#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 2.53 1.04 1.61 0.15 -1.26 -5.13 113.70 112.64 2dmv s SER 2 Ca 0.00 -0.44 -0.12 0.00 0.70 0.00 0.00 55.95 56.09 2dmv s SER 2 Cb 0.00 -0.26 0.21 0.00 -1.71 0.00 0.00 66.02 64.27 2dmv s SER 2 CO 0.00 0.23 1.08 -0.55 1.20 0.00 0.00 173.24 175.20 2dmv s SER 3 N -0.76 2.04 0.00 5.45 0.15 -1.26 -4.87 113.70 114.45 2dmv s SER 3 Ca 0.08 1.74 0.00 0.00 0.70 0.00 0.00 55.95 58.47 2dmv s SER 3 Cb -0.08 -2.37 0.00 0.00 -1.71 0.00 0.00 66.02 61.86 2dmv s SER 3 CO 0.00 -3.58 0.00 0.61 1.20 0.00 0.00 173.24 171.47 2dmv n GLY 4 N 0.27 -0.51 3.87 9.45 0.00 -1.26 -4.99 105.19 112.02 2dmv n GLY 4 Ca 0.07 -1.77 -0.29 0.00 0.00 0.00 0.00 46.02 44.02 2dmv n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dmv s SER 5 N -1.67 4.54 0.21 1.61 0.01 -1.26 -5.09 113.70 112.06 2dmv s SER 5 Ca 0.00 0.95 -0.09 0.00 1.31 0.00 0.00 55.95 58.11 2dmv s SER 5 Cb 0.00 -1.55 0.04 0.00 0.21 0.00 0.00 66.02 64.72 2dmv s SER 5 CO 0.00 -1.90 0.49 -1.54 0.41 0.00 0.00 173.24 170.71 2dmv n SER 6 N -3.34 -1.31 0.00 2.44 3.41 -1.26 -5.13 113.62 108.43 2dmv n SER 6 Ca 0.07 -1.87 0.00 0.00 -0.26 0.00 0.00 58.87 56.81 2dmv n SER 6 Cb 0.59 2.17 0.00 0.00 -0.26 0.00 0.00 64.21 66.71 2dmv n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dmv n GLY 7 N -0.34 1.95 3.23 5.00 0.00 -1.26 -5.18 105.19 108.59 2dmv n GLY 7 Ca -0.05 0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 1.11 0.98 0.99 1.43 -1.26 -5.16 118.68 116.78 2dmv s LEU 8 Ca 0.00 -0.46 -0.12 0.00 -1.03 0.00 0.00 54.13 52.51 2dmv s LEU 8 Cb 0.00 1.24 0.18 0.00 0.03 0.00 0.00 46.19 47.64 2dmv s LEU 8 CO 0.00 -0.71 1.09 -2.16 0.23 0.00 0.00 176.35 174.80 2dmv s PRO 9 N -3.45 0.55 -0.32 1.29 0.04 -1.26 -4.94 135.00 126.92 2dmv s PRO 9 Ca 0.01 0.57 -0.29 0.00 0.04 0.00 0.00 61.00 61.34 2dmv s PRO 9 Cb 0.03 -1.75 -0.01 0.00 0.04 0.00 0.00 34.50 32.80 2dmv s PRO 9 CO -0.09 -2.66 1.69 -1.25 0.04 0.00 0.00 177.00 174.73 2dmv s PRO 10 N -4.96 3.48 0.00 0.56 0.04 -1.26 -2.59 135.00 130.28 2dmv s PRO 10 Ca 0.65 1.39 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2dmv s PRO 10 Cb -0.18 -4.13 0.00 0.00 0.04 0.00 0.00 34.50 30.23 2dmv s PRO 10 CO 0.57 -1.68 0.00 0.41 0.04 0.00 0.00 177.00 176.35 2dmv n GLY 11 N 5.20 1.41 3.60 0.56 0.00 -1.26 -5.10 105.19 109.60 2dmv n GLY 11 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.89 2.94 0.49 1.61 0.52 -1.07 -2.78 118.94 118.76 2dmv s TRP 12 Ca 0.00 0.02 0.07 0.00 0.02 0.00 0.00 56.10 56.20 2dmv s TRP 12 Cb 0.00 -1.68 0.01 0.00 -1.15 0.00 0.00 33.47 30.65 2dmv s TRP 12 CO 0.00 0.36 0.41 -2.00 0.02 0.00 0.00 176.95 175.73 2dmv s GLU 13 