#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 5.04 -0.30 0.00 2.01 -1.26 -4.96 115.64 116.17 2d49 s THR 2 Ca 0.00 1.36 -0.18 0.00 0.31 0.00 0.00 61.69 63.19 2d49 s THR 2 Cb 0.00 -4.01 0.19 0.00 0.01 0.00 0.00 72.50 68.69 2d49 s THR 2 CO 0.00 0.21 1.20 0.00 -0.69 0.00 0.00 174.62 175.34 2d49 s ALA 4 N 1.96 2.31 0.23 0.00 0.00 -1.26 -4.93 121.76 120.06 2d49 s ALA 4 Ca -0.02 0.68 -0.32 0.00 0.00 0.00 0.00 51.96 52.30 2d49 s ALA 4 Cb -0.02 -3.38 -0.12 0.00 0.00 0.00 0.00 23.12 19.60 2d49 s ALA 4 CO -0.15 -1.54 1.69 -2.37 0.00 0.00 0.00 175.76 173.38 2d49 n THR 5 N -2.57 0.23 -1.52 0.00 5.66 -1.26 -2.91 114.28 111.91 2d49 n THR 5 Ca 0.12 -0.06 -0.42 0.00 -3.05 0.00 0.00 64.05 60.64 2d49 n THR 5 Cb 0.51 -1.96 0.01 0.00 -1.55 0.00 0.00 70.33 67.34 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 3.52 -0.80 -1.55 1.79 0.00 -1.26 -1.94 120.51 120.27 2d49 n ALA 6 Ca 0.14 0.22 -0.41 0.00 0.00 0.00 0.00 53.44 53.39 2d49 n ALA 6 Cb 0.35 -1.91 0.02 0.00 0.00 0.00 0.00 19.45 17.91 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 -0.61 0.49 -3.66 0.00 -0.00 -0.94 -4.68 117.44 108.04 2d49 n TRP 7 Ca 0.11 0.55 -0.27 0.00 -0.00 0.00 0.00 57.50 57.90 2d49 n TRP 7 Cb 0.38 -2.12 -0.17 0.00 -0.00 0.00 0.00 31.31 29.40 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 -0.89 2.53 0.47 5.87 0.01 -1.26 -4.99 113.70 115.44 2d49 s SER 8 Ca 0.65 -0.68 0.32 0.00 1.31 0.00 0.00 55.95 57.55 2d49 s SER 8 Cb -0.55 -0.37 1.66 0.00 0.21 0.00 0.00 66.02 66.97 2d49 s SER 8 CO 0.56 -0.33 1.98 0.28 0.41 0.00 0.00 173.24 176.14 2d49 h SER 9 N 8.36 0.00 -0.69 2.44 0.02 -1.94 -1.21 113.55 120.53 2d49 h SER 9 Ca -0.15 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.51 2d49 h SER 9 Cb 1.14 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.51 2d49 h SER 9 CO 0.31 0.00 0.36 -0.24 -1.14 0.00 0.00 176.83 176.12 2d49 n SER 10 N -2.67 3.94 -3.24 3.07 2.88 -1.26 -4.33 113.62 112.01 2d49 n SER 10 Ca -0.01 -3.11 -0.02 0.00 -1.33 0.00 0.00 58.87 54.39 2d49 n SER 10 Cb 0.10 -0.73 -0.04 0.00 -0.75 0.00 0.00 64.21 62.79 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 -0.75 -0.61 0.11 -3.46 0.15 -0.46 -5.14 113.70 103.55 2d49 s SER 11 Ca 0.44 0.38 -0.31 0.00 0.70 0.00 0.00 55.95 57.16 2d49 s SER 11 Cb 0.36 1.64 -0.08 0.00 -1.71 0.00 0.00 66.02 66.23 2d49 s SER 11 CO 0.10 -0.29 1.50 -0.69 1.20 0.00 0.00 173.24 175.06 2d49 s VAL 12 N 2.70 3.06 0.40 4.45 1.01 -1.26 -4.74 