#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xv3 n SER 2 N 0.00 -7.48 -3.66 4.39 2.88 -1.26 -4.98 113.62 103.52 1xv3 n SER 2 Ca 0.00 0.60 -0.09 0.00 -1.33 0.00 0.00 58.87 58.06 1xv3 n SER 2 Cb 0.00 -3.86 -0.09 0.00 -0.75 0.00 0.00 64.21 59.51 1xv3 n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1xv3 s SER 3 N -6.60 -0.76 0.00 -3.46 0.01 -1.26 -5.15 113.70 96.49 1xv3 s SER 3 Ca 0.00 1.24 0.00 0.00 1.31 0.00 0.00 55.95 58.50 1xv3 s SER 3 Cb 0.00 1.12 0.00 0.00 0.21 0.00 0.00 66.02 67.35 1xv3 s SER 3 CO 0.00 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.04 1xv3 n GLY 4 N 4.28 1.25 2.80 3.44 0.00 -1.26 -5.09 105.19 110.61 1xv3 n GLY 4 Ca -0.21 -2.19 -0.15 0.00 0.00 0.00 0.00 46.02 43.47 1xv3 n GLY 4 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xv3 s TYR 5 N -1.18 -0.02 -0.01 1.61 1.13 -1.26 -5.15 117.35 112.47 1xv3 s TYR 5 Ca 0.00 0.23 -0.09 0.00 -1.41 0.00 0.00 57.07 55.81 1xv3 s TYR 5 Cb 0.00 -0.22 0.01 0.00 -1.10 0.00 0.00 41.96 40.65 1xv3 s TYR 5 CO 0.00 -0.12 0.18 0.99 -2.51 0.00 0.00 175.55 174.09 1xv3 s THR 6 N 1.19 0.07 0.02 -3.49 2.01 -1.26 -5.17 115.64 109.01 1xv3 s THR 6 Ca -0.08 -0.59 -0.05 0.00 0.31 0.00 0.00 61.69 61.28 1xv3 s THR 6 Cb -0.13 -0.46 -0.01 0.00 0.01 0.00 0.00 72.50 71.92 1xv3 s THR 6 CO -0.04 -0.32 0.08 -0.13 -0.69 0.00 0.00 174.62 173.52 1xv3 s ARG 7 N -1.25 0.51 0.46 4.92 0.52 -1.26 -5.15 118.95 117.70 1xv3 s ARG 7 Ca -0.13 -0.63 -0.22 0.00 -0.52 0.00 0.00 55.73 54.23 1xv3 s ARG 7 Cb -0.07 0.20 -0.08 0.00 0.52 0.00 0.00 34.95 35.52 1xv3 s ARG 7 CO 0.02 -0.12 1.07 -1.25 0.02 0.00 0.00 175.30 175.05 1xv3 s PRO 8 N -2.05 3.84 -0.95 3.54 0.04 -1.26 -4.96 135.00 133.20 1xv3 s PRO 8 Ca -0.10 1.50 -0.23 0.00 0.04 0.00 0.00 61.00 62.21 1xv3 s PRO 8 Cb -0.05 -2.26 0.06 0.00 0.04 0.00 0.00 34.50 32.30 1xv3 s PRO 8 CO -0.02 -0.42 1.36 -1.17 0.04 0.00 0.00 177.00 176.78 1xv3 s LEU 9 N -3.22 3.72 0.23 -3.56 0.20 -1.26 -4.92 118.68 109.87 1xv3 s LEU 9 Ca 0.65 -1.38 -0.22 0.00 0.69 0.00 0.00 54.13 53.87 1xv3 s LEU 9 Cb -0.21 -2.54 0.04 0.00 -0.43 0.00 0.00 46.19 43.06 1xv3 s LEU 9 CO 0.25 -1.49 0.66 -0.60 -0.29 0.00 0.00 176.35 174.89 1xv3 s ARG 10 N 4.71 1.56 -0.13 1.98 3.52 -1.26 -5.11 118.95 124.23 1xv3 s ARG 10 Ca 0.42 -0.77 -0.31 0.00 -0.13 0.00 0.00 55.73 54.94 1xv3 s ARG 10 Cb -0.02 0.60 -0.08 0.00 -1.56 0.00 0.00 34.95 33.88 1xv3 s ARG 10 CO -0.06 -0.70 2.08 1.17 -0.81 0.00 0.00 175.30 176.98 1xv3 n LYS 11 N -0.42 2.17 0.00 5.12 4.81 -1.26 -4.96 118.16 123.61 1xv3 n LYS 11 Ca -0.10 0.71 0.00 0.00 -0.87 0.00 0.00 58.31 58.05 1xv3 n LYS 11 Cb 0.62 -2.96 0.00 0.00 0.02 0.00 0.00 35.03 32.70 1xv3 n