N -1.01 2.35 -0.10 4.98 2.56 0.30 -4.78 118.70 123.01 2dmv s GLU 13 Ca 0.14 -1.80 -0.01 0.00 0.00 0.00 0.00 54.97 53.29 2dmv s GLU 13 Cb -0.11 -2.23 0.03 0.00 2.00 0.00 0.00 34.13 33.82 2dmv s GLU 13 CO 0.04 -0.45 -0.00 -1.14 -0.56 0.00 0.00 175.26 173.14 2dmv s GLN 14 N -4.23 0.76 0.22 4.30 0.74 -1.26 -2.40 119.66 117.79 2dmv s GLN 14 Ca 0.42 -0.05 -0.03 0.00 0.05 0.00 0.00 55.36 55.75 2dmv s GLN 14 Cb -0.02 -1.28 -0.03 0.00 1.10 0.00 0.00 33.01 32.78 2dmv s GLN 14 CO 0.25 -0.36 0.23 1.03 -0.55 0.00 0.00 175.29 175.89 2dmv s ARG 15 N 1.91 1.34 0.05 1.67 0.52 -0.08 -5.00 118.95 119.36 2dmv s ARG 15 Ca 0.04 -1.58 0.03 0.00 -0.52 0.00 0.00 55.73 53.70 2dmv s ARG 15 Cb -0.13 0.32 -0.03 0.00 0.52 0.00 0.00 34.95 35.63 2dmv s ARG 15 CO -0.06 -0.48 -0.11 0.08 0.02 0.00 0.00 175.30 174.76 2dmv s VAL 16 N -4.04 0.79 0.54 3.52 1.01 -1.26 -0.36 120.40 120.60 2dmv s VAL 16 Ca 0.35 -1.18 0.02 0.00 0.00 0.00 0.00 61.98 61.17 2dmv s VAL 16 Cb 0.05 -0.81 0.10 0.00 0.00 0.00 0.00 36.38 35.73 2dmv s VAL 16 CO 0.13 -0.31 0.75 0.47 0.00 0.00 0.00 175.10 176.13 2dmv n ASP 17 N 1.38 1.19 0.00 3.32 8.00 -1.24 -4.97 116.55 124.24 2dmv n ASP 17 Ca -0.22 -1.96 0.14 0.00 0.71 0.00 0.00 54.79 53.45 2dmv n ASP 17 Cb 0.54 -0.47 0.75 0.00 -0.02 0.00 0.00 41.12 41.93 2dmv n ASP 17 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dmv n GLN 18 N -2.34 0.64 0.01 -1.24 10.64 -1.26 -2.82 117.38 121.01 2dmv n GLN 18 Ca 0.13 0.02 0.03 0.00 -1.83 0.00 0.00 57.00 55.34 2dmv n GLN 18 Cb 0.46 -1.50 -0.10 0.00 -0.86 0.00 0.00 30.24 28.24 2dmv n GLN 18 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 2dmv n HIS 19 N -1.13 0.59 0.00 2.61 8.25 -1.26 -4.98 115.22 119.29 2dmv n HIS 19 Ca 0.17 0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.82 2dmv n HIS 19 Cb 0.15 -0.91 0.00 0.00 1.12 0.00 0.00 29.99 30.35 2dmv n HIS 19 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dmv n GLY 20 N 1.39 1.07 3.42 -1.41 0.00 -1.13 -5.07 105.19 103.46 2dmv n GLY 20 Ca -0.11 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.61 2.97 0.38 1.61 0.52 -1.26 -4.92 118.95 117.64 2dmv s ARG 21 Ca 0.00 -1.21 -0.28 0.00 -0.52 0.00 0.00 55.73 53.73 2dmv s ARG 21 Cb 0.00 -4.06 -0.11 0.00 0.52 0.00 0.00 34.95 31.30 2dmv s ARG 21 CO 0.00 -0.91 1.50 0.08 0.02 0.00 0.00 175.30 175.99 2dmv s VAL 22 N 1.66 2.01 -0.05 3.52 1.01 -1.26 -3.61 120.40 123.68 2dmv s VAL 22 Ca 0.04 0.01 -0.13 0.00 0.00 0.00 0.00 61.98 61.90 2dmv s VAL 22 Cb -0.22 -3.01 0.02 0.00 0.00 0.00 0.00 36.38 33.18 2dmv s VAL 22 CO 0.08 0.00 0.30 -0.72 0.00 0.00 0.00 175.10 174.77 2dmv s TYR 23 N -1.12 -0.22 0.17 5.22 -0.85 0.51 -4.33 117.35 