#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmv s SER 2 N 0.00 6.36 -1.45 1.61 1.04 -1.26 -4.24 113.70 115.76 2dmv s SER 2 Ca 0.00 0.73 -0.08 0.00 0.48 0.00 0.00 55.95 57.08 2dmv s SER 2 Cb 0.00 -2.15 0.02 0.00 0.10 0.00 0.00 66.02 63.99 2dmv s SER 2 CO 0.00 -0.35 0.92 -1.20 0.98 0.00 0.00 173.24 173.59 2dmv n SER 3 N -1.58 -6.00 -3.97 7.02 7.64 -1.26 -4.99 113.62 110.49 2dmv n SER 3 Ca -0.02 -0.47 -0.25 0.00 1.01 0.00 0.00 58.87 59.14 2dmv n SER 3 Cb 0.55 -4.78 -0.17 0.00 -1.01 0.00 0.00 64.21 58.80 2dmv n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dmv s GLY 4 N -3.06 0.79 -0.55 0.23 0.00 -1.26 -5.09 107.32 98.39 2dmv s GLY 4 Ca 0.48 -0.45 -0.27 0.00 0.00 0.00 0.00 44.72 44.48 2dmv s GLY 4 CO 0.60 0.40 1.76 -1.35 0.00 0.00 0.00 173.10 174.51 2dmv s SER 5 N 1.08 5.56 0.02 1.64 1.04 -1.26 -4.97 113.70 116.81 2dmv s SER 5 Ca -0.07 0.51 0.09 0.00 0.48 0.00 0.00 55.95 56.96 2dmv s SER 5 Cb -0.14 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.42 2dmv s SER 5 CO -0.01 -2.12 -0.26 -0.94 0.98 0.00 0.00 173.24 170.89 2dmv s SER 6 N 6.99 3.09 0.00 7.02 1.04 -1.26 -5.14 113.70 125.44 2dmv s SER 6 Ca 0.67 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 56.56 2dmv s SER 6 Cb -0.14 -0.30 0.00 0.00 0.10 0.00 0.00 66.02 65.67 2dmv s SER 6 CO 0.24 0.28 0.00 0.61 0.98 0.00 0.00 173.24 175.35 2dmv n GLY 7 N 2.04 1.46 3.20 7.32 0.00 -1.26 -5.14 105.19 112.80 2dmv n GLY 7 Ca -0.17 -1.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.01 2dmv n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dmv s LEU 8 N 0.00 1.35 0.99 0.99 1.43 -1.26 -5.16 118.68 117.03 2dmv s LEU 8 Ca 0.00 -0.52 -0.12 0.00 -1.03 0.00 0.00 54.13 52.46 2dmv s LEU 8 Cb 0.00 1.04 0.18 0.00 0.03 0.00 0.00 46.19 47.44 2dmv s LEU 8 CO 0.00 -0.66 1.09 -2.16 0.23 0.00 0.00 176.35 174.85 2dmv s PRO 9 N -3.33 0.49 -0.20 1.29 0.04 -1.26 -4.95 135.00 127.08 2dmv s PRO 9 Ca 0.01 0.54 -0.29 0.00 0.04 0.00 0.00 61.00 61.29 2dmv s PRO 9 Cb 0.02 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.79 2dmv s PRO 9 CO -0.08 -2.70 1.59 -1.25 0.04 0.00 0.00 177.00 174.60 2dmv s PRO 10 N -4.97 3.87 0.00 0.56 0.04 -1.26 -2.64 135.00 130.60 2dmv s PRO 10 Ca 0.65 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.41 2dmv s PRO 10 Cb -0.18 -4.01 0.00 0.00 0.04 0.00 0.00 34.50 30.35 2dmv s PRO 10 CO 0.57 -1.20 0.00 0.41 0.04 0.00 0.00 177.00 176.82 2dmv n GLY 11 N 4.52 2.11 3.86 0.56 0.00 -1.26 -5.10 105.19 109.89 2dmv n GLY 11 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2dmv n GLY 11 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dmv s TRP 12 N -2.14 3.52 0.54 1.61 0.52 -1.08 -2.66 118.94 119.25 2dmv s TRP 12 Ca 0.00 0.42 0.06 0.00 0.02 0.00 0.00 56.10 56.60 2dmv s TRP 12 