#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 2.89 -0.29 0.00 -1.32 -1.26 -4.91 115.64 110.74 2d49 s THR 2 Ca 0.00 0.72 -0.27 0.00 -1.21 0.00 0.00 61.69 60.93 2d49 s THR 2 Cb 0.00 -3.40 0.20 0.00 -1.51 0.00 0.00 72.50 67.79 2d49 s THR 2 CO 0.00 0.05 1.42 0.00 -2.21 0.00 0.00 174.62 173.87 2d49 s ALA 4 N -0.59 3.83 0.08 0.00 0.00 -1.26 -5.03 121.76 118.79 2d49 s ALA 4 Ca 0.09 -0.83 -0.31 0.00 0.00 0.00 0.00 51.96 50.91 2d49 s ALA 4 Cb -0.03 -2.00 -0.10 0.00 0.00 0.00 0.00 23.12 20.99 2d49 s ALA 4 CO -0.12 0.43 1.88 -2.37 0.00 0.00 0.00 175.76 175.58 2d49 n THR 5 N -0.68 0.50 -1.57 0.00 5.66 -1.26 -3.35 114.28 113.58 2d49 n THR 5 Ca -0.05 -0.09 -0.44 0.00 -3.05 0.00 0.00 64.05 60.43 2d49 n THR 5 Cb 0.54 -2.15 -0.01 0.00 -1.55 0.00 0.00 70.33 67.16 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 6.26 -0.39 -1.54 1.79 0.00 -1.26 -1.99 120.51 123.38 2d49 n ALA 6 Ca 0.19 0.34 -0.40 0.00 0.00 0.00 0.00 53.44 53.57 2d49 n ALA 6 Cb 0.38 -1.99 0.03 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 -0.04 0.21 -4.03 0.00 -0.00 -0.97 -4.71 117.44 107.90 2d49 n TRP 7 Ca 0.10 0.51 -0.13 0.00 -0.00 0.00 0.00 57.50 57.98 2d49 n TRP 7 Cb 0.34 -2.08 -0.13 0.00 -0.00 0.00 0.00 31.31 29.43 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 -1.00 0.40 0.18 5.87 0.01 -1.26 -5.03 113.70 112.86 2d49 s SER 8 Ca 0.67 -0.17 0.15 0.00 1.31 0.00 0.00 55.95 57.91 2d49 s SER 8 Cb -0.51 -0.01 -0.04 0.00 0.21 0.00 0.00 66.02 65.67 2d49 s SER 8 CO 0.54 -0.04 1.20 0.77 0.41 0.00 0.00 173.24 176.12 2d49 h SER 9 N 5.69 0.00 -0.81 2.44 4.64 -1.97 -3.28 113.55 120.27 2d49 h SER 9 Ca -0.28 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.70 2d49 h SER 9 Cb 1.20 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.09 2d49 h SER 9 CO 0.48 0.60 0.43 -1.54 -0.87 0.00 0.00 176.83 175.93 2d49 n SER 10 N -3.12 4.18 -3.38 4.97 3.41 -1.26 -4.39 113.62 114.02 2d49 n SER 10 Ca -0.03 -3.30 -0.18 0.00 -0.26 0.00 0.00 58.87 55.10 2d49 n SER 10 Cb 0.80 -0.77 -0.09 0.00 -0.26 0.00 0.00 64.21 63.89 2d49 n SER 10 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2d49 s SER 11 N -1.00 1.51 0.29 4.04 0.15 -1.24 -5.13 113.70 112.32 2d49 s SER 11 Ca 0.52 -1.31 -0.30 0.00 0.70 0.00 0.00 55.95 55.56 2d49 s SER 11 Cb 0.42 0.46 -0.11 0.00 -1.71 0.00 0.00 66.02 65.09 2d49 s SER 11 CO 0.11 -0.31 1.50 0.54 1.20 0.00 0.00 173.24 176.28 