#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xv3 s SER 2 N 0.00 5.77 -0.56 0.41 0.15 -1.26 -4.99 113.70 113.21 1xv3 s SER 2 Ca 0.00 -1.25 0.06 0.00 0.70 0.00 0.00 55.95 55.45 1xv3 s SER 2 Cb 0.00 -2.04 0.21 0.00 -1.71 0.00 0.00 66.02 62.49 1xv3 s SER 2 CO 0.00 -0.49 0.56 -1.54 1.20 0.00 0.00 173.24 172.97 1xv3 n SER 3 N 5.00 2.02 0.00 5.45 3.41 -1.26 -5.00 113.62 123.24 1xv3 n SER 3 Ca -0.11 -3.02 0.00 0.00 -0.26 0.00 0.00 58.87 55.47 1xv3 n SER 3 Cb 0.44 -0.67 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 1xv3 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xv3 n GLY 4 N 1.64 -1.97 3.00 5.00 0.00 -1.26 -4.98 105.19 106.61 1xv3 n GLY 4 Ca 0.25 -1.50 -0.20 0.00 0.00 0.00 0.00 46.02 44.57 1xv3 n GLY 4 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xv3 s TYR 5 N -2.08 0.95 -0.79 1.61 2.02 -1.26 -5.05 117.35 112.75 1xv3 s TYR 5 Ca 0.00 -0.24 0.01 0.00 -0.37 0.00 0.00 57.07 56.46 1xv3 s TYR 5 Cb 0.00 -0.69 0.35 0.00 -0.40 0.00 0.00 41.96 41.23 1xv3 s TYR 5 CO 0.00 -0.11 1.65 -2.37 -1.57 0.00 0.00 175.55 173.15 1xv3 n THR 6 N 3.34 4.02 -1.86 -0.71 5.66 -1.26 -4.98 114.28 118.48 1xv3 n THR 6 Ca -0.19 -5.08 0.00 0.00 -3.05 0.00 0.00 64.05 55.73 1xv3 n THR 6 Cb 0.54 -1.36 0.00 0.00 -1.55 0.00 0.00 70.33 67.96 1xv3 n THR 6 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 1xv3 n ARG 7 N -0.35 -4.95 -1.68 1.09 0.63 -1.26 -4.98 116.66 105.16 1xv3 n ARG 7 Ca 0.46 3.56 -0.30 0.00 -0.92 0.00 0.00 57.85 60.65 1xv3 n ARG 7 Cb 0.34 -3.79 0.06 0.00 0.45 0.00 0.00 32.46 29.53 1xv3 n ARG 7 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1xv3 s PRO 8 N -1.12 2.58 -0.43 -0.14 0.04 -1.26 -4.96 135.00 129.69 1xv3 s PRO 8 Ca 0.00 0.65 -0.29 0.00 0.04 0.00 0.00 61.00 61.41 1xv3 s PRO 8 Cb 0.00 -1.97 0.01 0.00 0.04 0.00 0.00 34.50 32.57 1xv3 s PRO 8 CO 0.00 -1.28 1.46 -1.17 0.04 0.00 0.00 177.00 176.05 1xv3 s LEU 9 N -5.57 3.54 -0.28 -3.56 1.98 -1.26 -4.30 118.68 109.23 1xv3 s LEU 9 Ca 0.59 0.77 -0.03 0.00 -2.89 0.00 0.00 54.13 52.57 1xv3 s LEU 9 Cb -0.13 -3.44 0.01 0.00 0.66 0.00 0.00 46.19 43.29 1xv3 s LEU 9 CO 0.54 -1.53 0.06 -1.14 -1.89 0.00 0.00 176.35 172.39 1xv3 n ARG 10 N 8.23 -3.77 -1.83 1.98 3.00 -1.26 -4.81 116.66 118.20 1xv3 n ARG 10 Ca 0.17 2.96 -0.43 0.00 -0.00 0.00 0.00 57.85 60.55 1xv3 n ARG 10 Cb 0.48 -5.31 -0.03 0.00 0.00 0.00 0.00 32.46 27.60 1xv3 n ARG 10 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1xv3 s LYS 11 N -1.40 3.39 0.00 -0.14 1.02 -1.26 -4.98 119.74 116.37 1xv3 s LYS 11 Ca -0.07 1.80 0.00 0.00 0.02 0.00 0.00 55.97 57.73 1xv3 s LYS 11 Cb 0.00 -4.24 0.00 0.00 -0.52 0.00 0.00 37.83 33.08 1xv3 s LYS 11 CO 0.79 -1.79 0.00 -0.35 -0.92 0.00 0.00 175.35 173.08 1xv3 n PRO 12 N 8.37 1.14 -1.02 -1.68 -0.04 -1.26 -5.05 135.00 135.45 1xv3 n PRO 12 Ca 0.25 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.41 1xv3 n PRO 12 Cb 0.45 0.00 0.23 0.00 -0.04 0.00 0.00 33.50 34.14 1xv3 n PRO 12 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1xv3 s SER 13 N -1.05 1.21 -0.44 3.54 1.04 -1.26 -4.79 113.70 111.95 1xv3 s SER 13 Ca 0.00 0.84 -0.36 0.00 0.48 0.00 0.00 55.95 56.90 1xv3 s SER 13 Cb 0.00 -1.24 -0.14 0.00 0.10 0.00 0.00 66.02 64.75 1xv3 s SER 13 CO 0.00 -3.97 2.23 -2.11 0.98 0.00 0.00 173.24 170.37 1xv3 n ARG 14 N -4.68 0.75 -2.56 4.02 1.85 -1.26 -4.92 116.66 109.86 1xv3 n ARG 14 Ca 0.10 0.19 -0.30 0.00 -1.00 0.00 0.00 57.85 56.84 1xv3 n ARG 14 Cb 0.59 -2.23 -0.02 0.00 -1.05 0.00 0.00 32.46 29.76 1xv3 n ARG 14 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1xv3 s PRO 15 N 6.50 3.70 0.74 2.89 0.04 -1.26 -5.06 135.00 142.54 1xv3 s PRO 15 Ca 1.13 0.49 -0.12 0.00 0.04 0.00 0.00 61.00 62.55 1xv3 s PRO 15 Cb -1.00 -2.30 0.04 0.00 0.04 0.00 0.00 34.50 31.28 1xv3 s PRO 15 CO 0.52 -0.21 1.10 0.96 0.04 0.00 0.00 177.00 179.40 1xv3 s ILE 16 N -2.66 3.31 -0.01 0.56 -4.36 -1.26 -5.05 121.20 111.73 1xv3 s ILE 16 Ca 0.52 0.47 0.05 0.00 -0.26 0.00 0.00 60.65 61.43 1xv3 s ILE 16 Cb -0.10 -2.97 -0.01 0.00 1.25 0.00 0.00 42.46 40.62 1xv3 s ILE 16 CO 0.39 -0.51 -0.17 0.12 0.24 0.00 0.00 174.94 175.01 1xv3 s PHE 17 N -2.74 1.57 0.51 1.37 5.36 -1.26 -5.15 117.98 117.63 1xv3 s PHE 17 Ca 0.63 -0.30 0.05 0.00 -0.96 0.00 0.00 56.93 56.35 1xv3 s PHE 17 Cb -0.18 -1.01 0.09 0.00 -0.34 0.00 0.00 43.02 41.59 1xv3 s PHE 17 CO 0.52 -0.02 0.70 0.44 -1.46 0.00 0.00 175.22 175.39 1xv3 n ILE 18 N 2.63 0.00 -1.65 3.12 -5.35 -1.26 -5.02 119.36 111.82 1xv3 n ILE 18 Ca -0.15 -1.42 -0.44 0.00 -0.27 0.00 0.00 62.75 60.48 1xv3 n ILE 18 Cb 0.54 -0.77 -0.01 0.00 -1.74 0.00 0.00 39.64 37.66 1xv3 n ILE 18 CO 0.00 0.00 0.00 -2.11 -1.76 0.00 0.00 176.55 172.68 1xv3 n ARG 19 N -2.19 1.81 -1.13 6.28 0.00 -1.26 -4.95 116.66 115.21 1xv3 n ARG 19 Ca 0.13 0.63 -0.29 0.00 -0.00 0.00 0.00 57.85 58.32 1xv3 n ARG 19 Cb 0.47 -2.14 0.20 0.00 -0.00 0.00 0.00 32.46 31.00 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 -1.63 -0.23 0.82 2.89 0.04 -1.26 -5.04 135.00 130.60 1xv3 s PRO 20 Ca 0.58 0.29 -0.12 0.00 0.04 0.00 0.00 61.00 61.79 1xv3 s PRO 20 Cb -0.63 -1.68 0.09 0.00 0.04 0.00 0.00 34.50 32.32 1xv3 s PRO 20 CO 0.60 -3.12 1.13 0.42 0.04 0.00 0.00 177.00 176.07 1xv3 s ILE 21 N -2.98 2.50 0.00 0.56 1.01 -1.26 -4.32 121.20 116.71 1xv3 s ILE 21 Ca 0.67 0.16 0.00 0.00 0.00 0.00 0.00 60.65 61.49 1xv3 s ILE 21 Cb -0.16 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 39.30 1xv3 s ILE 21 CO 0.57 -0.21 0.00 0.61 0.00 0.00 0.00 174.94 175.91 1xv3 n GLY 22 N -2.61 2.60 0.21 6.18 0.00 -1.26 -4.72 105.19 105.58 1xv3 n GLY 22 Ca 0.07 -0.70 0.05 0.00 0.00 0.00 0.00 46.02 45.44 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 -4.04 0.00 -3.15 0.00 8.00 -1.26 -3.99 116.55 112.11 1xv3 n ASP 24 Ca -0.02 -1.00 -0.22 0.00 0.71 0.00 0.00 54.79 54.26 1xv3 n ASP 24 Cb 0.35 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.40 1xv3 n ASP 24 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1xv3 n VAL 25 N -0.85 -0.66 0.20 2.53 0.31 -0.79 -4.96 118.33 114.12 1xv3 n VAL 25 Ca 0.13 -3.62 0.17 0.00 -0.01 0.00 0.00 64.34 61.01 1xv3 n VAL 25 Cb 0.06 -1.48 0.70 0.00 -0.91 0.00 0.00 33.84 32.21 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 -4.32 3.15 0.00 0.00 2.02 -1.26 -4.43 117.35 112.51 1xv3 s TYR 27 Ca -0.03 -0.12 0.00 0.00 -0.37 0.00 0.00 57.07 56.54 1xv3 s TYR 27 Cb 0.11 -2.05 0.00 0.00 -0.40 0.00 0.00 41.96 39.62 1xv3 s TYR 27 CO 0.38 0.02 0.00 0.41 -1.57 0.00 0.00 175.55 174.79 1xv3 n GLY 28 N 3.70 1.73 3.90 0.71 0.00 -1.26 -5.09 105.19 108.88 1xv3 n GLY 28 Ca -0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.92 4.33 0.63 -0.61 -4.36 -1.26 -5.06 121.20 112.96 1xv3 s ILE 29 Ca 0.00 0.33 -0.14 0.00 -0.26 0.00 0.00 60.65 60.58 1xv3 s ILE 29 Cb 0.00 -3.70 -0.02 0.00 1.25 0.00 0.00 42.46 39.99 1xv3 s ILE 29 CO 0.00 -0.78 1.06 -2.16 0.24 0.00 0.00 174.94 173.30 1xv3 s PRO 30 N -4.99 3.14 0.25 0.37 0.04 -1.26 -4.81 135.00 127.73 1xv3 s PRO 30 Ca 0.52 1.15 -0.05 0.00 0.04 0.00 0.00 61.00 62.66 1xv3 s PRO 30 Cb -0.11 -2.01 0.30 0.00 0.04 0.00 0.00 34.50 32.72 1xv3 s PRO 30 CO 0.48 -0.95 1.90 1.03 0.04 0.00 0.00 177.00 179.50 1xv3 h SER 31 N 0.04 1.05 -0.40 6.66 0.87 -1.97 0.18 113.55 119.97 1xv3 h SER 31 Ca -0.46 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 1xv3 h SER 31 Cb 1.22 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.92 1xv3 h SER 31 CO 0.57 0.72 0.26 -1.28 -0.53 0.00 0.00 176.83 176.57 1xv3 h SER 32 N 1.22 0.46 -0.42 6.23 0.87 -1.99 0.53 113.55 120.45 1xv3 h SER 32 Ca 0.38 -0.02 -0.14 0.00 -1.23 0.00 0.00 61.79 60.78 1xv3 h SER 32 Cb -0.01 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 1xv3 h SER 32 CO -0.12 0.34 -0.29 0.74 -0.53 0.00 0.00 176.83 176.98 1xv3 h THR 33 N 0.54 1.27 -0.71 2.23 2.02 -1.83 -2.44 112.91 113.99 1xv3 h THR 33 Ca 0.15 -1.45 -0.05 0.00 0.77 0.00 0.00 66.41 