#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 5.03 -0.30 0.00 2.01 -1.26 -4.95 115.64 116.16 2d49 s THR 2 Ca 0.00 0.82 -0.19 0.00 0.31 0.00 0.00 61.69 62.63 2d49 s THR 2 Cb 0.00 -3.89 0.19 0.00 0.01 0.00 0.00 72.50 68.81 2d49 s THR 2 CO 0.00 -0.01 1.24 0.00 -0.69 0.00 0.00 174.62 175.16 2d49 s ALA 4 N 2.15 2.04 0.21 0.00 0.00 -1.26 -4.90 121.76 119.99 2d49 s ALA 4 Ca -0.00 0.88 -0.32 0.00 0.00 0.00 0.00 51.96 52.52 2d49 s ALA 4 Cb -0.02 -3.48 -0.12 0.00 0.00 0.00 0.00 23.12 19.50 2d49 s ALA 4 CO -0.16 -2.01 1.70 -2.37 0.00 0.00 0.00 175.76 172.92 2d49 n THR 5 N -2.88 0.10 -1.54 0.00 5.66 -1.26 -3.10 114.28 111.26 2d49 n THR 5 Ca 0.14 -0.02 -0.42 0.00 -3.05 0.00 0.00 64.05 60.69 2d49 n THR 5 Cb 0.50 -1.94 0.00 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 3.74 -0.65 -1.58 1.79 0.00 -1.26 -1.89 120.51 120.66 2d49 n ALA 6 Ca 0.15 0.25 -0.42 0.00 0.00 0.00 0.00 53.44 53.42 2d49 n ALA 6 Cb 0.34 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 17.86 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 -0.46 0.90 -3.66 0.00 -0.00 -0.82 -4.68 117.44 108.72 2d49 n TRP 7 Ca 0.11 0.61 -0.26 0.00 -0.00 0.00 0.00 57.50 57.96 2d49 n TRP 7 Cb 0.37 -2.19 -0.17 0.00 -0.00 0.00 0.00 31.31 29.32 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 -0.73 2.36 0.45 5.87 0.01 -1.26 -4.99 113.70 115.41 2d49 s SER 8 Ca 0.62 -0.58 0.31 0.00 1.31 0.00 0.00 55.95 57.61 2d49 s SER 8 Cb -0.61 -0.35 1.59 0.00 0.21 0.00 0.00 66.02 66.86 2d49 s SER 8 CO 0.58 -0.32 1.94 0.77 0.41 0.00 0.00 173.24 176.62 2d49 h SER 9 N 8.36 0.00 -0.69 2.44 4.64 -1.96 -1.32 113.55 125.03 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 1.14 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.05 2d49 h SER 9 CO 0.29 0.00 0.37 -0.24 -0.87 0.00 0.00 176.83 176.38 2d49 n SER 10 N -2.63 3.93 -3.23 4.97 2.88 -1.26 -4.31 113.62 113.97 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 0.11 -0.73 -0.03 0.00 -0.75 0.00 0.00 64.21 62.80 2d49 n SER 10 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2d49 s SER 11 N -0.75 -0.63 0.18 -3.46 0.01 -0.50 -5.14 113.70 103.41 2d49 s SER 11 Ca 0.44 0.11 -0.32 0.00 1.31 0.00 0.00 55.95 57.49 2d49 s SER 11 Cb 0.36 1.61 -0.11 0.00 0.21 0.00 0.00 66.02 68.10 2d49 s SER 11 CO 0.10 -0.31 1.62 -0.69 0.41 0.00 0.00 173.24 174.36 2d49 s VAL 12 N 2.70 2.43 0.39 3.43 1.01 -1.26 -4.75 120.40 124.35 2d49 s VAL 12 Ca 