62 0.27 -0.06 0.00 -2.10 0.00 0.00 70.33 69.06 2d49 n THR 14 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2d49 n ASN 15 N -2.23 2.51 0.00 3.42 2.85 -1.24 -0.17 115.26 120.40 2d49 n ASN 15 Ca 0.01 0.59 0.00 0.00 -0.11 0.00 0.00 54.58 55.07 2d49 n ASN 15 Cb 0.14 -1.29 0.00 0.00 1.24 0.00 0.00 39.78 39.87 2d49 n ASN 15 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2d49 n GLY 16 N 5.76 2.21 3.65 8.20 0.00 -1.22 -4.90 105.19 118.89 2d49 n GLY 16 Ca 0.35 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.43 0.94 3.43 -0.02 0.00 0.76 -4.78 105.19 105.09 2d49 n GLY 17 Ca 0.00 0.73 -0.31 0.00 0.00 0.00 0.00 46.02 46.44 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 1.55 2.71 0.22 2.61 2.01 -1.26 -1.56 115.64 121.92 2d49 s THR 18 Ca 0.85 -1.09 -0.02 0.00 0.31 0.00 0.00 61.69 61.74 2d49 s THR 18 Cb -0.81 -2.09 0.01 0.00 0.01 0.00 0.00 72.50 69.62 2d49 s THR 18 CO 0.46 0.43 0.32 1.33 -0.69 0.00 0.00 174.62 176.47 2d49 n VAL 19 N 1.85 0.00 -4.36 3.82 0.24 0.14 -4.31 118.33 115.70 2d49 n VAL 19 Ca -0.16 -1.04 -0.27 0.00 -2.04 0.00 0.00 64.34 60.82 2d49 n VAL 19 Cb 0.52 0.67 -0.13 0.00 -1.47 0.00 0.00 33.84 33.43 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 -2.33 3.10 -0.30 -1.34 0.15 -0.76 -0.37 113.70 111.86 2d49 s SER 20 Ca 0.17 -0.75 -0.22 0.00 0.70 0.00 0.00 55.95 55.85 2d49 s SER 20 Cb -0.01 -0.20 0.19 0.00 -1.71 0.00 0.00 66.02 64.29 2d49 s SER 20 CO 0.12 0.13 1.32 -0.47 1.20 0.00 0.00 173.24 175.55 2d49 s TYR 21 N -1.18 -0.13 -1.94 3.44 5.04 0.33 -2.42 117.35 120.49 2d49 s TYR 21 Ca 0.13 0.30 0.00 0.00 -2.44 0.00 0.00 57.07 55.05 2d49 s TYR 21 Cb -0.10 0.33 0.00 0.00 0.35 0.00 0.00 41.96 42.55 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 2.22 -5.30 0.00 4.32 2.85 -1.26 -0.93 115.26 117.16 2d49 n ASN 22 Ca -0.13 0.39 0.00 0.00 -0.11 0.00 0.00 54.58 54.72 2d49 n ASN 22 Cb 0.57 -4.45 0.00 0.00 1.24 0.00 0.00 39.78 37.14 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 -0.72 0.71 1.86 8.20 0.00 -1.26 -5.02 105.19 108.97 2d49 n GLY 23 Ca -0.19 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.51 1.12 -4.60 1.61 1.74 -0.11 -1.00 116.66 112.92 2d49 n ARG 24 Ca 0.00 -1.91 -0.33 0.00 -0.77 0.00 0.00 57.85 54.84 2d49 n ARG 24 Cb 0.00 0.71 -0.12 0.00 -1.02 0.00 0.00 32.46 32.02 2d49 n ARG 24 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2d49 s ASN 25 N -2.42 4.51 -0.14 0.55 0.02 -0.02 -0.51 114.94 116.93 2d49 s ASN 25 Ca 0.04 -0.15 0.01 0.00 -1.02 0.00 0.00 52.86 51.74 2d49 s ASN 25 Cb 0.00 -1.48 -0.00 0.00 0.02 0.00 0.00 41.25 39.79 2d49 s ASN 25 CO 0.03 0.24 -0.16 -0.31 0.02 0.00 0.00 177.10 176.92 2d49 s TYR 26 N -0.10 2.76 -0.14 2.20 2.02 0.51 -0.09 117.35 124.50 2d49 s TYR 26 Ca 0.01 -0.96 0.01 0.00 -0.37 0.00 0.00 57.07 55.76 2d49 s TYR 26 Cb -0.13 -1.86 0.00 0.00 -0.40 0.00 0.00 41.96 39.57 2d49 s TYR 26 CO 0.03 -0.41 -0.18 0.99 -1.57 0.00 0.00 175.55 174.41 2d49 s THR 27 N 0.66 2.48 0.90 -0.71 2.01 0.45 -0.68 115.64 120.75 2d49 s THR 27 Ca -0.08 -0.84 -0.12 0.00 0.31 0.00 0.00 61.69 