#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 -5.93 -4.51 0.26 7.64 -1.26 -4.84 113.62 104.98 1xv3 n SER 2 Ca 0.00 -0.68 -0.43 0.00 1.01 0.00 0.00 58.87 58.77 1xv3 n SER 2 Cb 0.00 -3.19 -0.00 0.00 -1.01 0.00 0.00 64.21 60.00 1xv3 n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1xv3 s SER 3 N -3.08 6.92 0.00 6.43 1.04 -1.26 -4.76 113.70 118.99 1xv3 s SER 3 Ca 0.09 -2.63 0.00 0.00 0.48 0.00 0.00 55.95 53.89 1xv3 s SER 3 Cb -0.03 -2.48 0.00 0.00 0.10 0.00 0.00 66.02 63.61 1xv3 s SER 3 CO 0.84 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 174.70 1xv3 n GLY 4 N 4.86 1.92 1.00 7.32 0.00 -1.26 -4.99 105.19 114.04 1xv3 n GLY 4 Ca 0.40 -0.18 0.05 0.00 0.00 0.00 0.00 46.02 46.28 1xv3 n GLY 4 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1xv3 n TYR 5 N 0.00 -2.71 -2.72 1.61 9.36 -1.26 -4.83 117.16 116.60 1xv3 n TYR 5 Ca 0.00 1.48 -0.42 0.00 3.32 0.00 0.00 57.90 62.29 1xv3 n TYR 5 Cb 0.00 -2.46 -0.03 0.00 -0.63 0.00 0.00 39.34 36.22 1xv3 n TYR 5 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 1xv3 s THR 6 N -4.51 4.76 0.51 2.97 2.01 -1.26 -5.02 115.64 115.08 1xv3 s THR 6 Ca 0.00 2.05 -0.20 0.00 0.31 0.00 0.00 61.69 63.85 1xv3 s THR 6 Cb 0.00 -4.32 -0.08 0.00 0.01 0.00 0.00 72.50 68.12 1xv3 s THR 6 CO 0.00 0.21 1.07 -0.13 -0.69 0.00 0.00 174.62 175.08 1xv3 s ARG 7 N 0.69 3.66 0.20 4.92 1.81 -1.26 -4.99 118.95 123.97 1xv3 s ARG 7 Ca 0.50 1.43 -0.30 0.00 -1.72 0.00 0.00 55.73 55.64 1xv3 s ARG 7 Cb -0.22 -2.07 -0.08 0.00 -0.45 0.00 0.00 34.95 32.13 1xv3 s ARG 7 CO 0.28 -0.56 1.23 -1.25 -0.68 0.00 0.00 175.30 174.32 1xv3 s PRO 8 N -3.27 4.46 0.39 3.54 0.04 -1.26 -4.76 135.00 134.14 1xv3 s PRO 8 Ca 0.69 1.94 0.00 0.00 0.04 0.00 0.00 61.00 63.67 1xv3 s PRO 8 Cb -0.19 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.14 1xv3 s PRO 8 CO 0.22 -0.13 0.00 -0.11 0.04 0.00 0.00 177.00 177.03 1xv3 n LEU 9 N 2.42 -1.82 -4.75 -3.56 7.94 -1.26 -4.65 117.00 111.31 1xv3 n LEU 9 Ca 0.04 2.21 -0.41 0.00 -1.11 0.00 0.00 56.01 56.74 1xv3 n LEU 9 Cb 0.44 -1.92 -0.02 0.00 0.53 0.00 0.00 43.42 42.46 1xv3 n LEU 9 CO 0.56 0.21 1.24 -0.13 -1.11 0.00 0.00 177.39 178.17 1xv3 s ARG 10 N -4.46 4.13 -0.23 1.96 1.81 -1.26 -4.15 118.95 116.76 1xv3 s ARG 10 Ca 0.00 2.56 -0.06 0.00 -1.72 0.00 0.00 55.73 56.51 1xv3 s ARG 10 Cb 0.00 -3.03 0.02 0.00 -0.45 0.00 0.00 34.95 31.49 1xv3 s ARG 10 CO 0.00 -0.63 0.12 1.63 -0.68 0.00 0.00 175.30 175.74 1xv3 n LYS 11 N 2.26 -3.74 0.00 3.54 5.02 -1.26 -5.04 118.16 118.94 1xv3 n LYS 11 Ca 0.08 2.93 0.00 0.00 -2.02 0.00 0.00 58.31 59.30 1xv3 n LYS 11 Cb 0.37 -4.87 