LYS 11 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1xv3 n PRO 12 N 7.92 1.03 -0.76 1.64 -0.04 -1.26 -5.03 135.00 138.50 1xv3 n PRO 12 Ca 0.27 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.44 1xv3 n PRO 12 Cb 0.38 0.00 0.24 0.00 -0.04 0.00 0.00 33.50 34.08 1xv3 n PRO 12 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1xv3 s SER 13 N -1.20 0.81 1.03 3.54 0.01 -1.26 -4.97 113.70 111.67 1xv3 s SER 13 Ca 0.00 1.08 -0.13 0.00 1.31 0.00 0.00 55.95 58.21 1xv3 s SER 13 Cb 0.00 -1.64 0.14 0.00 0.21 0.00 0.00 66.02 64.73 1xv3 s SER 13 CO 0.00 -4.24 0.67 0.54 0.41 0.00 0.00 173.24 170.61 1xv3 n ARG 14 N -4.90 -1.10 -1.42 12.44 1.74 -1.26 -4.96 116.66 117.20 1xv3 n ARG 14 Ca 0.07 -0.28 -0.32 0.00 -0.77 0.00 0.00 57.85 56.56 1xv3 n ARG 14 Cb 0.57 -2.04 0.08 0.00 -1.02 0.00 0.00 32.46 30.05 1xv3 n ARG 14 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1xv3 s PRO 15 N -4.04 2.44 0.03 5.56 0.04 -1.26 -5.05 135.00 132.71 1xv3 s PRO 15 Ca 0.62 1.24 -0.01 0.00 0.04 0.00 0.00 61.00 62.89 1xv3 s PRO 15 Cb -0.21 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.42 1xv3 s PRO 15 CO 0.64 -1.51 0.04 0.44 0.04 0.00 0.00 177.00 176.65 1xv3 n ILE 16 N -3.17 0.00 -0.49 0.56 -5.35 -1.26 -5.05 119.36 104.60 1xv3 n ILE 16 Ca 0.09 -0.03 -0.17 0.00 -0.27 0.00 0.00 62.75 62.38 1xv3 n ILE 16 Cb 0.53 -1.72 0.15 0.00 -1.74 0.00 0.00 39.64 36.85 1xv3 n ILE 16 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1xv3 n PHE 17 N -2.19 -3.26 -0.68 4.28 3.72 -1.26 -4.96 117.46 113.09 1xv3 n PHE 17 Ca 0.00 -0.50 -0.32 0.00 -0.05 0.00 0.00 57.45 56.59 1xv3 n PHE 17 Cb 0.02 -0.66 0.17 0.00 -0.94 0.00 0.00 39.48 38.07 1xv3 n PHE 17 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1xv3 n ILE 18 N -4.16 0.00 -1.65 4.37 2.08 -1.26 -4.77 119.36 113.98 1xv3 n ILE 18 Ca 0.08 -0.25 -0.57 0.00 0.56 0.00 0.00 62.75 62.57 1xv3 n ILE 18 Cb 0.33 -0.72 -0.07 0.00 -0.75 0.00 0.00 39.64 38.43 1xv3 n ILE 18 CO 0.00 0.00 0.00 -1.14 0.56 0.00 0.00 176.55 175.97 1xv3 n ARG 19 N -2.67 0.91 -1.38 0.38 0.00 -1.26 -4.93 116.66 107.70 1xv3 n ARG 19 Ca 0.04 0.33 -0.30 0.00 -0.00 0.00 0.00 57.85 57.93 1xv3 n ARG 19 Cb 0.57 -1.96 0.12 0.00 0.00 0.00 0.00 32.46 31.19 1xv3 n ARG 19 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1xv3 s PRO 20 N 2.08 1.46 0.66 -0.14 0.04 -1.26 -5.05 135.00 132.79 1xv3 s PRO 20 Ca 0.94 0.64 -0.09 0.00 0.04 0.00 0.00 61.00 62.53 1xv3 s PRO 20 Cb -1.10 -1.85 0.02 0.00 0.04 0.00 0.00 34.50 31.62 1xv3 s PRO 20 CO 0.60 -2.05 1.01 0.42 0.04 0.00 0.00 177.00 177.02 1xv3 s ILE 21 N -3.07 3.35 0.00 0.56 1.09 -1.26 -4.44 121.20 117.42 1xv3 s ILE 21 Ca 0.63 0.17 