#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a0h h GLU 2 N 0.00 0.00 0.00 2.12 -0.00 -2.06 0.24 114.58 114.89 3a0h h GLU 2 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 3a0h h GLU 2 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 3a0h h GLU 2 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 179.01 179.26 3a0h n THR 3 N -3.86 0.52 0.04 -1.06 -2.24 -1.26 -1.68 114.28 104.74 3a0h n THR 3 Ca 0.03 0.13 -0.22 0.00 -2.27 0.00 0.00 64.05 61.72 3a0h n THR 3 Cb 0.37 -0.77 -0.14 0.00 -2.10 0.00 0.00 70.33 67.69 3a0h n THR 3 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 3a0h h ILE 4 N 0.00 0.99 -0.90 2.28 -2.65 -0.93 -2.59 117.51 113.71 3a0h h ILE 4 Ca 0.00 -2.45 0.18 0.00 1.03 0.00 0.00 64.86 63.63 3a0h h ILE 4 Cb 0.35 2.75 -0.07 0.00 -2.05 0.00 0.00 36.82 37.79 3a0h h ILE 4 CO 0.00 0.77 0.59 0.74 0.03 0.00 0.00 178.15 180.28 3a0h h THR 5 N -0.12 0.72 0.05 0.16 2.02 -1.08 1.68 112.91 116.35 3a0h h THR 5 Ca -0.32 -0.18 -0.00 0.00 0.77 0.00 0.00 66.41 66.68 3a0h h THR 5 Cb 1.91 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 3a0h h THR 5 CO 0.11 0.09 -0.03 1.88 0.37 0.00 0.00 175.52 177.95 3a0h h TYR 6 N 0.52 -0.07 0.00 3.16 0.05 -1.37 -2.88 116.97 116.38 3a0h h TYR 6 Ca 0.47 -0.00 -0.03 0.00 0.05 0.00 0.00 58.73 59.22 3a0h h TYR 6 Cb 1.01 0.02 -0.00 0.00 1.01 0.00 0.00 36.73 38.77 3a0h h TYR 6 CO -0.00 0.50 -0.14 0.28 -1.05 0.00 0.00 178.16 177.74 3a0h h VAL 7 N -0.70 0.63 -0.11 -2.88 2.07 -0.39 -1.54 116.25 113.34 3a0h h VAL 7 Ca -0.01 -0.61 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 3a0h h VAL 7 Cb 0.59 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 3a0h h VAL 7 CO 0.01 0.14 -0.20 0.15 0.02 0.00 0.00 177.57 177.69 3a0h h PHE 8 N 0.00 0.42 0.22 1.57 3.57 0.24 -1.78 116.94 121.18 3a0h h PHE 8 Ca -0.00 -0.15 -0.01 0.00 3.53 0.00 0.00 57.97 61.34 3a0h h PHE 8 Cb 0.38 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.04 3a0h h PHE 8 CO 0.00 0.81 -0.13 0.82 -2.23 0.00 0.00 178.31 177.59 3a0h h ILE 9 N -0.10 0.00 -0.56 1.41 2.04 -1.27 0.89 117.51 119.93 3a0h h ILE 9 Ca 0.01 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.04 3a0h h ILE 9 Cb 0.78 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.76 3a0h h ILE 9 CO 0.05 0.00 0.10 0.33 0.00 0.00 0.00 178.15 178.62 3a0h n PHE 10 N -2.99 0.44 -0.03 1.37 -0.00 -0.60 -1.16 117.46 114.50 3a0h n PHE 10 Ca -0.04 0.67 -0.00 0.00 -0.00 0.00 0.00 57.45 58.08 3a0h n PHE 10 Cb 0.13 -0.97 -0.00 0.00 -0.00 0.00 0.00 39.48 38.64 3a0h n PHE 