Cb 0.00 -1.88 0.04 0.00 -1.15 0.00 0.00 33.47 30.48 2dmv s TRP 12 CO 0.00 0.67 0.45 -2.00 0.02 0.00 0.00 176.95 176.10 2dmv s GLU 13 N -1.36 2.28 -0.21 4.98 2.56 -0.30 -4.78 118.70 121.88 2dmv s GLU 13 Ca 0.19 -1.93 -0.04 0.00 0.00 0.00 0.00 54.97 53.20 2dmv s GLU 13 Cb -0.12 -2.19 0.07 0.00 2.00 0.00 0.00 34.13 33.88 2dmv s GLU 13 CO 0.09 -0.61 0.08 -1.14 -0.56 0.00 0.00 175.26 173.13 2dmv s GLN 14 N -4.32 0.27 0.47 4.30 0.74 -1.26 -2.87 119.66 117.00 2dmv s GLN 14 Ca 0.39 -0.30 0.03 0.00 0.05 0.00 0.00 55.36 55.53 2dmv s GLN 14 Cb -0.03 -1.79 -0.03 0.00 1.10 0.00 0.00 33.01 32.26 2dmv s GLN 14 CO 0.24 -0.74 0.01 1.03 -0.55 0.00 0.00 175.29 175.28 2dmv s ARG 15 N 2.03 2.10 -0.18 1.67 0.52 0.25 -4.97 118.95 120.37 2dmv s ARG 15 Ca 0.03 -2.30 -0.04 0.00 -0.52 0.00 0.00 55.73 52.90 2dmv s ARG 15 Cb -0.16 -1.51 0.08 0.00 0.52 0.00 0.00 34.95 33.88 2dmv s ARG 15 CO -0.15 -0.27 0.19 0.08 0.02 0.00 0.00 175.30 175.18 2dmv s VAL 16 N -2.85 -0.28 1.28 3.52 1.01 -1.26 -0.51 120.40 121.31 2dmv s VAL 16 Ca 0.16 -0.06 -0.19 0.00 0.00 0.00 0.00 61.98 61.89 2dmv s VAL 16 Cb 0.04 -0.61 0.29 0.00 0.00 0.00 0.00 36.38 36.11 2dmv s VAL 16 CO 0.08 -0.17 0.69 -0.67 0.00 0.00 0.00 175.10 175.04 2dmv n ASP 17 N 5.31 -3.27 0.00 3.32 2.03 -1.19 -4.82 116.55 117.93 2dmv n ASP 17 Ca -0.06 -0.55 0.10 0.00 0.52 0.00 0.00 54.79 54.81 2dmv n ASP 17 Cb 0.49 -1.00 0.52 0.00 -0.72 0.00 0.00 41.12 40.41 2dmv n ASP 17 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dmv n GLN 18 N -4.38 0.23 0.10 -0.67 10.64 -1.26 -2.45 117.38 119.58 2dmv n GLN 18 Ca 0.08 0.10 0.11 0.00 -1.83 0.00 0.00 57.00 55.45 2dmv n GLN 18 Cb 0.54 -1.50 -0.01 0.00 -0.86 0.00 0.00 30.24 28.41 2dmv n GLN 18 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2dmv h HIS 19 N 0.00 0.00 0.00 2.61 3.86 -2.05 -3.48 115.15 116.09 2dmv h HIS 19 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2dmv h HIS 19 Cb 0.24 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.71 2dmv h HIS 19 CO 0.00 0.05 0.00 0.41 0.86 0.00 0.00 177.93 179.25 2dmv n GLY 20 N 1.20 0.81 3.48 2.45 0.00 -1.03 -5.06 105.19 107.04 2dmv n GLY 20 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 2dmv n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dmv s ARG 21 N -0.84 3.21 0.29 1.61 0.52 -1.26 -4.89 118.95 117.59 2dmv s ARG 21 Ca 0.00 -0.62 -0.30 0.00 -0.52 0.00 0.00 55.73 54.29 2dmv s ARG 21 Cb 0.00 -4.07 -0.11 0.00 0.52 0.00 0.00 34.95 31.29 2dmv s ARG 21 CO 0.00 -1.31 1.56 0.08 0.02 0.00 0.00 175.30 175.66 2dmv s VAL 22 N 3.14 2.16 -0.05 3.52 1.01 -1.26 -3.20 120.40 125.73 2dmv s VAL 22 Ca 0.21 0.14 -0.04 0.00 0.00 0.00 0.00 61.98 62.30 2dmv s VAL 22 Cb -0.16 -3.09 0.02 0.00 0.00 0.00 0.00 36.38 33.14 2dmv s VAL 22 CO 0.15 0.02 0.12 -0.72 0.00 0.00 0.00 175.10 174.67 2dmv s TYR 23 N -0.07 -0.13 0.30 5.22 -0.85 0.33 -4.37 117.35 117.79 2dmv s TYR 23 Ca 0.62 0.33 -0.07 0.00 -0.52 0.00 0.00 57.07 57.43 2dmv s TYR 23 Cb -0.47 0.02 -0.06 0.00 0.38 0.00 0.00 41.96 41.83 2dmv s TYR 23 CO 0.48 -0.08 0.60 0.71 -1.52 0.00 0.00 175.55 175.74 2dmv s TYR 24 N 0.25 3.47 -0.09 -3.49 2.02 0.99 -0.58 117.35 119.91 2dmv s TYR 24 Ca -0.02 0.77 -0.01 0.00 -0.37 0.00 0.00 57.07 57.44 2dmv s TYR 24 Cb -0.03 -2.20 0.03 0.00 -0.40 0.00 0.00 41.96 39.36 2dmv s TYR 24 CO -0.01 0.13 -0.05 0.08 -1.57 0.00 0.00 175.55 174.13 2dmv s VAL 25 N -2.10 0.77 -0.23 0.71 1.01 -1.14 -2.36 120.40 117.07 2dmv s VAL 25 Ca 0.46 -0.14 -0.22 0.00 0.00 0.00 0.00 61.98 62.08 2dmv s VAL 25 Cb -0.11 -0.83 -0.02 0.00 0.00 0.00 0.00 36.38 35.42 2dmv s VAL 25 CO 0.29 0.32 0.71 -0.62 0.00 0.00 0.00 175.10 175.80 2dmv s ASP 26 N 1.72 6.71 0.00 3.32 2.15 -0.98 -1.15 116.67 128.44 2dmv s ASP 26 Ca 0.03 0.87 0.29 0.00 0.43 0.00 0.00 52.55 54.18 2dmv s ASP 26 Cb -0.13 -2.38 1.35 0.00 -0.30 0.00 0.00 42.92 41.46 2dmv s ASP 26 CO -0.06 -0.40 1.98 1.41 -0.17 0.00 0.00 175.17 177.92 2dmv n HIS 27 N 5.65 0.00 -0.12 -5.34 8.25 -1.09 -0.08 115.22 122.50 2dmv n HIS 27 Ca 0.02 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.28 2dmv n HIS 27 Cb 0.49 -0.41 -0.10 0.00 1.12 0.00 0.00 29.99 31.09 2dmv n HIS 27 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2dmv n VAL 28 N -1.41 1.34 0.04 1.59 0.31 -1.26 -4.58 118.33 114.36 2dmv n VAL 28 Ca 0.10 -0.46 0.05 0.00 -0.01 0.00 0.00 64.34 64.02 2dmv n VAL 28 Cb 0.30 -1.48 -0.07 0.00 -0.91 0.00 0.00 33.84 31.68 2dmv n VAL 28 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2dmv n GLU 29 N -3.47 0.62 -3.04 5.55 -0.58 -1.25 -5.00 120.64 113.47 2dmv n GLU 29 Ca -0.44 0.12 -0.13 0.00 -0.42 0.00 0.00 57.16 56.30 2dmv n GLU 29 Cb 0.91 -1.76 0.06 0.00 -0.57 0.00 0.00 31.44 30.08 2dmv n GLU 29 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2dmv n LYS 30 N -2.73 -3.58 -4.18 3.49 3.00 0.89 -5.02 118.16 110.03 2dmv n LYS 30 Ca -0.07 0.70 -0.17 0.00 -0.00 0.00 0.00 58.31 58.76 2dmv n LYS 30 Cb 0.72 -5.12 -0.12 0.00 0.00 0.00 0.00 35.03 30.51 2dmv n LYS 30 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 2dmv s ARG 31 N -4.61 0.76 -0.11 1.64 1.70 -1.23 -4.95 118.95 112.15 2dmv s ARG 31 Ca 0.19 -0.85 0.02 0.00 -0.47 0.00 0.00 55.73 54.62 2dmv s ARG 31 Cb -0.02 -0.72 -0.01 0.00 -0.57 0.00 0.00 34.95 33.63 2dmv s ARG 31 CO 0.60 0.16 -0.20 0.95 -1.08 0.00 0.00 175.30 175.73 2dmv s THR 32 N -1.18 2.46 -0.07 4.99 -4.23 -1.26 -2.32 115.64 114.03 2dmv s THR 32 Ca -0.03 -0.88 -0.06 0.00 -1.18 0.00 0.00 61.69 59.54 2dmv s THR 32 Cb -0.09 -1.98 0.02 0.00 1.34 0.00 0.00 72.50 71.78 2dmv s THR 32 CO 0.02 