60.96 2d49 s THR 27 Cb -0.16 -2.03 0.13 0.00 0.01 0.00 0.00 72.50 70.46 2d49 s THR 27 CO 0.02 0.53 1.14 0.00 -0.69 0.00 0.00 174.62 175.62 2d49 s ALA 28 N 0.74 1.85 -0.04 7.40 0.00 -0.60 -2.45 121.76 128.66 2d49 s ALA 28 Ca -0.07 -0.55 0.09 0.00 0.00 0.00 0.00 51.96 51.43 2d49 s ALA 28 Cb -0.16 -3.02 -0.13 0.00 0.00 0.00 0.00 23.12 19.81 2d49 s ALA 28 CO 0.01 -2.24 0.14 1.17 0.00 0.00 0.00 175.76 174.84 2d49 n LYS 29 N -3.73 1.13 -2.78 0.00 3.00 -1.15 -3.38 118.16 111.25 2d49 n LYS 29 Ca 0.07 -0.05 -0.04 0.00 -0.00 0.00 0.00 58.31 58.29 2d49 n LYS 29 Cb 0.59 -1.22 0.02 0.00 0.00 0.00 0.00 35.03 34.42 2d49 n LYS 29 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.40 174.73 2d49 n TRP 30 N -2.00 -1.44 -1.64 5.64 2.14 -1.26 -4.03 117.44 114.85 2d49 n TRP 30 Ca -0.06 -0.94 -0.50 0.00 2.07 0.00 0.00 57.50 58.07 2d49 n TRP 30 Cb 0.43 0.47 -0.05 0.00 -0.81 0.00 0.00 31.31 31.35 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 -0.38 1.94 -3.72 -2.67 -0.00 -1.26 -3.59 117.44 107.77 2d49 n TRP 31 Ca -0.03 0.42 -0.12 0.00 -0.00 0.00 0.00 57.50 57.76 2d49 n TRP 31 Cb 0.35 -2.46 -0.10 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 1.32 -0.01 0.52 5.87 -1.32 0.51 -4.94 115.64 117.59 2d49 s THR 32 Ca 0.84 0.02 -0.03 0.00 -1.21 0.00 0.00 61.69 61.32 2d49 s THR 32 Cb -0.83 -0.61 0.11 0.00 -1.51 0.00 0.00 72.50 69.66 2d49 s THR 32 CO 0.46 0.01 0.71 1.67 -2.21 0.00 0.00 174.62 175.26 2d49 n GLN 33 N 3.24 -0.13 -1.48 7.08 -0.06 -1.26 -2.12 117.38 122.65 2d49 n GLN 33 Ca -0.16 -1.66 -0.44 0.00 -2.00 0.00 0.00 57.00 52.74 2d49 n GLN 33 Cb 0.57 -0.56 -0.09 0.00 -4.06 0.00 0.00 30.24 26.10 2d49 n GLN 33 CO 0.00 0.00 0.00 0.27 -0.20 0.00 0.00 177.06 177.13 2d49 n ASN 34 N -3.11 1.54 -3.81 1.69 6.94 -1.26 -4.88 115.26 112.36 2d49 n ASN 34 Ca 0.11 0.09 -0.12 0.00 -0.02 0.00 0.00 54.58 54.64 2d49 n ASN 34 Cb 0.38 -1.23 -0.12 0.00 -2.36 0.00 0.00 39.78 36.46 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 7.65 0.29 -0.18 -3.83 0.41 -1.26 -5.08 118.70 116.70 2d49 s GLU 35 Ca 1.15 0.14 -0.29 0.00 -0.41 0.00 0.00 54.97 55.56 2d49 s GLU 35 Cb -0.83 0.14 -0.05 0.00 -1.78 0.00 0.00 34.13 31.61 2d49 s GLU 35 CO 0.44 -0.05 2.04 1.03 -0.49 0.00 0.00 175.26 178.23 2d49 s ARG 36 N -0.22 3.45 0.47 1.61 0.52 -1.26 -4.95 118.95 118.57 2d49 s ARG 36 Ca -0.03 2.04 -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 0.01 -1.74 1.16 -1.25 0.02 0.00 0.00 175.30 173.50 2d49 s PRO 37 N 5.67 3.71 0.00 3.54 0.04 -1.26 -3.39 135.00 143.32 2d49 s PRO 37 Ca 0.92 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.71 2d49 s PRO 37 Cb -0.33 -2.35 0.00 0.00 0.04 0.00 0.00 34.50 31.86 2d49 s PRO 37 CO 0.36 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 177.22 2d49 n GLY 38 N 0.40 2.61 0.16 0.56 0.00 -1.24 -4.76 105.19 102.92 2d49 n GLY 38 Ca 0.08 -0.31 0.05 0.00 0.00 0.00 0.00 46.02 45.83 2d49 n GLY 38 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2d49 h THR 39 N 0.00 0.63 -3.80 2.61 2.02 -1.86 -3.46 112.91 109.06 2d49 h THR 39 Ca 0.00 -1.90 -0.64 