0.00 0.00 -0.02 0.00 0.00 35.03 30.52 1xv3 n LYS 11 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1xv3 n PRO 12 N 1.12 1.05 -0.40 1.97 -0.04 -1.26 -4.95 135.00 132.49 1xv3 n PRO 12 Ca -0.20 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.31 1xv3 n PRO 12 Cb 0.31 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.76 1xv3 n PRO 12 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1xv3 n SER 13 N 0.00 -5.08 -4.73 3.54 2.88 -1.26 -4.75 113.62 104.22 1xv3 n SER 13 Ca 0.00 0.43 -0.41 0.00 -1.33 0.00 0.00 58.87 57.56 1xv3 n SER 13 Cb 0.00 -1.21 -0.04 0.00 -0.75 0.00 0.00 64.21 62.21 1xv3 n SER 13 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1xv3 s ARG 14 N -0.71 4.64 0.82 -1.46 1.70 -1.26 -5.04 118.95 117.64 1xv3 s ARG 14 Ca 0.00 1.60 -0.12 0.00 -0.47 0.00 0.00 55.73 56.75 1xv3 s ARG 14 Cb 0.00 -3.32 0.08 0.00 -0.57 0.00 0.00 34.95 31.15 1xv3 s ARG 14 CO 0.00 0.14 1.11 -1.25 -1.08 0.00 0.00 175.30 174.22 1xv3 s PRO 15 N -0.22 1.88 1.01 3.89 0.04 -1.26 -5.05 135.00 135.29 1xv3 s PRO 15 Ca 0.48 0.55 -0.14 0.00 0.04 0.00 0.00 61.00 61.93 1xv3 s PRO 15 Cb -0.27 -1.90 0.19 0.00 0.04 0.00 0.00 34.50 32.56 1xv3 s PRO 15 CO 0.33 -1.74 1.13 0.96 0.04 0.00 0.00 177.00 177.72 1xv3 s ILE 16 N -3.19 1.91 0.62 0.56 -4.36 -1.26 -5.00 121.20 110.48 1xv3 s ILE 16 Ca 0.61 0.00 -0.17 0.00 -0.26 0.00 0.00 60.65 60.83 1xv3 s ILE 16 Cb -0.14 -2.63 -0.02 0.00 1.25 0.00 0.00 42.46 40.92 1xv3 s ILE 16 CO 0.54 0.00 1.15 -0.36 0.24 0.00 0.00 174.94 176.50 1xv3 s PHE 17 N -3.17 2.52 0.41 1.37 0.08 -1.26 -5.05 117.98 112.88 1xv3 s PHE 17 Ca 0.67 1.55 0.04 0.00 0.12 0.00 0.00 56.93 59.31 1xv3 s PHE 17 Cb -0.14 -3.30 0.04 0.00 -0.57 0.00 0.00 43.02 39.05 1xv3 s PHE 17 CO 0.55 -1.87 0.37 0.44 -0.10 0.00 0.00 175.22 174.61 1xv3 n ILE 18 N -1.98 0.00 -1.20 0.64 -5.35 -1.26 -5.05 119.36 105.16 1xv3 n ILE 18 Ca 0.12 -1.58 0.00 0.00 -0.27 0.00 0.00 62.75 61.02 1xv3 n ILE 18 Cb 0.51 -0.26 -0.00 0.00 -1.74 0.00 0.00 39.64 38.15 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 -1.56 -3.15 -1.16 6.28 -4.01 -1.26 -4.96 116.66 106.83 1xv3 n ARG 19 Ca 0.01 2.45 -0.30 0.00 -1.04 0.00 0.00 57.85 58.97 1xv3 n ARG 19 Cb 0.46 -3.07 0.23 0.00 -3.04 0.00 0.00 32.46 27.04 1xv3 n ARG 19 CO 0.00 0.00 0.00 -1.25 -3.04 0.00 0.00 177.63 173.34 1xv3 s PRO 20 N -5.08 -0.87 0.83 2.89 0.04 -1.26 -5.02 135.00 126.53 1xv3 s PRO 20 Ca 0.00 -0.01 -0.12 0.00 0.04 0.00 0.00 61.00 60.91 1xv3 s PRO 20 Cb 0.00 -1.63 0.09 0.00 0.04 0.00 0.00 34.50 33.00 1xv3 s PRO 20 CO 0.00 -3.49 1.12 0.42 0.04 0.00 0.00 177.00 175.10 1xv3 s