2d49 s VAL 12 N 1.77 2.36 0.38 4.45 0.11 -1.26 -4.69 120.40 123.51 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 -0.15 -3.20 -0.04 0.00 -1.53 0.00 0.00 36.38 31.46 2d49 s VAL 12 CO -0.15 0.05 0.22 -0.31 -3.33 0.00 0.00 175.10 171.59 2d49 s TYR 13 N -0.22 2.69 0.07 1.54 2.02 -0.85 -4.98 117.35 117.63 2d49 s TYR 13 Ca 0.59 -0.46 0.00 0.00 -0.37 0.00 0.00 57.07 56.83 2d49 s TYR 13 Cb -0.45 -1.87 -0.00 0.00 -0.40 0.00 0.00 41.96 39.24 2d49 s TYR 13 CO 0.48 0.17 0.08 0.25 -1.57 0.00 0.00 175.55 174.97 2d49 n THR 14 N -1.29 0.00 -1.65 -0.71 -2.24 -1.26 -0.38 114.28 106.76 2d49 n THR 14 Ca -0.01 -0.40 -0.50 0.00 -2.27 0.00 0.00 64.05 60.87 2d49 n THR 14 Cb 0.62 0.23 -0.05 0.00 -2.10 0.00 0.00 70.33 69.03 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 -2.28 2.58 0.00 3.42 5.15 -1.23 -0.34 115.26 122.57 2d49 n ASN 15 Ca 0.01 1.07 0.00 0.00 -0.60 0.00 0.00 54.58 55.06 2d49 n ASN 15 Cb 0.12 -1.30 0.00 0.00 -0.53 0.00 0.00 39.78 38.07 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 3.43 3.27 3.68 8.20 0.00 -1.21 -4.89 105.19 117.67 2d49 n GLY 16 Ca 0.20 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.67 1.51 3.64 -0.02 0.00 0.54 -4.79 105.19 104.39 2d49 n GLY 17 Ca 0.00 0.86 -0.34 0.00 0.00 0.00 0.00 46.02 46.54 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 4.13 4.00 0.36 2.61 2.01 -1.26 -1.59 115.64 125.91 2d49 s THR 18 Ca 0.92 -0.40 -0.00 0.00 0.31 0.00 0.00 61.69 62.52 2d49 s THR 18 Cb -0.66 -2.68 0.00 0.00 0.01 0.00 0.00 72.50 69.18 2d49 s THR 18 CO 0.50 0.57 0.47 1.33 -0.69 0.00 0.00 174.62 176.81 2d49 n VAL 19 N 2.08 0.00 -4.36 3.82 0.24 -0.25 -4.14 118.33 115.71 2d49 n VAL 19 Ca -0.18 -1.95 -0.28 0.00 -2.04 0.00 0.00 64.34 59.89 2d49 n VAL 19 Cb 0.53 1.15 -0.13 0.00 -1.47 0.00 0.00 33.84 33.93 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 -3.27 3.13 -0.30 -1.34 0.15 -0.84 -0.88 113.70 110.35 2d49 s SER 20 Ca 0.32 -0.74 -0.23 0.00 0.70 0.00 0.00 55.95 56.00 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 0.23 0.15 1.34 -0.47 1.20 0.00 0.00 173.24 175.69 2d49 s TYR 21 N -1.10 -0.13 -1.94 3.44 6.14 0.57 -2.29 117.35 122.04 2d49 s TYR 21 Ca 0.12 0.29 0.00 0.00 0.64 0.00 0.00 57.07 58.12 2d49 s TYR 21 Cb -0.10 0.37 0.00 0.00 0.42 0.00 0.00 41.96 42.65 2d49 s TYR 21 CO 0.06 -0.06 0.00 -1.71 0.64 0.00 0.00 175.55 174.47 2d49 n ASN 22 N 2.06 -5.29 0.00 4.32 5.15 -1.26 -1.16 115.26 119.08 2d49 n ASN 22 Ca -0.12 0.40 0.00 0.00 -0.60 0.00 0.00 54.58 54.26 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 -0.71 2.39 1.48 8.20 0.00 -1.26 -5.01 105.19 110.27 2d49 n GLY 23 Ca -0.19 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 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 1.03 -4.86 1.61 3.00 -0.31 -0.39 116.66 114.75 2d49 n ARG 24 Ca 0.00 -1.27 -0.31 0.00 -0.01 0.00 0.00 57.85 56.26 2d49 n ARG 24 Cb 0.00 0.04 -0.17 0.00 0.00 0.00 0.00 32.46 32.33 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 -2.30 2.85 -0.10 0.55 0.01 -1.01 -0.32 114.94 114.61 2d49 s ASN 25 Ca 0.17 -0.52 -0.03 0.00 -0.71 0.00 0.00 52.86 51.77 2d49 s ASN 25 Cb -0.01 -1.30 -0.03 0.00 0.41 0.00 0.00 41.25 40.31 2d49 s ASN 25 CO 0.11 0.10 0.03 -0.31 -1.51 0.00 0.00 177.10 175.52 2d49 s TYR 26 N 0.62 3.25 -0.17 2.20 2.02 -0.06 -0.16 117.35 125.06 2d49 s TYR 26 Ca -0.13 0.24 0.01 0.00 -0.37 0.00 0.00 57.07 56.82 2d49 s TYR 26 Cb -0.17 -1.84 0.02 0.00 -0.40 0.00 0.00 41.96 39.57 2d49 s TYR 26 CO 0.03 0.49 -0.19 0.99 -1.57 0.00 0.00 175.55 175.31 2d49 s THR 27 N -0.81 1.93 0.99 -0.71 2.01 0.46 -1.09 115.64 118.42 2d49 s THR 27 Ca 0.13 -0.86 -0.13 0.00 0.31 0.00 0.00 61.69 61.14 2d49 s THR 27 Cb -0.12 -1.75 0.18 0.00 0.01 0.00 0.00 72.50 70.83 2d49 s THR 27 CO 0.03 0.52 1.10 0.00 -0.69 0.00 0.00 174.62 175.58 2d49 s ALA 28 N 1.27 1.09 -0.02 7.40 0.00 -0.62 -2.43 121.76 128.45 2d49 s ALA 28 Ca 0.03 -0.44 0.04 0.00 0.00 0.00 0.00 51.96 51.60 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 -2.77 0.07 1.63 0.00 0.00 0.00 175.76 174.58 2d49 n LYS 29 N -4.12 1.31 -2.76 0.00 4.76 -1.16 -3.31 118.16 112.88 2d49 n LYS 29 Ca 0.06 -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 32.68 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 -1.84 -1.40 -1.64 2.13 2.14 -1.26 -4.01 117.44 111.56 2d49 n TRP 30 Ca -0.03 -0.92 -0.50 0.00 2.07 0.00 0.00 57.50 58.12 2d49 n TRP 30 Cb 0.31 0.45 -0.05 0.00 -0.81 0.00 0.00 31.31 31.21 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 1.92 -3.72 -2.67 -0.00 -1.26 -3.52 117.44 107.82 2d49 n TRP 31 Ca -0.03 0.43 -0.13 0.00 -0.00 0.00 0.00 57.50 57.78 2d49 n TRP 31 Cb 0.35 -2.45 -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 1.30 -0.00 0.55 5.87 -1.32 0.49 -4.94 115.64 117.59 2d49 s THR 32 Ca 0.85 0.02 -0.03 0.00 -1.21 0.00 0.00 