0.00 0.00 -1.10 0.00 0.00 60.65 60.35 1xv3 s ILE 21 Cb -0.16 -3.39 0.00 0.00 -1.06 0.00 0.00 42.46 37.85 1xv3 s ILE 21 CO 0.55 -0.46 0.00 0.61 -0.10 0.00 0.00 174.94 175.55 1xv3 n GLY 22 N -2.84 2.59 0.19 6.18 0.00 -1.26 -4.75 105.19 105.29 1xv3 n GLY 22 Ca 0.06 -0.69 0.02 0.00 0.00 0.00 0.00 46.02 45.41 1xv3 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xv3 n ASP 24 N -4.08 1.58 -3.19 0.00 2.03 -1.26 -4.12 116.55 107.51 1xv3 n ASP 24 Ca -0.02 -2.10 -0.21 0.00 0.52 0.00 0.00 54.79 52.98 1xv3 n ASP 24 Cb 0.42 -0.30 -0.05 0.00 -0.72 0.00 0.00 41.12 40.47 1xv3 n ASP 24 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1xv3 n VAL 25 N 0.13 -0.19 0.08 5.18 0.31 -0.89 -4.95 118.33 118.01 1xv3 n VAL 25 Ca 0.07 -4.44 0.20 0.00 -0.01 0.00 0.00 64.34 60.16 1xv3 n VAL 25 Cb 0.31 -0.93 0.64 0.00 -0.91 0.00 0.00 33.84 32.95 1xv3 n VAL 25 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xv3 s TYR 27 N -4.43 3.21 0.00 0.00 2.02 -1.26 -4.38 117.35 112.51 1xv3 s TYR 27 Ca -0.03 -0.01 0.00 0.00 -0.37 0.00 0.00 57.07 56.66 1xv3 s TYR 27 Cb 0.13 -2.09 0.00 0.00 -0.40 0.00 0.00 41.96 39.60 1xv3 s TYR 27 CO 0.44 0.08 0.00 0.41 -1.57 0.00 0.00 175.55 174.91 1xv3 n GLY 28 N 3.69 1.73 3.91 0.71 0.00 -1.26 -5.08 105.19 108.88 1xv3 n GLY 28 Ca -0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.59 1xv3 n GLY 28 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1xv3 s ILE 29 N -1.96 4.37 0.59 -0.61 -4.36 -1.26 -5.06 121.20 112.92 1xv3 s ILE 29 Ca 0.00 0.09 -0.16 0.00 -0.26 0.00 0.00 60.65 60.32 1xv3 s ILE 29 Cb 0.00 -3.69 -0.04 0.00 1.25 0.00 0.00 42.46 39.99 1xv3 s ILE 29 CO 0.00 -0.68 1.06 -2.16 0.24 0.00 0.00 174.94 173.40 1xv3 s PRO 30 N -4.83 3.33 0.26 0.37 0.04 -1.26 -4.84 135.00 128.08 1xv3 s PRO 30 Ca 0.50 1.20 -0.04 0.00 0.04 0.00 0.00 61.00 62.70 1xv3 s PRO 30 Cb -0.10 -2.03 0.36 0.00 0.04 0.00 0.00 34.50 32.76 1xv3 s PRO 30 CO 0.45 -0.80 1.91 1.03 0.04 0.00 0.00 177.00 179.63 1xv3 h SER 31 N 0.46 1.08 -0.51 6.66 0.87 -1.97 0.69 113.55 120.82 1xv3 h SER 31 Ca -0.47 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.08 1xv3 h SER 31 Cb 1.22 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.91 1xv3 h SER 31 CO 0.57 0.74 0.32 -1.28 -0.53 0.00 0.00 176.83 176.65 1xv3 h SER 32 N 1.25 0.60 -0.43 6.23 0.87 -1.99 0.49 113.55 120.57 1xv3 h SER 32 Ca 0.39 -0.04 -0.11 0.00 -1.23 0.00 0.00 61.79 60.80 1xv3 h SER 32 Cb 0.00 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.80 1xv3 h SER 32 CO -0.12 0.47 -0.15 0.74 -0.53 0.00 0.00 176.83 177.23 1xv3 h THR 33 N 0.68 1.28 -0.65 2.23 2.02 -1.81 -2.44 112.91 114.22 1xv3 h THR 33 Ca 0.18 -1.29 -0.04 