0.12 0.31 0.08 0.00 0.00 0.00 0.00 61.98 62.48 2d49 s VAL 12 Cb -0.12 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.04 2d49 s VAL 12 CO -0.25 0.02 0.41 -0.31 0.00 0.00 0.00 175.10 174.97 2d49 s TYR 13 N 1.12 2.81 0.09 5.22 2.02 -0.89 -4.95 117.35 122.77 2d49 s TYR 13 Ca 0.71 -0.41 0.00 0.00 -0.37 0.00 0.00 57.07 57.01 2d49 s TYR 13 Cb -0.46 -2.11 -0.00 0.00 -0.40 0.00 0.00 41.96 38.99 2d49 s TYR 13 CO 0.32 -0.10 0.11 0.25 -1.57 0.00 0.00 175.55 174.56 2d49 n THR 14 N -1.58 0.00 -1.68 -0.71 -2.24 -1.25 -0.37 114.28 106.44 2d49 n THR 14 Ca 0.03 -0.53 -0.49 0.00 -2.27 0.00 0.00 64.05 60.79 2d49 n THR 14 Cb 0.60 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 -3.20 -0.57 0.00 0.00 175.07 171.30 2d49 n ASN 15 N -2.20 3.22 0.00 3.42 5.15 -1.24 -0.96 115.26 122.64 2d49 n ASN 15 Ca 0.01 1.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.99 2d49 n ASN 15 Cb 0.16 -1.34 0.00 0.00 -0.53 0.00 0.00 39.78 38.06 2d49 n ASN 15 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2d49 n GLY 16 N 4.20 2.91 3.48 8.20 0.00 -1.23 -4.90 105.19 117.85 2d49 n GLY 16 Ca 0.22 -0.36 -0.50 0.00 0.00 0.00 0.00 46.02 45.39 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 0.61 3.90 -0.02 0.00 -0.14 -4.75 105.19 104.79 2d49 n GLY 17 Ca 0.00 0.91 -0.32 0.00 0.00 0.00 0.00 46.02 46.62 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 7.21 5.30 0.24 2.61 2.01 -1.26 -2.34 115.64 129.42 2d49 s THR 18 Ca 1.08 -0.37 -0.00 0.00 0.31 0.00 0.00 61.69 62.70 2d49 s THR 18 Cb -0.79 -3.56 0.00 0.00 0.01 0.00 0.00 72.50 68.16 2d49 s THR 18 CO 0.48 0.19 0.31 1.33 -0.69 0.00 0.00 174.62 176.24 2d49 n VAL 19 N 0.48 0.00 -4.27 3.82 0.24 0.47 -4.16 118.33 114.90 2d49 n VAL 19 Ca -0.07 -1.27 -0.22 0.00 -2.04 0.00 0.00 64.34 60.75 2d49 n VAL 19 Cb 0.51 0.76 -0.12 0.00 -1.47 0.00 0.00 33.84 33.52 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 -2.49 2.36 -0.30 -1.34 0.15 -0.79 -0.39 113.70 110.89 2d49 s SER 20 Ca 0.21 -0.74 -0.24 0.00 0.70 0.00 0.00 55.95 55.88 2d49 s SER 20 Cb -0.00 -0.12 0.18 0.00 -1.71 0.00 0.00 66.02 64.37 2d49 s SER 20 CO 0.15 -0.02 1.36 -0.47 1.20 0.00 0.00 173.24 175.46 2d49 s TYR 21 N -1.57 -0.12 -1.93 3.44 5.04 0.51 -1.94 117.35 120.78 2d49 s TYR 21 Ca 0.08 0.29 0.00 0.00 -2.44 0.00 0.00 57.07 54.99 2d49 s TYR 21 Cb -0.08 0.42 0.00 0.00 0.35 0.00 0.00 41.96 42.65 2d49 s TYR 21 CO 0.04 -0.06 0.00 -1.71 -1.34 0.00 0.00 