0.55 0.18 0.28 -0.54 0.00 0.00 174.62 175.10 2dmv s THR 33 N 0.34 0.00 0.04 3.99 -1.32 -0.99 -5.00 115.64 112.70 2dmv s THR 33 Ca -0.16 -0.01 0.25 0.00 -1.21 0.00 0.00 61.69 60.57 2dmv s THR 33 Cb -0.17 -0.26 0.26 0.00 -1.51 0.00 0.00 72.50 70.82 2dmv s THR 33 CO 0.08 -0.00 1.80 -0.50 -2.21 0.00 0.00 174.62 173.79 2dmv h TRP 34 N 5.85 0.00 -1.15 9.09 4.06 -1.88 0.28 115.95 132.20 2dmv h TRP 34 Ca -0.25 0.00 -0.65 0.00 2.06 0.00 0.00 58.89 60.05 2dmv h TRP 34 Cb 1.20 0.00 -0.13 0.00 -1.00 0.00 0.00 29.16 29.23 2dmv h TRP 34 CO 0.41 0.18 -0.56 0.34 -3.56 0.00 0.00 178.44 175.24 2dmv s ASP 35 N -6.11 4.00 0.96 -3.49 2.15 -1.26 -4.27 116.67 108.65 2dmv s ASP 35 Ca 0.02 -1.47 -0.13 0.00 0.43 0.00 0.00 52.55 51.39 2dmv s ASP 35 Cb 0.09 -0.04 0.04 0.00 -0.30 0.00 0.00 42.92 42.71 2dmv s ASP 35 CO 0.63 -0.61 0.35 0.54 -0.17 0.00 0.00 175.17 175.90 2dmv n ARG 36 N -1.10 -0.37 -2.11 4.34 3.00 -1.26 -4.69 116.66 114.47 2dmv n ARG 36 Ca -0.10 -0.07 -0.43 0.00 -0.01 0.00 0.00 57.85 57.24 2dmv n ARG 36 Cb 0.67 -1.82 -0.03 0.00 0.00 0.00 0.00 32.46 31.28 2dmv n ARG 36 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2dmv s PRO 37 N -3.58 3.58 0.28 5.56 0.04 -1.26 -4.96 135.00 134.66 2dmv s PRO 37 Ca 0.56 1.46 -0.12 0.00 0.04 0.00 0.00 61.00 62.94 2dmv s PRO 37 Cb -0.20 -4.10 0.01 0.00 0.04 0.00 0.00 34.50 30.25 2dmv s PRO 37 CO 0.68 -1.55 0.53 -1.54 0.04 0.00 0.00 177.00 175.16 2dmv s SER 38 N 4.90 0.05 0.00 6.66 1.04 -1.26 -5.17 113.70 119.92 2dmv s SER 38 Ca 0.73 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 56.16 2dmv s SER 38 Cb -0.22 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.54 2dmv s SER 38 CO 0.31 -1.24 0.00 0.61 0.98 0.00 0.00 173.24 173.90 2dmv n GLY 39 N -0.43 3.03 3.57 7.32 0.00 -1.26 -4.96 105.19 112.45 2dmv n GLY 39 Ca -0.02 -1.88 -0.29 0.00 0.00 0.00 0.00 46.02 43.83 2dmv n GLY 39 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dmv n PRO 40 N -1.60 1.62 -4.21 1.61 -0.04 -1.26 -4.92 135.00 126.21 2dmv n PRO 40 Ca 0.00 -2.47 -0.23 0.00 -0.04 0.00 0.00 63.50 60.76 2dmv n PRO 40 Cb 0.00 -3.72 -0.06 0.00 -0.04 0.00 0.00 33.50 29.68 2dmv n PRO 40 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2dmv s SER 41 N 6.42 5.00 -0.04 3.54 0.01 -1.26 -5.05 113.70 122.32 2dmv s SER 41 Ca 0.68 -0.44 -0.20 0.00 1.31 0.00 0.00 55.95 57.30 2dmv s SER 41 Cb -0.00 -1.11 -0.32 0.00 0.21 0.00 0.00 66.02 64.80 2dmv s SER 41 CO 0.14 -0.01 0.87 0.77 0.41 0.00 0.00 173.24 175.42 2dmv h SER 42 N 1.80 0.54 0.00 2.44 4.64 -2.05 -3.55 113.55 117.37 2dmv h SER 42 Ca -0.46 -0.94 0.00 0.00 -0.47 0.00 0.00 61.79 59.92 2dmv h SER 42 Cb 1.24 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2dmv h SER 42 CO 0.60 1.49 0.00 0.61 -0.87 0.00 0.00 176.83 178.66