65.83 1xv3 h THR 33 Cb -0.05 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.60 1xv3 h THR 33 CO -0.03 0.49 0.26 0.00 0.37 0.00 0.00 175.52 176.61 1xv3 h ALA 34 N 0.81 1.12 -0.58 6.16 0.00 -0.16 -0.74 119.26 125.87 1xv3 h ALA 34 Ca 0.08 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1xv3 h ALA 34 Cb 0.87 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1xv3 h ALA 34 CO 0.08 0.62 0.15 -0.09 0.00 0.00 0.00 179.25 180.01 1xv3 h ARG 35 N 1.04 0.92 -0.66 0.00 2.43 0.21 -2.02 114.38 116.30 1xv3 h ARG 35 Ca 0.24 -0.22 -0.08 0.00 -0.81 0.00 0.00 59.98 59.11 1xv3 h ARG 35 Cb 0.23 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 1xv3 h ARG 35 CO -0.02 0.85 0.12 1.25 -1.51 0.00 0.00 179.97 180.66 1xv3 h LEU 36 N 0.83 1.03 -1.66 3.80 6.46 -1.06 0.13 115.31 124.84 1xv3 h LEU 36 Ca 0.18 -0.24 -0.04 0.00 -0.12 0.00 0.00 57.88 57.67 1xv3 h LEU 36 Cb 0.34 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 39.99 1xv3 h LEU 36 CO 0.00 1.02 -0.17 0.00 -0.62 0.00 0.00 178.44 178.67 1xv3 h PHE 39 N 0.08 1.02 0.00 0.00 3.57 -0.47 -2.56 116.94 118.58 1xv3 h PHE 39 Ca -0.32 -0.21 -0.23 0.00 3.53 0.00 0.00 57.97 60.74 1xv3 h PHE 39 Cb 2.05 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 40.51 1xv3 h PHE 39 CO 0.08 0.98 -1.76 0.54 -2.23 0.00 0.00 178.31 175.92 1xv3 n ARG 40 N -4.14 0.55 0.08 1.11 1.74 -0.18 -4.70 116.66 111.12 1xv3 n ARG 40 Ca 0.01 0.23 -0.18 0.00 -0.77 0.00 0.00 57.85 57.15 1xv3 n ARG 40 Cb 0.40 -1.45 -0.14 0.00 -1.02 0.00 0.00 32.46 30.25 1xv3 n ARG 40 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 1xv3 h TYR 41 N -0.99 0.54 0.00 -1.55 -1.99 -1.51 -3.48 116.97 107.98 1xv3 h TYR 41 Ca -0.35 -0.39 0.00 0.00 2.00 0.00 0.00 58.73 59.99 1xv3 h TYR 41 Cb 1.30 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 40.01 1xv3 h TYR 41 CO -0.26 1.39 0.00 0.41 -0.00 0.00 0.00 178.16 179.70 1xv3 n GLY 42 N 1.64 1.00 3.83 3.88 0.00 0.14 -4.95 105.19 110.73 1xv3 n GLY 42 Ca -0.15 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 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 5.60 -1.26 1.61 1.01 -0.71 -4.53 116.67 116.39 1xv3 s ASP 43 Ca 0.00 -0.18 -0.07 0.00 0.71 0.00 0.00 52.55 53.01 1xv3 s ASP 43 Cb 0.00 -1.46 0.01 0.00 1.01 0.00 0.00 42.92 42.48 1xv3 s ASP 43 CO 0.00 -0.01 0.99 0.00 0.21 0.00 0.00 175.17 176.36 1xv3 s HIS 46 N -1.88 3.55 0.00 0.00 3.76 -1.26 -5.09 115.29 114.37 1xv3 s HIS 46 Ca -0.07 -1.88 0.00 0.00 -0.15 0.00 0.00 55.06 52.96 1xv3 s HIS 46 Cb 0.01 -4.07 0.00 0.00 1.11 0.00 0.00 32.58 29.63 1xv3 s HIS 46 CO 0.13 -1.23 0.39 -0.11 -0.85 0.00 0.00 174.74 173.06