175.55 172.49 2d49 n ASN 22 N 1.86 -5.29 0.00 4.32 2.85 -1.26 -0.91 115.26 116.83 2d49 n ASN 22 Ca -0.11 0.39 0.00 0.00 -0.11 0.00 0.00 54.58 54.74 2d49 n ASN 22 Cb 0.57 -4.43 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 -0.72 0.88 1.47 8.20 0.00 -1.26 -5.02 105.19 108.73 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 1.40 -5.07 1.61 3.00 -0.08 -0.42 116.66 115.10 2d49 n ARG 24 Ca 0.00 -1.44 -0.30 0.00 -0.01 0.00 0.00 57.85 56.10 2d49 n ARG 24 Cb 0.00 0.32 -0.17 0.00 0.00 0.00 0.00 32.46 32.61 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 -2.16 2.77 -0.08 0.55 0.01 -0.80 -0.37 114.94 114.86 2d49 s ASN 25 Ca 0.04 -0.49 0.01 0.00 -0.71 0.00 0.00 52.86 51.70 2d49 s ASN 25 Cb -0.00 -1.21 -0.03 0.00 0.41 0.00 0.00 41.25 40.41 2d49 s ASN 25 CO 0.02 0.14 -0.07 -0.31 -1.51 0.00 0.00 177.10 175.37 2d49 s TYR 26 N 0.36 2.92 -0.17 2.20 2.02 0.47 -0.10 117.35 125.07 2d49 s TYR 26 Ca -0.16 -0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.51 2d49 s TYR 26 Cb -0.17 -1.73 0.02 0.00 -0.40 0.00 0.00 41.96 39.68 2d49 s TYR 26 CO 0.07 0.27 -0.20 0.99 -1.57 0.00 0.00 175.55 175.12 2d49 s THR 27 N -0.66 1.99 0.96 -0.71 2.01 0.50 -0.40 115.64 119.33 2d49 s THR 27 Ca 0.10 -0.91 -0.13 0.00 0.31 0.00 0.00 61.69 61.07 2d49 s THR 27 Cb -0.11 -1.79 0.17 0.00 0.01 0.00 0.00 72.50 70.77 2d49 s THR 27 CO 0.02 0.53 1.12 0.00 -0.69 0.00 0.00 174.62 175.59 2d49 s ALA 28 N 1.20 1.35 -0.02 7.40 0.00 -0.99 -2.42 121.76 128.27 2d49 s ALA 28 Ca 0.02 -0.48 0.05 0.00 0.00 0.00 0.00 51.96 51.56 2d49 s ALA 28 Cb -0.14 -3.06 -0.08 0.00 0.00 0.00 0.00 23.12 19.84 2d49 s ALA 28 CO -0.10 -2.59 0.08 1.17 0.00 0.00 0.00 175.76 174.32 2d49 n LYS 29 N -3.99 1.29 -2.82 0.00 3.00 -1.12 -3.52 118.16 111.01 2d49 n LYS 29 Ca 0.06 -0.03 -0.02 0.00 -0.00 0.00 0.00 58.31 58.32 2d49 n LYS 29 Cb 0.58 -1.14 0.01 0.00 0.00 0.00 0.00 35.03 34.49 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 -1.89 -1.11 -1.63 5.64 2.14 -1.26 -4.00 117.44 115.33 2d49 n TRP 30 Ca -0.04 -0.77 -0.50 0.00 2.07 0.00 0.00 57.50 58.26 2d49 n TRP 30 Cb 0.35 0.38 -0.05 0.00 -0.81 0.00 0.00 31.31 31.17 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 -0.41 1.88 -3.72 -2.67 -0.00 -1.26 -3.70 117.44 107.56 2d49 n TRP 31 Ca -0.02 0.46 -0.13 0.00 -0.00 0.00 0.00 57.50 57.81 2d49 n TRP 31 Cb 0.34 -2.44 -0.10 0.00 -0.00 0.00 0.00 31.31 29.11 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 