0.00 0.77 0.00 0.00 66.41 66.04 1xv3 h THR 33 Cb -0.03 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.55 1xv3 h THR 33 CO -0.04 0.44 0.26 0.00 0.37 0.00 0.00 175.52 176.55 1xv3 h ALA 34 N 0.85 1.24 -0.39 6.16 0.00 -0.34 -0.71 119.26 126.07 1xv3 h ALA 34 Ca 0.10 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1xv3 h ALA 34 Cb 0.71 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1xv3 h ALA 34 CO 0.05 0.56 0.13 -0.09 0.00 0.00 0.00 179.25 179.91 1xv3 h ARG 35 N 0.93 0.60 -0.60 0.00 2.43 0.19 -2.07 114.38 115.85 1xv3 h ARG 35 Ca 0.22 -0.12 -0.06 0.00 -0.81 0.00 0.00 59.98 59.20 1xv3 h ARG 35 Cb 0.18 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 1xv3 h ARG 35 CO -0.02 0.59 0.12 1.25 -1.51 0.00 0.00 179.97 180.40 1xv3 h LEU 36 N 0.49 0.90 -1.53 3.80 7.12 -1.07 -1.29 115.31 123.73 1xv3 h LEU 36 Ca 0.13 -0.19 -0.03 0.00 0.13 0.00 0.00 57.88 57.92 1xv3 h LEU 36 Cb 0.23 -0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 40.11 1xv3 h LEU 36 CO -0.01 0.89 0.04 0.00 -0.13 0.00 0.00 178.44 179.23 1xv3 h PHE 39 N 0.11 0.90 0.00 0.00 3.57 -0.92 -2.68 116.94 117.93 1xv3 h PHE 39 Ca -0.22 -0.22 0.00 0.00 3.53 0.00 0.00 57.97 61.06 1xv3 h PHE 39 Cb 2.09 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 40.62 1xv3 h PHE 39 CO 0.10 0.96 -0.92 0.54 -2.23 0.00 0.00 178.31 176.76 1xv3 n ARG 40 N -4.09 0.51 0.08 1.11 5.12 -0.34 -4.70 116.66 114.35 1xv3 n ARG 40 Ca -0.00 0.25 -0.21 0.00 -1.93 0.00 0.00 57.85 55.95 1xv3 n ARG 40 Cb 0.46 -1.45 -0.12 0.00 -1.16 0.00 0.00 32.46 30.19 1xv3 n ARG 40 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 1xv3 h TYR 41 N -0.98 1.01 0.00 -1.55 -1.99 -1.40 -3.48 116.97 108.57 1xv3 h TYR 41 Ca 0.00 -0.61 0.00 0.00 2.00 0.00 0.00 58.73 60.12 1xv3 h TYR 41 Cb 0.92 -0.09 0.00 0.00 2.00 0.00 0.00 36.73 39.56 1xv3 h TYR 41 CO -0.40 1.45 0.00 0.41 -0.00 0.00 0.00 178.16 179.62 1xv3 n GLY 42 N 1.29 1.05 3.77 3.88 0.00 0.18 -4.96 105.19 110.40 1xv3 n GLY 42 Ca -0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.66 1xv3 n GLY 42 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xv3 s ASP 43 N -2.00 5.28 -1.20 1.61 1.01 -0.99 -4.56 116.67 115.82 1xv3 s ASP 43 Ca 0.00 -0.31 -0.08 0.00 0.71 0.00 0.00 52.55 52.88 1xv3 s ASP 43 Cb 0.00 -1.28 0.01 0.00 1.01 0.00 0.00 42.92 42.66 1xv3 s ASP 43 CO 0.00 0.00 1.05 0.00 0.21 0.00 0.00 175.17 176.43 1xv3 s HIS 46 N -1.94 2.79 -0.82 0.00 3.76 -1.26 -5.08 115.29 112.74 1xv3 s HIS 46 Ca -0.09 -1.15 0.07 0.00 -0.15 0.00 0.00 55.06 53.74 1xv3 s HIS 46 Cb 0.01 -4.55 0.05 0.00 1.11 0.00 0.00 32.58 29.20 1xv3 s HIS 46 CO 0.16 -1.76 0.71 1.28 -0.85 0.00 0.00 174.74 174.28