120.40 126.02 2d49 s VAL 12 Ca 0.15 0.70 0.08 0.00 0.00 0.00 0.00 61.98 62.91 2d49 s VAL 12 Cb -0.14 -3.45 -0.00 0.00 0.00 0.00 0.00 36.38 32.79 2d49 s VAL 12 CO -0.21 0.04 0.48 -0.31 0.00 0.00 0.00 175.10 175.10 2d49 s TYR 13 N 1.55 2.84 0.09 5.22 2.02 -0.85 -4.94 117.35 123.28 2d49 s TYR 13 Ca 0.68 -0.39 -0.00 0.00 -0.37 0.00 0.00 57.07 57.00 2d49 s TYR 13 Cb -0.39 -2.22 0.00 0.00 -0.40 0.00 0.00 41.96 38.95 2d49 s TYR 13 CO 0.31 -0.23 0.12 0.25 -1.57 0.00 0.00 175.55 174.42 2d49 n THR 14 N -1.70 0.00 -1.68 -0.71 -2.24 -1.25 -0.37 114.28 106.31 2d49 n THR 14 Ca 0.05 -0.49 -0.49 0.00 -2.27 0.00 0.00 64.05 60.84 2d49 n THR 14 Cb 0.60 0.29 -0.05 0.00 -2.10 0.00 0.00 70.33 69.07 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 -2.11 3.28 0.00 3.42 6.94 -1.24 -1.00 115.26 124.54 2d49 n ASN 15 Ca 0.00 0.99 0.00 0.00 -0.02 0.00 0.00 54.58 55.56 2d49 n ASN 15 Cb 0.15 -1.34 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 4.30 2.81 3.58 4.83 0.00 -1.23 -4.90 105.19 114.58 2d49 n GLY 16 Ca 0.23 -0.42 -0.51 0.00 0.00 0.00 0.00 46.02 45.32 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 0.92 3.76 -0.02 0.00 -0.17 -4.76 105.19 104.92 2d49 n GLY 17 Ca 0.00 0.90 -0.31 0.00 0.00 0.00 0.00 46.02 46.61 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 5.65 4.48 0.30 2.61 2.01 -1.26 -2.08 115.64 127.35 2d49 s THR 18 Ca 1.01 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 62.27 2d49 s THR 18 Cb -0.80 -3.14 0.00 0.00 0.01 0.00 0.00 72.50 68.57 2d49 s THR 18 CO 0.52 0.16 0.38 1.33 -0.69 0.00 0.00 174.62 176.33 2d49 n VAL 19 N 0.60 0.00 -4.27 3.82 0.24 0.49 -4.18 118.33 115.03 2d49 n VAL 19 Ca -0.10 -1.63 -0.22 0.00 -2.04 0.00 0.00 64.34 60.35 2d49 n VAL 19 Cb 0.52 0.96 -0.12 0.00 -1.47 0.00 0.00 33.84 33.72 2d49 n VAL 19 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2d49 s SER 20 N -2.88 2.20 -0.29 -1.34 1.04 -0.82 -0.41 113.70 111.20 2d49 s SER 20 Ca 0.27 -0.64 -0.25 0.00 0.48 0.00 0.00 55.95 55.80 2d49 s SER 20 Cb -0.00 -0.11 0.18 0.00 0.10 0.00 0.00 66.02 66.19 2d49 s SER 20 CO 0.19 0.02 1.37 -0.47 0.98 0.00 0.00 173.24 175.33 2d49 s TYR 21 N -1.16 -0.12 -1.93 5.02 5.04 0.52 -2.20 117.35 122.52 2d49 s TYR 21 Ca 0.03 0.28 0.00 0.00 -2.44 0.00 0.00 57.07 54.94 2d49 s TYR 21 Cb -0.10 0.47 0.00 0.00 0.35 0.00 0.00 41.96 42.68 2d49 s TYR 21 CO 0.03 -0.06 0.00 -1.71 -1.34 0.00 0.00 175.55 172.47 2d49 n ASN 22 N 1.55 -5.29 0.00 4.32 5.15 -1.26 -0.94 115.26 118.79 2d49 n ASN 22 Ca -0.10 0.39 0.00 0.00 -0.60 0.00 0.00 54.58 54.27 2d49 n ASN 22 Cb 0.57 -4.43 0.00 0.00 -0.53 0.00 0.00 39.78 35.39 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 1.12 1.52 8.20 0.00 -1.26 -5.02 105.19 109.03 2d49 n GLY 23 Ca -0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 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 -4.80 1.61 3.00 -0.11 -0.44 116.66 115.27 2d49 n ARG 24 Ca 0.00 -1.48 -0.30 0.00 -0.01 0.00 0.00 57.85 56.06 2d49 n ARG 24 Cb 0.00 0.30 -0.17 0.00 0.00 0.00 0.00 32.46 32.60 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 -2.22 2.73 -0.14 0.55 0.01 -0.86 -0.35 114.94 114.66 2d49 s ASN 25 Ca 0.05 -0.50 -0.04 0.00 -0.71 0.00 0.00 52.86 51.67 2d49 s ASN 25 Cb -0.00 -1.25 -0.03 0.00 0.41 0.00 0.00 41.25 40.38 2d49 s ASN 25 CO 0.03 0.09 -0.00 -0.31 -1.51 0.00 0.00 177.10 175.39 2d49 s TYR 26 N 0.66 3.12 -0.19 2.20 2.02 0.45 -0.09 117.35 125.52 2d49 s TYR 26 Ca -0.12 -0.05 0.00 0.00 -0.37 0.00 0.00 57.07 56.53 2d49 s TYR 26 Cb -0.16 -1.93 0.01 0.00 -0.40 0.00 0.00 41.96 39.48 2d49 s TYR 26 CO 0.03 0.18 -0.17 0.99 -1.57 0.00 0.00 175.55 175.01 2d49 s THR 27 N -0.05 2.34 0.97 -0.71 2.01 0.54 -0.38 115.64 120.37 2d49 s THR 27 Ca 0.03 -0.85 -0.12 0.00 0.31 0.00 0.00 61.69 61.06 2d49 s THR 27 Cb -0.13 -2.00 0.17 0.00 0.01 0.00 0.00 72.50 70.55 2d49 s THR 27 CO 0.02 0.52 1.11 0.00 -0.69 0.00 0.00 174.62 175.58 2d49 s ALA 28 N 1.31 1.22 -0.02 7.40 0.00 -0.88 -2.43 121.76 128.36 2d49 s ALA 28 Ca 0.05 -0.44 0.04 0.00 0.00 0.00 0.00 51.96 51.61 2d49 s ALA 28 Cb -0.13 -3.08 -0.06 0.00 0.00 0.00 0.00 23.12 19.84 2d49 s ALA 28 CO -0.11 -2.67 0.08 1.17 0.00 0.00 0.00 175.76 174.23 2d49 n LYS 29 N -4.05 0.97 -2.71 0.00 0.00 -1.15 -3.51 118.16 107.72 2d49 n LYS 29 Ca 0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 58.31 58.31 2d49 n LYS 29 Cb 0.58 -1.11 0.01 0.00 0.00 0.00 0.00 35.03 34.52 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 -1.79 -1.28 -1.62 5.64 2.14 -1.26 -3.98 117.44 115.29 2d49 n TRP 30 Ca -0.02 -0.83 -0.49 0.00 2.07 0.00 0.00 57.50 58.23 2d49 n TRP 30 Cb 0.25 0.41 -0.05 0.00 -0.81 0.00 0.00 31.31 31.11 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 -0.37 1.77 -3.72 -2.67 -0.00 -1.26 -3.66 117.44 107.54 2d49 n TRP 31 Ca -0.03 0.51 -0.12 0.00 -0.00 0.00 0.00 57.50 57.86 2d49 n TRP 31 Cb 0.33 -2.40 -0.10 0.00 -0.00 0.00 0.00 31.31 29.14 