61.69 61.31 2d49 s THR 32 Cb -0.84 -0.61 0.12 0.00 -1.51 0.00 0.00 72.50 69.65 2d49 s THR 32 CO 0.46 0.01 0.76 1.67 -2.21 0.00 0.00 174.62 175.30 2d49 n GLN 33 N 3.12 -0.17 -1.49 7.08 -0.06 -1.26 -2.00 117.38 122.60 2d49 n GLN 33 Ca -0.15 -1.76 -0.43 0.00 -2.00 0.00 0.00 57.00 52.66 2d49 n GLN 33 Cb 0.57 -0.60 -0.08 0.00 -4.06 0.00 0.00 30.24 26.07 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 -3.12 1.59 -3.83 1.69 6.94 -1.26 -4.86 115.26 112.40 2d49 n ASN 34 Ca 0.11 0.03 -0.12 0.00 -0.02 0.00 0.00 54.58 54.59 2d49 n ASN 34 Cb 0.41 -1.26 -0.12 0.00 -2.36 0.00 0.00 39.78 36.45 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 7.78 0.26 -0.18 -3.83 0.41 -1.26 -5.07 118.70 116.82 2d49 s GLU 35 Ca 1.14 0.05 -0.29 0.00 -0.41 0.00 0.00 54.97 55.47 2d49 s GLU 35 Cb -0.77 0.12 -0.05 0.00 -1.78 0.00 0.00 34.13 31.65 2d49 s GLU 35 CO 0.42 -0.05 2.05 1.03 -0.49 0.00 0.00 175.26 178.22 2d49 s ARG 36 N -0.31 3.44 0.46 1.61 0.52 -1.26 -4.95 118.95 118.46 2d49 s ARG 36 Ca -0.04 2.04 -0.23 0.00 -0.52 0.00 0.00 55.73 56.98 2d49 s ARG 36 Cb -0.03 -4.27 -0.07 0.00 0.52 0.00 0.00 34.95 31.09 2d49 s ARG 36 CO 0.01 -1.75 1.16 -1.25 0.02 0.00 0.00 175.30 173.49 2d49 s PRO 37 N 5.70 3.77 0.00 3.54 0.04 -1.26 -3.36 135.00 143.42 2d49 s PRO 37 Ca 0.92 1.77 0.00 0.00 0.04 0.00 0.00 61.00 63.74 2d49 s PRO 37 Cb -0.33 -2.41 0.00 0.00 0.04 0.00 0.00 34.50 31.80 2d49 s PRO 37 CO 0.36 -0.55 0.00 0.41 0.04 0.00 0.00 177.00 177.26 2d49 n GLY 38 N 0.45 2.67 0.13 0.56 0.00 -1.24 -4.76 105.19 103.00 2d49 n GLY 38 Ca 0.07 -0.24 0.03 0.00 0.00 0.00 0.00 46.02 45.88 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 0.65 -3.89 2.61 2.02 -1.85 -3.46 112.91 108.99 2d49 h THR 39 Ca 0.00 -1.98 -0.69 0.00 0.77 0.00 0.00 66.41 64.51 2d49 h THR 39 Cb 0.00 2.24 -0.21 0.00 -1.74 0.00 0.00 68.15 68.44 2d49 h THR 39 CO 0.00 0.37 -0.85 -0.55 0.37 0.00 0.00 175.52 174.87 2d49 s SER 40 N -6.22 3.51 0.64 4.18 0.15 -1.25 -5.00 113.70 109.71 2d49 s SER 40 Ca 0.02 -0.66 0.35 0.00 0.70 0.00 0.00 55.95 56.37 2d49 s SER 40 Cb 0.08 -0.35 1.98 0.00 -1.71 0.00 0.00 66.02 66.02 2d49 s SER 40 CO 0.76 0.19 2.19 0.44 1.20 0.00 0.00 173.24 178.01 2d49 h ASP 41 N 3.95 0.00 -0.64 5.45 5.19 -1.95 -2.31 116.42 126.11 2d49 h ASP 41 Ca -0.50 0.00 0.13 0.00 -0.62 0.00 0.00 57.03 56.04 2d49 h ASP 41 Cb 1.17 0.00 -0.09 0.00 0.18 0.00 0.00 39.33 40.58 2d49 h