ILE 21 N -3.06 2.59 0.00 0.56 -1.09 -1.26 -4.32 121.20 114.61 1xv3 s ILE 21 Ca 0.70 0.19 0.00 0.00 -2.23 0.00 0.00 60.65 59.31 1xv3 s ILE 21 Cb -0.11 -2.99 0.00 0.00 -1.58 0.00 0.00 42.46 37.79 1xv3 s ILE 21 CO 0.56 -0.25 0.00 0.61 -1.23 0.00 0.00 174.94 174.63 1xv3 n GLY 22 N -2.36 2.52 0.19 6.18 0.00 -1.26 -4.72 105.19 105.74 1xv3 n GLY 22 Ca 0.07 -0.68 0.04 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.80 0.07 -3.19 0.00 -0.08 -1.26 -3.97 116.55 104.33 1xv3 n ASP 24 Ca -0.01 -1.93 -0.21 0.00 -1.51 0.00 0.00 54.79 51.12 1xv3 n ASP 24 Cb 0.46 -0.01 -0.05 0.00 2.34 0.00 0.00 41.12 43.86 1xv3 n ASP 24 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1xv3 n VAL 25 N -0.50 -0.00 0.06 5.18 0.31 -0.97 -4.94 118.33 117.47 1xv3 n VAL 25 Ca 0.02 -4.47 0.21 0.00 -0.01 0.00 0.00 64.34 60.09 1xv3 n VAL 25 Cb 0.02 -1.10 0.65 0.00 -0.91 0.00 0.00 33.84 32.50 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 -4.48 3.19 0.00 0.00 2.02 -1.26 -4.38 117.35 112.44 1xv3 s TYR 27 Ca -0.04 -0.08 0.00 0.00 -0.37 0.00 0.00 57.07 56.58 1xv3 s TYR 27 Cb 0.14 -2.14 0.00 0.00 -0.40 0.00 0.00 41.96 39.55 1xv3 s TYR 27 CO 0.47 -0.03 0.00 0.41 -1.57 0.00 0.00 175.55 174.83 1xv3 n GLY 28 N 4.06 1.86 3.89 0.71 0.00 -1.26 -5.08 105.19 109.37 1xv3 n GLY 28 Ca -0.16 0.00 -0.29 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 -2.01 4.31 0.62 -0.61 -4.36 -1.25 -5.05 121.20 112.84 1xv3 s ILE 29 Ca 0.00 0.48 -0.15 0.00 -0.26 0.00 0.00 60.65 60.72 1xv3 s ILE 29 Cb 0.00 -3.71 -0.02 0.00 1.25 0.00 0.00 42.46 39.98 1xv3 s ILE 29 CO 0.00 -0.85 1.06 -2.16 0.24 0.00 0.00 174.94 173.24 1xv3 s PRO 30 N -5.08 3.18 0.30 0.37 0.04 -1.26 -4.82 135.00 127.73 1xv3 s PRO 30 Ca 0.54 1.19 -0.01 0.00 0.04 0.00 0.00 61.00 62.76 1xv3 s PRO 30 Cb -0.11 -2.01 0.49 0.00 0.04 0.00 0.00 34.50 32.91 1xv3 s PRO 30 CO 0.50 -0.92 1.94 1.03 0.04 0.00 0.00 177.00 179.59 1xv3 h SER 31 N 0.19 0.92 -0.41 6.66 0.87 -1.97 0.15 113.55 119.95 1xv3 h SER 31 Ca -0.46 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.07 1xv3 h SER 31 Cb 1.22 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.95 1xv3 h SER 31 CO 0.57 0.63 0.19 -1.28 -0.53 0.00 0.00 176.83 176.41 1xv3 h SER 32 N 1.07 0.55 -0.38 6.23 0.87 -1.99 0.38 113.55 120.28 1xv3 h SER 32 Ca 0.34 -0.14 -0.15 0.00 -1.23 0.00 0.00 61.79 60.62 1xv3 h SER 32 Cb 0.03 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 1xv3 h SER 32 CO -0.10 0.54 -0.33 0.74 -0.53 0.00 0.00 176.83 177.14 1xv3 h THR 33 N 0.53 1.28 -0.84 2.23 2.02 -1.82 -2.38 112.91 113.92 1xv3 h THR 33 Ca 0.14 -1.50 -0.03 0.00 