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 0.51 -0.01 0.51 5.87 -1.32 0.50 -4.93 115.64 116.78 2d49 s THR 32 Ca 0.80 0.03 -0.03 0.00 -1.21 0.00 0.00 61.69 61.28 2d49 s THR 32 Cb -0.84 -0.60 0.11 0.00 -1.51 0.00 0.00 72.50 69.66 2d49 s THR 32 CO 0.45 0.01 0.70 0.00 -2.21 0.00 0.00 174.62 173.57 2d49 n GLN 33 N 3.26 -0.11 -1.48 7.08 1.13 -1.26 -2.01 117.38 123.98 2d49 n GLN 33 Ca -0.16 -1.64 -0.44 0.00 -1.94 0.00 0.00 57.00 52.82 2d49 n GLN 33 Cb 0.57 -0.55 -0.09 0.00 0.11 0.00 0.00 30.24 30.28 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 -3.10 1.50 -3.84 1.08 6.94 -1.26 -4.88 115.26 111.69 2d49 n ASN 34 Ca 0.11 0.11 -0.12 0.00 -0.02 0.00 0.00 54.58 54.66 2d49 n ASN 34 Cb 0.38 -1.21 -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 7.64 0.23 -0.18 -3.83 2.02 -1.26 -5.07 118.70 118.26 2d49 s GLU 35 Ca 1.16 0.03 -0.29 0.00 0.02 0.00 0.00 54.97 55.89 2d49 s GLU 35 Cb -0.85 0.10 -0.05 0.00 0.10 0.00 0.00 34.13 33.43 2d49 s GLU 35 CO 0.44 -0.04 2.05 1.03 0.02 0.00 0.00 175.26 178.76 2d49 s ARG 36 N -0.30 3.45 0.42 1.61 0.52 -1.26 -4.95 118.95 118.44 2d49 s ARG 36 Ca -0.04 2.05 -0.24 0.00 -0.52 0.00 0.00 55.73 56.97 2d49 s ARG 36 Cb -0.03 -4.27 -0.08 0.00 0.52 0.00 0.00 34.95 31.09 2d49 s ARG 36 CO 0.00 -1.74 1.18 -1.25 0.02 0.00 0.00 175.30 173.52 2d49 s PRO 37 N 5.67 3.94 0.00 3.54 0.04 -1.26 -3.17 135.00 143.77 2d49 s PRO 37 Ca 0.92 1.85 0.00 0.00 0.04 0.00 0.00 61.00 63.81 2d49 s PRO 37 Cb -0.33 -2.59 0.00 0.00 0.04 0.00 0.00 34.50 31.62 2d49 s PRO 37 CO 0.36 -0.41 0.00 0.41 0.04 0.00 0.00 177.00 177.39 2d49 n GLY 38 N 0.58 3.28 0.04 0.56 0.00 -1.26 -4.76 105.19 103.63 2d49 n GLY 38 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.92 0.48 -3.76 2.61 -1.04 -1.19 -4.98 114.28 104.48 2d49 n THR 39 Ca 0.00 -0.46 -0.34 0.00 -2.04 0.00 0.00 64.05 61.21 2d49 n THR 39 Cb 0.00 -0.25 -0.05 0.00 -1.82 0.00 0.00 70.33 68.21 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 -4.21 6.49 0.63 8.00 0.01 -1.19 -4.98 113.70 118.44 2d49 s SER 40 Ca -0.06 0.54 0.40 0.00 1.31 0.00 0.00 55.95 58.15 2d49 s SER 40 Cb 0.07 -2.08 2.08 0.00 0.21 0.00 0.00 66.02 66.30 2d49 s SER 40 CO 0.59 0.23 2.26 -0.78 0.41 0.00 0.00 173.24 175.94 2d49 h ASP 41 N 3.83 0.00 -0.48 2.44 1.82 -1.94 -2.14 116.42 119.95 2d49 h ASP 41 Ca -0.49 0.00 -0.07 0.00 -0.39 0.00 0.00 57.03 56.08 2d49 h ASP 41 Cb 1.19 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.18 2d49 h ASP 41 CO 0.67 