1.01 -0.00 0.53 5.87 -1.32 0.50 -4.93 115.64 117.29 2d49 s THR 32 Ca 0.83 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 61.29 2d49 s THR 32 Cb -0.84 -0.61 0.11 0.00 -1.51 0.00 0.00 72.50 69.65 2d49 s THR 32 CO 0.45 0.00 0.72 0.00 -2.21 0.00 0.00 174.62 173.58 2d49 n GLN 33 N 2.91 -0.14 -1.47 7.08 1.13 -1.26 -2.10 117.38 123.53 2d49 n GLN 33 Ca -0.14 -1.68 -0.45 0.00 -1.94 0.00 0.00 57.00 52.80 2d49 n GLN 33 Cb 0.57 -0.57 -0.09 0.00 0.11 0.00 0.00 30.24 30.26 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 1.48 -3.80 1.08 6.94 -1.26 -4.88 115.26 111.70 2d49 n ASN 34 Ca 0.11 0.13 -0.13 0.00 -0.02 0.00 0.00 54.58 54.67 2d49 n ASN 34 Cb 0.39 -1.21 -0.12 0.00 -2.36 0.00 0.00 39.78 36.49 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 7.60 0.29 -0.18 -3.83 2.02 -1.26 -5.06 118.70 118.28 2d49 s GLU 35 Ca 1.16 0.24 -0.29 0.00 0.02 0.00 0.00 54.97 56.10 2d49 s GLU 35 Cb -0.87 0.14 -0.05 0.00 0.10 0.00 0.00 34.13 33.45 2d49 s GLU 35 CO 0.45 -0.04 2.05 1.03 0.02 0.00 0.00 175.26 178.76 2d49 s ARG 36 N -0.05 3.44 0.46 1.61 1.81 -1.26 -4.95 118.95 120.01 2d49 s ARG 36 Ca -0.02 2.03 -0.23 0.00 -1.72 0.00 0.00 55.73 55.80 2d49 s ARG 36 Cb -0.02 -4.27 -0.07 0.00 -0.45 0.00 0.00 34.95 30.13 2d49 s ARG 36 CO 0.01 -1.75 1.16 -1.25 -0.68 0.00 0.00 175.30 172.79 2d49 s PRO 37 N 5.69 3.75 0.00 3.54 0.04 -1.26 -3.34 135.00 143.43 2d49 s PRO 37 Ca 0.92 1.77 0.00 0.00 0.04 0.00 0.00 61.00 63.73 2d49 s PRO 37 Cb -0.33 -2.40 0.00 0.00 0.04 0.00 0.00 34.50 31.81 2d49 s PRO 37 CO 0.36 -0.56 0.00 0.41 0.04 0.00 0.00 177.00 177.25 2d49 n GLY 38 N 0.44 2.75 0.13 0.56 0.00 -1.23 -4.76 105.19 103.08 2d49 n GLY 38 Ca 0.07 -0.12 0.06 0.00 0.00 0.00 0.00 46.02 46.03 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 0.36 -3.92 2.61 2.02 -1.83 -3.46 112.91 108.69 2d49 h THR 39 Ca 0.00 -1.61 -0.68 0.00 0.77 0.00 0.00 66.41 64.89 2d49 h THR 39 Cb 0.00 1.96 -0.21 0.00 -1.74 0.00 0.00 68.15 68.16 2d49 h THR 39 CO 0.00 0.21 -0.81 -0.55 0.37 0.00 0.00 175.52 174.74 2d49 s SER 40 N -5.88 3.81 0.59 4.18 0.15 -1.25 -5.00 113.70 110.31 2d49 s SER 40 Ca 0.01 -0.46 0.29 0.00 0.70 0.00 0.00 55.95 56.49 2d49 s SER 40 Cb 0.08 -0.59 1.54 0.00 -1.71 0.00 0.00 66.02 65.34 2d49 s SER 40 CO 0.77 0.24 1.96 0.44 1.20 0.00 0.00 173.24 177.85 2d49 h ASP 41 N 4.37 0.00 -0.38 5.45 5.19 -1.96 -1.99 116.42 127.10 2d49 h ASP 41 Ca -0.48 0.00 0.08 0.00 -0.62 0.00 0.00 57.03 56.01 2d49 h ASP 41 Cb 1.16 0.00 -0.08 0.00 0.18 0.00 0.00 39.33 40.58 2d49 h ASP 41 CO 0.47 0.00 -0.20 0.58 -3.12 0.00 0.00 179.24 176.97 2d49 h VAL 42 N 0.00 0.42 -3.39 -1.35 2.07 -1.95 -3.39 116.25 108.66 2d49 h VAL 42 Ca 0.16 0.00 -0.62 0.00 0.82 0.00 0.00 66.70 67.07 2d49 h VAL 42 Cb 0.93 0.42 -0.15 0.00 -1.52 0.00 0.00 31.29 30.97 2d49 h VAL 42 CO -0.00 0.00 -0.53 0.26 0.02 0.00 0.00 177.57 177.32 2d49 s TRP 43 N -6.13 3.30 -0.02 1.57 0.52 -0.75 -2.77 118.94 114.66 2d49 s TRP 43 Ca -0.14 0.14 0.03 0.00 0.02 0.00 0.00 56.10 56.16 2d49 s TRP 43 Cb 0.14 -2.16 -0.01 0.00 -1.15 0.00 0.00 33.47 30.29 2d49 s TRP 43 CO 0.70 0.13 -0.12 0.00 0.02 0.00 0.00 176.95 177.67 2d49 s ALA 44 N 0.65 1.04 -0.06 0.98 0.00 -1.01 -3.47 121.76 119.88 2d49 s ALA 44 Ca 0.06 -0.49 -0.30 0.00 0.00 0.00 0.00 51.96 51.22 2d49 s ALA 44 Cb -0.13 -0.31 -0.08 0.00 0.00 0.00 0.00 23.12 22.61 2d49 s ALA 44 CO 0.01 0.22 2.06 -0.40 0.00 0.00 0.00 175.76 177.65 2d49 n ASP 45 N 2.96 3.78 -0.88 0.00 5.75 -1.26 -0.37 116.55 126.54 2d49 n ASP 45 Ca -0.16 0.67 0.09 0.00 -0.01 0.00 0.00 54.79 55.38 2d49 n ASP 45 Cb 0.55 -1.52 0.26 0.00 -1.03 0.00 0.00 41.12 39.38 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 7.89 2.87 -1.39 0.11 3.00 0.86 -4.90 118.16 126.60 2d49 n LYS 46 Ca 0.24 -2.84 0.00 0.00 -0.00 0.00 0.00 58.31 55.70 2d49 n LYS 46 Cb 0.41 -1.84 0.00 0.00 0.00 0.00 0.00 35.03 33.60 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 -0.54 0.39 3.51 3.14 0.00 -1.23 -4.95 105.19 105.51 2d49 n GLY 47 Ca 0.21 -1.63 -0.25 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.91 121.76 124.86 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 1.49 -0.13 0.00 0.00 -1.07 -4.69 107.32 103.24 2d49 s GLY 50 Ca -0.01 -1.74 -0.32 0.00 0.00 0.00 0.00 44.72 42.65 2d49 s GLY 50 CO 0.02 -1.54 1.07 -1.08 0.00 0.00 0.00 173.10 171.57 2d49 s THR 51 N -3.79 0.00 -0.02 0.90 -1.32 -1.26 -3.77 115.64 106.38 2d49 s THR 51 Ca 0.33 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.79 2d49 s THR 51 Cb 0.07 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 70.02 2d49 s THR 51 CO 0.10 0.00 0.09 -0.83 -2.21 0.00 0.00 174.62 171.77 2d49 s GLY 52 N -2.01 2.03 0.00 6.08 0.00 -1.26 -4.75 107.32 107.42 2d49 s GLY 52 Ca 0.06 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 43.95 2d49 s GLY 52 CO -0.05 -0.69 0.00 1.44 0.00 0.00 0.00 173.10 173.80