0.77 0.00 0.00 66.41 65.79 1xv3 h THR 33 Cb 0.14 1.39 -0.04 0.00 -1.74 0.00 0.00 68.15 67.90 1xv3 h THR 33 CO -0.02 0.50 0.40 0.00 0.37 0.00 0.00 175.52 176.77 1xv3 h ALA 34 N 0.77 1.09 -0.50 6.16 0.00 -0.40 0.10 119.26 126.48 1xv3 h ALA 34 Ca 0.06 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1xv3 h ALA 34 Cb 0.92 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1xv3 h ALA 34 CO 0.08 0.66 0.13 -0.09 0.00 0.00 0.00 179.25 180.03 1xv3 h ARG 35 N 1.21 0.79 -0.41 0.00 2.43 -0.13 -2.02 114.38 116.24 1xv3 h ARG 35 Ca 0.29 -0.19 -0.11 0.00 -0.81 0.00 0.00 59.98 59.17 1xv3 h ARG 35 Cb 0.13 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 1xv3 h ARG 35 CO -0.04 0.76 -0.17 1.25 -1.51 0.00 0.00 179.97 180.26 1xv3 h LEU 36 N 0.68 0.78 -1.73 3.80 5.85 -1.07 0.65 115.31 124.27 1xv3 h LEU 36 Ca 0.16 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.59 1xv3 h LEU 36 Cb 0.32 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 1xv3 h LEU 36 CO 0.00 0.95 -0.14 0.00 -0.34 0.00 0.00 178.44 178.91 1xv3 h PHE 39 N 0.06 1.04 0.00 0.00 3.57 -0.59 -2.84 116.94 118.18 1xv3 h PHE 39 Ca -0.34 -0.26 0.00 0.00 3.53 0.00 0.00 57.97 60.89 1xv3 h PHE 39 Cb 2.03 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 40.54 1xv3 h PHE 39 CO 0.06 1.06 -0.79 0.54 -2.23 0.00 0.00 178.31 176.95 1xv3 n ARG 40 N -4.09 0.43 -0.03 1.11 1.74 0.09 -4.71 116.66 111.21 1xv3 n ARG 40 Ca -0.00 0.20 -0.17 0.00 -0.77 0.00 0.00 57.85 57.11 1xv3 n ARG 40 Cb 0.47 -1.29 -0.08 0.00 -1.02 0.00 0.00 32.46 30.54 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 -0.83 0.85 0.00 -1.55 0.05 -1.58 -3.48 116.97 110.44 1xv3 h TYR 41 Ca 0.00 -0.37 0.00 0.00 0.05 0.00 0.00 58.73 58.41 1xv3 h TYR 41 Cb 0.79 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 38.40 1xv3 h TYR 41 CO -0.34 1.17 0.00 0.41 -1.05 0.00 0.00 178.16 178.35 1xv3 n GLY 42 N 0.71 1.15 3.91 3.88 0.00 0.15 -4.96 105.19 110.02 1xv3 n GLY 42 Ca -0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.73 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 5.92 -1.30 1.61 1.01 -0.56 -4.50 116.67 116.85 1xv3 s ASP 43 Ca 0.00 -0.11 -0.08 0.00 0.71 0.00 0.00 52.55 53.07 1xv3 s ASP 43 Cb 0.00 -1.58 0.01 0.00 1.01 0.00 0.00 42.92 42.36 1xv3 s ASP 43 CO 0.00 -0.11 1.13 0.00 0.21 0.00 0.00 175.17 176.41 1xv3 s HIS 46 N -2.35 3.13 -0.15 0.00 3.76 -1.26 -5.11 115.29 113.31 1xv3 s HIS 46 Ca -0.17 -1.52 0.01 0.00 -0.15 0.00 0.00 55.06 53.23 1xv3 s HIS 46 Cb 0.03 -4.36 0.01 0.00 1.11 0.00 0.00 32.58 29.36 1xv3 s HIS 46 CO 0.26 -1.54 0.54 1.28 -0.85 0.00 0.00 174.74 174.44