0.00 0.77 0.00 0.00 66.41 64.64 2d49 h THR 39 Cb 0.00 2.30 -0.21 0.00 -1.74 0.00 0.00 68.15 68.50 2d49 h THR 39 CO 0.00 0.36 -0.85 -0.55 0.37 0.00 0.00 175.52 174.85 2d49 s SER 40 N -6.37 3.07 0.66 4.18 0.15 -1.25 -5.01 113.70 109.12 2d49 s SER 40 Ca 0.05 -0.75 0.40 0.00 0.70 0.00 0.00 55.95 56.34 2d49 s SER 40 Cb 0.07 -0.20 2.21 0.00 -1.71 0.00 0.00 66.02 66.39 2d49 s SER 40 CO 0.73 0.13 2.28 0.44 1.20 0.00 0.00 173.24 178.01 2d49 h ASP 41 N 3.82 0.00 -0.72 5.45 3.32 -1.96 -2.41 116.42 123.92 2d49 h ASP 41 Ca -0.49 0.00 0.14 0.00 0.02 0.00 0.00 57.03 56.71 2d49 h ASP 41 Cb 1.18 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.63 2d49 h ASP 41 CO 0.41 0.00 0.24 0.58 -1.72 0.00 0.00 179.24 178.74 2d49 h VAL 42 N 0.00 0.61 -3.32 -1.35 2.07 -1.96 -3.39 116.25 108.91 2d49 h VAL 42 Ca 0.01 -0.12 -0.64 0.00 0.82 0.00 0.00 66.70 66.76 2d49 h VAL 42 Cb 0.14 0.22 -0.22 0.00 -1.52 0.00 0.00 31.29 29.91 2d49 h VAL 42 CO -0.00 0.07 -0.68 0.26 0.02 0.00 0.00 177.57 177.24 2d49 s TRP 43 N -6.04 3.00 0.03 1.57 0.52 -0.91 -2.94 118.94 114.17 2d49 s TRP 43 Ca -0.13 -0.37 0.04 0.00 0.02 0.00 0.00 56.10 55.67 2d49 s TRP 43 Cb 0.20 -1.96 -0.02 0.00 -1.15 0.00 0.00 33.47 30.54 2d49 s TRP 43 CO 0.76 -0.09 -0.13 0.00 0.02 0.00 0.00 176.95 177.51 2d49 s ALA 44 N 0.45 1.10 -0.05 0.98 0.00 -1.03 -3.67 121.76 119.54 2d49 s ALA 44 Ca -0.04 -0.75 -0.30 0.00 0.00 0.00 0.00 51.96 50.87 2d49 s ALA 44 Cb -0.14 -0.18 -0.07 0.00 0.00 0.00 0.00 23.12 22.73 2d49 s ALA 44 CO 0.03 0.21 1.86 0.16 0.00 0.00 0.00 175.76 178.03 2d49 s ASP 45 N -0.97 6.38 -0.17 0.00 -4.77 -1.26 -0.41 116.67 115.47 2d49 s ASP 45 Ca 0.02 2.32 0.17 0.00 -3.30 0.00 0.00 52.55 51.76 2d49 s ASP 45 Cb -0.07 -2.53 0.51 0.00 -1.09 0.00 0.00 42.92 39.74 2d49 s ASP 45 CO 0.01 -1.15 1.40 1.17 0.70 0.00 0.00 175.17 177.30 2d49 n LYS 46 N 7.58 2.81 -1.33 2.11 3.00 0.87 -4.88 118.16 128.33 2d49 n LYS 46 Ca 0.20 -2.81 0.00 0.00 -0.00 0.00 0.00 58.31 55.70 2d49 n LYS 46 Cb 0.43 -1.81 0.00 0.00 0.00 0.00 0.00 35.03 33.64 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 -0.55 0.18 3.51 3.14 0.00 -1.23 -4.92 105.19 105.32 2d49 n GLY 47 Ca 0.21 -1.69 -0.25 0.00 0.00 0.00 0.00 46.02 44.29 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 -1.02 2.81 -0.16 4.61 0.00 -1.26 -0.84 121.76 125.91 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 0.69 0.08 0.00 0.00 -0.44 -4.75 107.32 103.21 2d49 s GLY 50 Ca -0.01 -0.46 0.05 0.00 0.00 0.00 0.00 44.72 44.30 2d49 s GLY 50 CO 0.02 1.06 -0.13 -0.51 0.00 0.00 0.00 173.10 173.55 2d49 s THR 51 N 1.82 1.06 0.93 0.90 -4.23 -1.26 -3.46 115.64 111.40 2d49 s THR 51 Ca 0.03 -1.43 -0.10 0.00 -1.18 0.00 0.00 61.69 59.01 2d49 s THR 51 Cb -0.14 -1.17 0.16 0.00 1.34 0.00 0.00 72.50 72.69 2d49 s THR 51 CO -0.07 -0.35 1.13 0.61 -0.54 0.00 0.00 174.62 175.41 2d49 n GLY 52 N 1.01 -0.49 0.00 3.99 0.00 -1.26 -5.14 105.19 103.29 2d49 n GLY 52 Ca -0.19 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.08 2d49 n GLY 52 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06