116.72 2dmv s TYR 23 Ca 0.53 0.43 0.01 0.00 -0.52 0.00 0.00 57.07 57.52 2dmv s TYR 23 Cb -0.47 0.09 -0.04 0.00 0.38 0.00 0.00 41.96 41.93 2dmv s TYR 23 CO 0.64 -0.31 0.33 0.71 -1.52 0.00 0.00 175.55 175.39 2dmv s TYR 24 N -0.85 3.49 -0.11 -3.49 2.02 0.10 -0.90 117.35 117.60 2dmv s TYR 24 Ca -0.09 0.22 -0.01 0.00 -0.37 0.00 0.00 57.07 56.82 2dmv s TYR 24 Cb -0.04 -1.75 0.03 0.00 -0.40 0.00 0.00 41.96 39.79 2dmv s TYR 24 CO 0.03 0.46 -0.06 0.08 -1.57 0.00 0.00 175.55 174.48 2dmv s VAL 25 N -1.80 0.92 -0.18 0.71 1.01 -1.01 -2.59 120.40 117.46 2dmv s VAL 25 Ca 0.36 -0.25 -0.19 0.00 0.00 0.00 0.00 61.98 61.90 2dmv s VAL 25 Cb -0.11 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 35.26 2dmv s VAL 25 CO 0.29 0.33 0.55 -0.62 0.00 0.00 0.00 175.10 175.64 2dmv s ASP 26 N 1.75 6.64 0.10 3.32 2.15 -1.06 -0.53 116.67 129.03 2dmv s ASP 26 Ca 0.05 0.76 0.25 0.00 0.43 0.00 0.00 52.55 54.05 2dmv s ASP 26 Cb -0.13 -2.31 0.61 0.00 -0.30 0.00 0.00 42.92 40.79 2dmv s ASP 26 CO -0.08 -0.18 1.53 1.41 -0.17 0.00 0.00 175.17 177.69 2dmv n HIS 27 N 4.64 0.46 -0.05 -5.34 8.25 -1.12 -0.11 115.22 121.96 2dmv n HIS 27 Ca -0.04 0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 2dmv n HIS 27 Cb 0.50 -0.63 -0.16 0.00 1.12 0.00 0.00 29.99 30.83 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 -1.95 0.73 -0.03 1.59 0.31 -1.26 -4.50 118.33 113.22 2dmv n VAL 28 Ca 0.05 -0.68 -0.00 0.00 -0.01 0.00 0.00 64.34 63.69 2dmv n VAL 28 Cb 0.40 -0.26 -0.09 0.00 -0.91 0.00 0.00 33.84 32.98 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 -2.53 1.29 -3.17 5.55 -0.58 -1.24 -5.03 120.64 114.91 2dmv n GLU 29 Ca -0.18 -0.06 -0.14 0.00 -0.42 0.00 0.00 57.16 56.36 2dmv n GLU 29 Cb 0.87 -1.30 0.07 0.00 -0.57 0.00 0.00 31.44 30.51 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 -2.20 -5.41 -4.29 3.49 3.00 0.85 -5.02 118.16 108.57 2dmv n LYS 30 Ca -0.11 0.70 -0.20 0.00 -0.00 0.00 0.00 58.31 58.70 2dmv n LYS 30 Cb 0.62 -5.27 -0.13 0.00 0.00 0.00 0.00 35.03 30.25 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 -5.11 0.91 -0.13 1.64 1.70 -1.23 -4.96 118.95 111.77 2dmv s ARG 31 Ca 0.01 -0.84 0.01 0.00 -0.47 0.00 0.00 55.73 54.43 2dmv s ARG 31 Cb -0.00 -0.93 -0.01 0.00 -0.57 0.00 0.00 34.95 33.44 2dmv s ARG 31 CO 0.60 0.22 -0.15 0.95 -1.08 0.00 0.00 175.30 175.84 2dmv s THR 32 N -1.01 2.81 -0.07 4.99 -4.23 -1.26 -2.57 115.64 114.30 2dmv s THR 32 Ca 0.01 -0.74 -0.06 0.00 -1.18 0.00 0.00 61.69 59.71 2dmv s THR 32 Cb -0.09 -2.16 0.02 0.00 1.34 0.00 0.00 72.50 71.61 2dmv s THR 32 CO 0.02 0.53 0.18 0.28 -0.54 0.00 0.00 174.62 175.09 2dmv s THR 33 N 0.40 -0.01 0.19 3.99 -1.32 -1.07 -5.00 115.64 112.82 2dmv s THR 33 Ca -0.12 0.04 0.22 0.00 -1.21 0.00 0.00 61.69 60.62 2dmv s THR 33 Cb -0.16 -0.27 0.20 0.00 -1.51 0.00 0.00 72.50 70.76 2dmv s THR 33 CO 0.06 0.02 1.82 -0.50 -2.21 0.00 0.00 174.62 173.81 2dmv h TRP 34 N 6.18 0.00 -0.48 9.09 4.06 -1.88 0.29 115.95 133.21 2dmv h TRP 34 Ca -0.29 0.00 -0.65 0.00 2.06 0.00 0.00 58.89 60.01 2dmv h TRP 34 Cb 1.19 0.00 -0.11 0.00 -1.00 0.00 0.00 29.16 29.24 2dmv h TRP 34 CO 0.40 0.27 -0.46 0.34 -3.56 0.00 0.00 178.44 175.44 2dmv s ASP 35 N -6.30 4.28 0.93 -3.49 2.15 -1.26 -4.18 116.67 108.80 2dmv s ASP 35 Ca -0.00 -1.52 -0.10 0.00 0.43 0.00 0.00 52.55 51.36 2dmv s ASP 35 Cb 0.11 0.45 0.15 0.00 -0.30 0.00 0.00 42.92 43.33 2dmv s ASP 35 CO 0.65 -0.91 1.12 0.54 -0.17 0.00 0.00 175.17 176.41 2dmv n ARG 36 N -1.40 -0.54 -0.85 4.34 1.74 -1.26 -4.67 116.66 114.02 2dmv n ARG 36 Ca -0.13 -0.09 -0.25 0.00 -0.77 0.00 0.00 57.85 56.61 2dmv n ARG 36 Cb 0.66 -2.36 0.21 0.00 -1.02 0.00 0.00 32.46 29.95 2dmv n ARG 36 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2dmv n PRO 37 N -4.22 -2.79 -3.45 5.56 -0.04 -1.26 -4.42 135.00 124.37 2dmv n PRO 37 Ca 0.12 -1.44 -0.18 0.00 -0.04 0.00 0.00 63.50 61.96 2dmv n PRO 37 Cb 0.52 -1.35 0.09 0.00 -0.04 0.00 0.00 33.50 32.72 2dmv n PRO 37 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dmv n SER 38 N -4.55 -2.70 -0.83 3.54 2.88 -1.26 -4.74 113.62 105.96 2dmv n SER 38 Ca 0.12 -0.60 0.10 0.00 -1.33 0.00 0.00 58.87 57.17 2dmv n SER 38 Cb 0.48 -5.08 -0.04 0.00 -0.75 0.00 0.00 64.21 58.82 2dmv n SER 38 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dmv n GLY 39 N -1.26 -2.55 3.68 0.46 0.00 -1.26 -4.78 105.19 99.48 2dmv n GLY 39 Ca -0.24 -1.26 -0.42 0.00 0.00 0.00 0.00 46.02 44.10 2dmv n GLY 39 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dmv s PRO 40 N -3.00 4.25 0.20 1.61 0.04 -1.26 -4.78 135.00 132.04 2dmv s PRO 40 Ca 0.00 2.02 0.12 0.00 0.04 0.00 0.00 61.00 63.18 2dmv s PRO 40 Cb 0.00 -3.67 -0.06 0.00 0.04 0.00 0.00 34.50 30.81 2dmv s PRO 40 CO 0.00 -0.66 1.31 0.66 0.04 0.00 0.00 177.00 178.35 2dmv h SER 41 N 8.23 0.00 -0.48 6.66 4.64 -1.86 -3.45 113.55 127.29 2dmv h SER 41 Ca -0.38 0.00 0.22 0.00 -0.47 0.00 0.00 61.79 61.17 2dmv h SER 41 Cb 1.17 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.04 2dmv h SER 41 CO 0.92 0.70 0.22 -0.94 -0.87 0.00 0.00 176.83 176.86 2dmv s SER 42 N -6.48 -0.43 0.00 4.97 1.04 -1.26 -5.15 113.70 106.39 2dmv s SER 42 Ca 0.02 0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.84 2dmv s SER 42 Cb 0.08 1.41 0.00 0.00 0.10 0.00 0.00 66.02 67.62 2dmv s SER 42 CO 0.78 -0.08 0.25 0.61 0.98 0.00 0.00 173.24 175.78