0.01 0.05 1.62 -1.61 0.00 0.00 179.24 179.98 2d49 h VAL 42 N 0.00 1.24 -3.47 2.25 3.04 -1.96 -3.41 116.25 113.94 2d49 h VAL 42 Ca -0.00 -0.98 -0.62 0.00 -1.01 0.00 0.00 66.70 64.09 2d49 h VAL 42 Cb 0.15 0.78 -0.15 0.00 -2.01 0.00 0.00 31.29 30.06 2d49 h VAL 42 CO 0.00 0.35 -0.53 0.26 -1.01 0.00 0.00 177.57 176.64 2d49 s TRP 43 N -5.08 3.28 -0.05 3.17 0.52 -0.81 -2.92 118.94 117.06 2d49 s TRP 43 Ca -0.10 0.13 0.02 0.00 0.02 0.00 0.00 56.10 56.17 2d49 s TRP 43 Cb 0.15 -2.20 0.01 0.00 -1.15 0.00 0.00 33.47 30.28 2d49 s TRP 43 CO 0.82 0.08 -0.10 0.00 0.02 0.00 0.00 176.95 177.76 2d49 s ALA 44 N 0.83 1.06 -0.04 0.98 0.00 -1.02 -4.24 121.76 119.32 2d49 s ALA 44 Ca 0.06 -0.32 -0.33 0.00 0.00 0.00 0.00 51.96 51.37 2d49 s ALA 44 Cb -0.13 -0.48 -0.11 0.00 0.00 0.00 0.00 23.12 22.40 2d49 s ALA 44 CO 0.02 0.10 1.91 -0.40 0.00 0.00 0.00 175.76 177.40 2d49 n ASP 45 N 3.74 3.70 -0.84 0.00 5.75 -1.26 -0.34 116.55 127.31 2d49 n ASP 45 Ca -0.23 0.95 0.09 0.00 -0.01 0.00 0.00 54.79 55.59 2d49 n ASP 45 Cb 0.52 -1.43 0.25 0.00 -1.03 0.00 0.00 41.12 39.43 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 6.92 2.82 -1.32 0.11 4.81 0.87 -4.87 118.16 127.50 2d49 n LYS 46 Ca 0.22 -2.81 0.00 0.00 -0.87 0.00 0.00 58.31 54.84 2d49 n LYS 46 Cb 0.33 -1.81 0.00 0.00 0.02 0.00 0.00 35.03 33.57 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 0.47 3.51 3.14 0.00 -1.23 -4.96 105.19 105.57 2d49 n GLY 47 Ca 0.21 -1.63 -0.24 0.00 0.00 0.00 0.00 46.02 44.35 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 2.83 -0.16 4.61 0.00 -1.26 -2.04 121.76 124.74 2d49 s ALA 48 Ca 0.00 -1.77 -0.05 0.00 0.00 0.00 0.00 51.96 50.15 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 0.31 -0.00 0.00 0.00 0.00 0.00 175.76 176.07 2d49 s GLY 50 N 0.31 1.23 -0.03 0.00 0.00 -1.04 -4.69 107.32 103.10 2d49 s GLY 50 Ca -0.01 0.88 0.01 0.00 0.00 0.00 0.00 44.72 45.59 2d49 s GLY 50 CO 0.02 3.30 -0.01 -0.51 0.00 0.00 0.00 173.10 175.89 2d49 s THR 51 N 5.30 0.26 -0.01 0.90 -4.23 -1.26 -4.94 115.64 111.66 2d49 s THR 51 Ca 0.82 0.02 -0.07 0.00 -1.18 0.00 0.00 61.69 61.28 2d49 s THR 51 Cb -0.33 -0.33 -0.05 0.00 1.34 0.00 0.00 72.50 73.13 2d49 s THR 51 CO 0.34 0.15 0.26 -0.83 -0.54 0.00 0.00 174.62 174.00 2d49 s GLY 52 N 0.88 2.25 0.00 3.99 0.00 -1.26 -5.22 107.32 107.96 2d49 s GLY 52 Ca -0.09 -0.56 0.29 0.00 0.00 0.00 0.00 44.72 44.35 2d49 s GLY 52 CO -0.01 -0.35 1.88 1.44 0.00 0.00 0.00 173.10 176.06