#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bah s THR 3 N 0.00 5.39 -0.39 4.37 -4.23 -1.26 -5.03 115.64 114.48 1bah s THR 3 Ca 0.00 0.02 0.10 0.00 -1.18 0.00 0.00 61.69 60.63 1bah s THR 3 Cb 0.00 -3.54 0.44 0.00 1.34 0.00 0.00 72.50 70.74 1bah s THR 3 CO 0.00 0.37 1.05 -0.46 -0.54 0.00 0.00 174.62 175.04 1bah n ASN 4 N 1.11 3.39 -4.96 3.99 6.94 -1.26 -4.59 115.26 119.88 1bah n ASN 4 Ca -0.12 -3.31 -0.23 0.00 -0.02 0.00 0.00 54.58 50.90 1bah n ASN 4 Cb 0.53 -0.49 -0.02 0.00 -2.36 0.00 0.00 39.78 37.44 1bah n ASN 4 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1bah s VAL 5 N -4.56 5.27 -0.09 3.53 1.01 -1.26 -5.12 120.40 119.19 1bah s VAL 5 Ca 0.40 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 61.39 1bah s VAL 5 Cb 0.42 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.94 1bah s VAL 5 CO -0.10 -0.26 0.33 -0.94 0.00 0.00 0.00 175.10 174.14 1bah s SER 6 N -3.71 6.60 0.04 3.32 1.04 -1.26 -4.44 113.70 115.28 1bah s SER 6 Ca 0.35 0.71 0.03 0.00 0.48 0.00 0.00 55.95 57.51 1bah s SER 6 Cb -0.10 -2.20 -0.02 0.00 0.10 0.00 0.00 66.02 63.80 1bah s SER 6 CO 0.29 0.22 -0.09 0.00 0.98 0.00 0.00 173.24 174.64 1bah n THR 8 N 1.76 0.00 -4.44 0.00 -2.24 -1.26 -3.82 114.28 104.28 1bah n THR 8 Ca -0.20 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.23 1bah n THR 8 Cb 0.55 -0.77 -0.10 0.00 -2.10 0.00 0.00 70.33 67.91 1bah n THR 8 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1bah s THR 9 N -1.83 4.14 -1.06 4.28 -4.23 -1.26 -5.05 115.64 110.63 1bah s THR 9 Ca 0.00 -0.31 -0.16 0.00 -1.18 0.00 0.00 61.69 60.04 1bah s THR 9 Cb 0.00 -2.73 0.15 0.00 1.34 0.00 0.00 72.50 71.26 1bah s THR 9 CO 0.00 0.60 1.27 -0.94 -0.54 0.00 0.00 174.62 175.01 1bah s SER 10 N -0.82 6.85 0.00 3.99 1.04 -1.26 -3.16 113.70 120.34 1bah s SER 10 Ca 0.12 -2.53 0.00 0.00 0.48 0.00 0.00 55.95 54.03 1bah s SER 10 Cb -0.11 -2.39 0.00 0.00 0.10 0.00 0.00 66.02 63.61 1bah s SER 10 CO 0.02 -0.89 0.00 1.17 0.98 0.00 0.00 173.24 174.52 1bah n LYS 11 N 6.02 0.00 0.00 4.02 4.81 -1.26 -5.09 118.16 126.66 1bah n LYS 11 Ca 0.30 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 1bah n LYS 11 Cb 0.46 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.51 1bah n LYS 11 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1bah n GLU 12 N -1.33 0.10 0.00 1.64 2.13 -1.19 -4.72 120.64 117.27 1bah n GLU 12 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1bah n GLU 12 Cb 0.00 -1.18 0.00 0.00 0.27 0.00 0.00 31.44 30.53 1bah n GLU 12 CO 0.00 0.00 0.00 0.91 -0.41 0.00 0.00 177.13 177.63 1bah n TRP 14 N 0.61 0.00 1.08 4.31 8.01 -1.26 -4.29 117.44 125.89 1bah n TRP 14 Ca 0.00 0.00 0.12 0.00 -1.31 0.00 0.00 57.50 56.31 1bah n TRP 14 Cb 0.03 -0.08 0.30 0.00 -2.01 0.00 0.00 31.31 29.55 1bah n TRP 14 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 1bah n SER 15 N 0.12 0.64 -0.04 -0.99 3.41 -1.26 -3.40 113.62 112.09 1bah n SER 15 Ca 0.00 -0.43 0.00 0.00 -0.26 0.00 0.00 58.87 58.18 1bah n SER 15 Cb 0.00 0.20 -0.15 0.00 -0.26 0.00 0.00 64.21 64.00 1bah n SER 15 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1bah n VAL 16 N -1.25 0.79 0.19 -3.33 0.31 -1.26 -3.36 118.33 110.42 1bah n VAL 16 Ca 0.08 -0.69 0.12 0.00 -0.01 0.00 0.00 64.34 63.84 1bah n VAL 16 Cb 0.34 -0.31 0.10 0.00 -0.91 0.00 0.00 33.84 33.06 1bah n VAL 16 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1bah h GLN 18 N 0.00 0.14 0.00 0.00 4.15 -1.56 -2.80 115.11 115.04 1bah h GLN 18 Ca 0.00 -0.25 -0.00 0.00 0.77 0.00 0.00 58.65 59.17 1bah h GLN 18 Cb 0.99 0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.77 1bah h GLN 18 CO 0.00 0.88 -0.60 0.00 -1.93 0.00 0.00 178.83 177.18 1bah h ARG 19 N 0.04 0.00 0.00 1.69 2.47 -1.72 -3.35 114.38 113.50 1bah h ARG 19 Ca -0.35 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.37 1bah h ARG 19 Cb 2.03 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.35 1bah h ARG 19 CO 