ASP 41 CO 0.42 0.00 0.12 0.58 -3.12 0.00 0.00 179.24 177.25 2d49 h VAL 42 N 0.00 0.59 -3.33 -1.35 2.07 -1.96 -3.39 116.25 108.88 2d49 h VAL 42 Ca 0.02 -0.08 -0.63 0.00 0.82 0.00 0.00 66.70 66.83 2d49 h VAL 42 Cb 0.29 0.32 -0.20 0.00 -1.52 0.00 0.00 31.29 30.18 2d49 h VAL 42 CO -0.00 0.04 -0.64 0.26 0.02 0.00 0.00 177.57 177.26 2d49 s TRP 43 N -6.10 3.09 -0.06 1.57 0.52 -0.87 -2.99 118.94 114.10 2d49 s TRP 43 Ca -0.13 -0.23 0.02 0.00 0.02 0.00 0.00 56.10 55.78 2d49 s TRP 43 Cb 0.19 -2.02 0.02 0.00 -1.15 0.00 0.00 33.47 30.50 2d49 s TRP 43 CO 0.74 -0.03 -0.10 0.00 0.02 0.00 0.00 176.95 177.59 2d49 s ALA 44 N 0.52 1.09 0.02 0.98 0.00 -1.02 -3.65 121.76 119.69 2d49 s ALA 44 Ca -0.01 -0.32 -0.33 0.00 0.00 0.00 0.00 51.96 51.31 2d49 s ALA 44 Cb -0.14 -0.55 -0.11 0.00 0.00 0.00 0.00 23.12 22.32 2d49 s ALA 44 CO 0.02 0.03 1.85 -0.40 0.00 0.00 0.00 175.76 177.26 2d49 n ASP 45 N 3.98 3.69 -0.87 0.00 5.75 -1.26 -0.41 116.55 127.43 2d49 n ASP 45 Ca -0.23 0.97 0.09 0.00 -0.01 0.00 0.00 54.79 55.62 2d49 n ASP 45 Cb 0.51 -1.45 0.26 0.00 -1.03 0.00 0.00 41.12 39.41 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 6.18 2.88 -1.26 0.11 3.00 0.78 -4.87 118.16 124.98 2d49 n LYS 46 Ca 0.20 -2.84 0.00 0.00 -0.00 0.00 0.00 58.31 55.67 2d49 n LYS 46 Cb 0.34 -1.84 0.00 0.00 0.00 0.00 0.00 35.03 33.53 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 0.48 3.51 3.14 0.00 -1.24 -4.97 105.19 105.57 2d49 n GLY 47 Ca 0.21 -1.61 -0.25 0.00 0.00 0.00 0.00 46.02 44.38 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 2.81 -0.16 4.61 0.00 -1.26 -2.41 121.76 124.35 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 0.33 -0.00 0.00 0.00 0.00 0.00 175.76 176.08 2d49 s GLY 50 N 0.32 1.56 0.16 0.00 0.00 -0.81 -4.73 107.32 103.81 2d49 s GLY 50 Ca -0.01 -0.81 -0.15 0.00 0.00 0.00 0.00 44.72 43.74 2d49 s GLY 50 CO 0.02 1.89 0.58 -0.51 0.00 0.00 0.00 173.10 175.08 2d49 s THR 51 N 3.44 4.81 -0.10 0.90 -4.23 -1.26 -4.65 115.64 114.55 2d49 s THR 51 Ca 0.33 0.91 -0.22 0.00 -1.18 0.00 0.00 61.69 61.54 2d49 s THR 51 Cb -0.12 -3.76 0.05 0.00 1.34 0.00 0.00 72.50 70.02 2d49 s THR 51 CO 0.23 0.25 0.53 -0.83 -0.54 0.00 0.00 174.62 174.25 2d49 s GLY 52 N -1.68 -0.40 0.00 3.99 0.00 -1.26 -5.11 107.32 102.86 2d49 s GLY 52 Ca 0.38 1.13 0.00 0.00 0.00 0.00 0.00 44.72 46.23 2d49 s GLY 52 CO 0.19 0.87 0.23 -1.26 0.00 0.00 0.00 173.10 173.13