10 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3a0h h ALA 11 N 1.11 -0.00 -1.41 3.13 0.00 -0.97 -3.17 119.26 117.95 3a0h h ALA 11 Ca 0.38 -0.00 0.41 0.00 0.00 0.00 0.00 54.91 55.70 3a0h h ALA 11 Cb 0.86 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.60 3a0h h ALA 11 CO -0.50 -0.00 1.21 0.00 0.00 0.00 0.00 179.25 179.96 3a0h h ILE 13 N 0.00 1.32 -0.06 0.00 2.04 -1.21 -1.97 117.51 117.63 3a0h h ILE 13 Ca 0.67 -1.75 -0.04 0.00 1.00 0.00 0.00 64.86 64.74 3a0h h ILE 13 Cb 3.08 1.73 -0.01 0.00 -0.74 0.00 0.00 36.82 40.88 3a0h h ILE 13 CO -0.01 0.54 -0.13 -0.29 0.00 0.00 0.00 178.15 178.26 3a0h h ILE 14 N 0.41 1.13 0.00 -0.67 2.10 0.98 -1.03 117.51 120.44 3a0h h ILE 14 Ca 0.02 -0.61 0.00 0.00 1.08 0.00 0.00 64.86 65.35 3a0h h ILE 14 Cb 1.04 1.24 0.00 0.00 -1.09 0.00 0.00 36.82 38.01 3a0h h ILE 14 CO 0.10 0.18 -0.24 0.00 -1.08 0.00 0.00 178.15 177.11 3a0h h ALA 15 N 1.78 0.85 -0.00 0.18 0.00 -1.17 -2.52 119.26 118.37 3a0h h ALA 15 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3a0h h ALA 15 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3a0h h ALA 15 CO 0.02 0.00 -0.06 -0.11 0.00 0.00 0.00 179.25 179.10 3a0h n LEU 16 N -2.30 0.09 0.03 0.00 7.94 -0.42 -2.23 117.00 120.12 3a0h n LEU 16 Ca 0.04 0.35 -0.22 0.00 -1.11 0.00 0.00 56.01 55.07 3a0h n LEU 16 Cb 0.45 -0.39 -0.14 0.00 0.53 0.00 0.00 43.42 43.86 3a0h n LEU 16 CO 0.33 0.02 -0.64 -0.26 -1.11 0.00 0.00 177.39 175.73 3a0h h PHE 17 N 0.05 0.58 0.00 1.96 0.05 -1.12 -3.02 116.94 115.45 3a0h h PHE 17 Ca 0.00 -0.42 0.00 0.00 3.82 0.00 0.00 57.97 61.37 3a0h h PHE 17 Cb 0.43 -0.02 0.00 0.00 2.00 0.00 0.00 35.95 38.36 3a0h h PHE 17 CO 0.00 1.71 0.00 0.34 -0.18 0.00 0.00 178.31 180.18 3a0h n PHE 18 N -3.60 0.00 -0.06 -0.55 7.35 -0.95 -2.34 117.46 117.30 3a0h n PHE 18 Ca -0.28 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.32 3a0h n PHE 18 Cb 1.04 -0.29 -0.03 0.00 0.35 0.00 0.00 39.48 40.55 3a0h n PHE 18 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 3a0h h PHE 19 N 0.00 -0.87 0.00 -5.13 0.05 -1.67 -0.70 116.94 108.62 3a0h h PHE 19 Ca 0.00 0.05 0.00 0.00 3.82 0.00 0.00 57.97 61.84 3a0h h PHE 19 Cb 0.00 0.42 0.00 0.00 2.00 0.00 0.00 35.95 38.37 3a0h h PHE 19 CO -0.13 -0.38 0.10 0.00 -0.18 0.00 0.00 178.31 177.72 3a0h h ALA 20 N 0.61 1.07 0.00 2.45 0.00 -1.57 0.46 119.26 122.28 3a0h h ALA 20 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.69 3a0h h ALA 20 Cb 0.53 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 3a0h h ALA 20 CO -0.44 -0.07 -2.26 -0.89 0.00 0.00 0.00 179.25 175.58 3a0h n ILE 21 N -2.24 1.25 0.02 0.00 5.41 -0.75 -4.27 119.36 118.77 3a0h n ILE 21 Ca -0.01 -0.40 0.07 0.00 1.00 0.00 0.00 62.75 63.41 3a0h n ILE 21 Cb 0.13 -1.55 -0.11 0.00 -0.71 0.00 0.00 39.64 37.41 3a0h n ILE 21 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 3a0h n PHE 22 N -3.60 0.44 -1.64 1.39 3.01 -0.34 -4.19 117.46 112.52 3a0h n PHE 22 Ca -0.42 0.13 0.06 0.00 1.01 0.00 0.00 57.45 58.23 3a0h n PHE 22 Cb 0.86 -0.79 0.19 0.00 -0.01 0.00 0.00 39.48 39.74 3a0h n PHE 22 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 3a0h n PHE 23 N -2.54 0.00 -2.35 1.38 0.99 0.16 -5.03 117.46 110.06 3a0h n PHE 23 Ca -0.07 -1.40 -0.33 0.00 -0.00 0.00 0.00 57.45 55.64 3a0h n PHE 23 Cb 0.68 -0.24 -0.02 0.00 -1.00 0.00 0.00 39.48 38.90 3a0h n PHE 23 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.76 175.78 3a0h s ARG 24 N -2.98 3.64 -0.18 -1.08 1.04 -0.90 -4.82 118.95 113.67 3a0h s ARG 24 Ca 0.37 1.26 -0.29 0.00 -1.04 0.00 0.00 55.73 56.03 3a0h s ARG 24 Cb 0.37 -2.08 -0.03 0.00 -2.04 0.00 0.00 34.95 31.17 3a0h s ARG 24 CO -0.07 -0.55 1.49 -2.00 -0.04 0.00 0.00 175.30 174.13 3a0h s GLU 25 N -3.63 4.01 0.74 3.89 2.12 -1.26 -4.98 118.70 119.60 3a0h s GLU 25 Ca 0.65 1.72 -0.14 0.00 0.36 0.00 0.00 54.97 57.56 3a0h s GLU 25 Cb -0.15 -3.94 0.05 0.00 0.26 0.00 0.00 34.13 30.35 3a0h s GLU 25 CO 0.27 -1.02 1.18 -1.25 -0.54 0.00 0.00 175.26 173.90 3a0h s PRO 26 N 4.17 2.09 -0.45 4.30 0.04 -1.26 -5.00 135.00 138.89 3a0h s PRO 26 Ca 0.66 1.67 -0.29 0.00 0.04 0.00 0.00 61.00 63.08 3a0h s PRO 26 Cb -0.25 -1.84 0.03 0.00 0.04 0.00 0.00 34.50 32.48 3a0h s PRO 26 CO 0.25 -1.85 1.10 -1.25 0.04 0.00 0.00 177.00 175.29 3a0h s PRO 27 N -4.06 3.77 -0.51 0.56 0.04 -1.26 -5.02 135.00 128.51 3a0h s PRO 27 Ca 0.72 0.61 -0.17 0.00 0.04 0.00 0.00 61.00 62.20 3a0h s PRO 27 Cb -0.27 -3.88 0.08 0.00 0.04 0.00 0.00 34.50 30.47 3a0h s PRO 27 CO 0.47 -1.28 0.53 1.03 0.04 0.00 0.00 177.00 177.78 3a0h s ARG 28 N 4.24 3.04 -0.77 4.56 1.81 -1.26 -5.02 118.95 125.55 3a0h s ARG 28 Ca 0.46 -1.23 -0.25 0.00 -1.72 0.00 0.00 55.73 52.99 3a0h s ARG 28 Cb -0.08 -4.16 -0.05 0.00 -0.45 0.00 0.00 34.95 30.21 3a0h s ARG 28 CO 0.28 -1.20 2.00 0.42 -0.68 0.00 0.00 175.30 176.13 3a0h s ILE 29 N 2.12 3.34 0.00 1.52 1.01 -1.26 -5.36 121.20 122.57 3a0h s ILE 29 Ca 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.61 3a0h s ILE 29 Cb -0.23 -3.81 0.00 0.00 0.01 0.00 0.00 42.46 38.43 3a0h s ILE 29 CO 0.08 -0.77 0.20 0.41 0.00 0.00 0.00 174.94 174.86