0.09 0.01 -0.34 -0.07 0.56 0.00 0.00 179.97 180.22 1bah h LEU 20 N 0.00 0.00 0.00 3.04 -0.00 -1.74 -3.49 115.31 113.12 1bah h LEU 20 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1bah h LEU 20 Cb 1.02 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.68 1bah h LEU 20 CO 0.00 0.51 0.00 1.41 -0.00 0.00 0.00 178.44 180.36 1bah n HIS 21 N -3.87 0.00 -2.66 1.13 8.25 -1.15 -5.10 115.22 111.82 1bah n HIS 21 Ca -0.05 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.38 1bah n HIS 21 Cb 0.18 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.39 1bah n HIS 21 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1bah n ASN 22 N 0.00 -1.15 -3.69 0.41 6.94 -1.07 -4.79 115.26 111.91 1bah n ASN 22 Ca 0.00 -1.75 -0.14 0.00 -0.02 0.00 0.00 54.58 52.68 1bah n ASN 22 Cb 0.00 1.10 -0.07 0.00 -2.36 0.00 0.00 39.78 38.45 1bah n ASN 22 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1bah s THR 23 N 0.03 0.00 -0.17 5.53 -1.32 -1.13 -4.98 115.64 113.60 1bah s THR 23 Ca 0.19 -1.75 0.20 0.00 -1.21 0.00 0.00 61.69 59.12 1bah s THR 23 Cb 0.28 -2.49 0.42 0.00 -1.51 0.00 0.00 72.50 69.21 1bah s THR 23 CO -0.20 0.00 1.19 -1.54 -2.21 0.00 0.00 174.62 171.86 1bah n SER 24 N -0.90 0.67 -3.65 8.08 3.41 -1.26 -3.24 113.62 116.74 1bah n SER 24 Ca 0.02 -2.04 -0.20 0.00 -0.26 0.00 0.00 58.87 56.38 1bah n SER 24 Cb 0.63 -0.17 -0.17 0.00 -0.26 0.00 0.00 64.21 64.24 1bah n SER 24 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bah s ARG 25 N -1.73 -0.01 0.00 4.33 3.03 -1.26 -5.03 118.95 118.28 1bah s ARG 25 Ca 0.23 0.32 0.00 0.00 2.03 0.00 0.00 55.73 58.31 1bah s ARG 25 Cb 0.33 -0.76 0.00 0.00 -1.03 0.00 0.00 34.95 33.49 1bah s ARG 25 CO -0.09 -0.41 0.00 0.41 -1.13 0.00 0.00 175.30 174.08 1bah n GLY 26 N 5.30 2.40 0.00 3.88 0.00 -1.26 -2.39 105.19 113.13 1bah n GLY 26 Ca -0.04 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1bah n GLY 26 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bah n LYS 27 N 0.00 2.52 -3.95 1.61 5.02 -1.24 -4.37 118.16 117.76 1bah n LYS 27 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 1bah n LYS 27 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 34.99 1bah n LYS 27 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bah n MET 29 N -0.48 0.00 0.04 0.00 1.56 -1.08 -4.95 117.12 112.22 1bah n MET 29 Ca -0.03 0.00 -0.22 0.00 -0.27 0.00 0.00 57.70 57.18 1bah n MET 29 Cb 0.61 0.00 -0.14 0.00 2.15 0.00 0.00 33.22 35.83 1bah n MET 29 CO 0.00 0.00 0.00 -2.95 -0.73 0.00 0.00 175.97 172.29 1bah h ASN 30 N 0.00 0.49 0.00 6.12 -1.07 -1.98 -3.45 115.58 115.70 1bah h ASN 30 Ca 0.00 -0.90 0.00 0.00 0.07 0.00 0.00 56.30 55.47 1bah h ASN 30 Cb 0.00 -0.16 0.00 0.00 -2.07 0.00 0.00 38.32 36.09 1bah h ASN 30 CO 0.00 1.68 0.00 0.29 0.07 0.00 0.00 177.43 179.47 1bah n LYS 31 N -3.79 0.00 0.00 4.14 4.76 -1.25 -4.75 118.16 117.27 1bah n LYS 31 Ca -0.24 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.20 1bah n LYS 31 Cb 0.97 -0.29 0.00 0.00 -1.84 0.00 0.00 35.03 33.87 1bah n LYS 31 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1bah n LYS 32 N 0.00 0.00 0.00 1.97 2.85 -1.25 -2.37 118.16 119.36 1bah n LYS 32 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1bah n LYS 32 Cb 0.19 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.57 1bah n LYS 32 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 1bah n ARG 34 N 0.00 -1.34 -3.80 -1.58 0.63 -0.84 -2.62 116.66 107.12 1bah n ARG 34 Ca 0.00 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.80 1bah n ARG 34 Cb 0.00 0.00 -0.13 0.00 0.45 0.00 0.00 32.46 32.78 1bah n ARG 34 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1bah n TYR 36 N 3.21 0.38 1.94 0.00 4.01 -1.00 -4.93 117.16 120.77 1bah n TYR 36 Ca -0.15 -3.67 0.16 0.00 -0.16 0.00 0.00 57.90 54.07 1bah n TYR 36 Cb 0.58 -0.39 0.92 0.00 -0.31 0.00 0.00 39.34 40.14 1bah n TYR 36 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83