#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 6.34 0.16 1.61 1.04 -1.26 -5.07 113.70 116.52 2dmv s SER 2 Ca 0.00 0.40 -0.11 0.00 0.48 0.00 0.00 55.95 56.72 2dmv s SER 2 Cb 0.00 -2.22 -0.07 0.00 0.10 0.00 0.00 66.02 63.83 2dmv s SER 2 CO 0.00 -0.15 0.50 -0.94 0.98 0.00 0.00 173.24 173.64 2dmv s SER 3 N 1.37 6.69 0.00 7.02 1.04 -1.26 -4.88 113.70 123.69 2dmv s SER 3 Ca 0.17 0.92 0.00 0.00 0.48 0.00 0.00 55.95 57.53 2dmv s SER 3 Cb -0.15 -2.23 0.00 0.00 0.10 0.00 0.00 66.02 63.74 2dmv s SER 3 CO 0.09 0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.97 2dmv n GLY 4 N 0.44 -1.71 3.59 7.32 0.00 -1.26 -4.72 105.19 108.86 2dmv n GLY 4 Ca -0.04 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 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 -4.00 6.08 0.01 1.61 0.01 -1.26 -4.98 113.70 111.17 2dmv s SER 5 Ca 0.00 0.84 0.03 0.00 1.31 0.00 0.00 55.95 58.13 2dmv s SER 5 Cb 0.00 -2.54 -0.01 0.00 0.21 0.00 0.00 66.02 63.68 2dmv s SER 5 CO 0.00 -1.64 -0.09 -0.94 0.41 0.00 0.00 173.24 170.98 2dmv s SER 6 N 5.01 1.08 0.00 2.44 1.04 -1.26 -5.14 113.70 116.87 2dmv s SER 6 Ca 0.66 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.82 2dmv s SER 6 Cb -0.16 -0.08 0.00 0.00 0.10 0.00 0.00 66.02 65.88 2dmv s SER 6 CO 0.31 0.04 0.00 0.61 0.98 0.00 0.00 173.24 175.18 2dmv n GLY 7 N 2.45 5.07 3.15 7.32 0.00 -1.26 -5.15 105.19 116.77 2dmv n GLY 7 Ca -0.16 -1.03 -0.09 0.00 0.00 0.00 0.00 46.02 44.74 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 1.79 0.97 0.99 1.43 -1.26 -5.15 118.68 117.45 2dmv s LEU 8 Ca 0.00 -0.67 -0.12 0.00 -1.03 0.00 0.00 54.13 52.31 2dmv s LEU 8 Cb 0.00 0.70 0.17 0.00 0.03 0.00 0.00 46.19 47.09 2dmv s LEU 8 CO 0.00 -0.61 1.09 -2.16 0.23 0.00 0.00 176.35 174.90 2dmv s PRO 9 N -3.35 0.68 -0.38 1.29 0.04 -1.26 -4.93 135.00 127.08 2dmv s PRO 9 Ca 0.01 0.61 -0.28 0.00 0.04 0.00 0.00 61.00 61.39 2dmv s PRO 9 Cb 0.03 -1.76 -0.01 0.00 0.04 0.00 0.00 34.50 32.80 2dmv s PRO 9 CO -0.08 -2.59 1.72 -1.25 0.04 0.00 0.00 177.00 174.84 2dmv s PRO 10 N -4.95 3.30 0.00 0.56 0.04 -1.26 -2.53 135.00 130.16 2dmv s PRO 10 Ca 0.65 1.21 0.00 0.00 0.04 0.00 0.00 61.00 62.90 2dmv s PRO 10 Cb -0.18 -4.18 0.00 0.00 0.04 0.00 0.00 34.50 30.17 2dmv s PRO 10 CO 0.57 -1.90 0.00 0.41 0.04 0.00 0.00 177.00 176.13 2dmv n GLY 11 N 5.38 1.68 3.75 0.56 0.00 -1.26 -5.11 105.19 110.19 2dmv n GLY 11 Ca 0.21 0.00 -0.34 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 -1.67 3.26 0.39 1.61 0.52 -1.05 -2.39 118.94 119.60 2dmv s TRP 12 Ca 0.00 0.23 0.08 0.00 0.02 0.00 0.00 56.10 56.42 2dmv s TRP 12 Cb 0.00 -1.77 -0.03 0.00 -1.15 0.00 0.00 33.47 30.52 2dmv s TRP 12 CO 0.00 0.54 0.30 -2.00 0.02 0.00 0.00 176.95 175.81 2dmv s GLU 13 N -1.39 2.51 -0.12 4.98 2.56 0.59 -4.75 118.70 123.09 2dmv s GLU 13 Ca 0.19 -1.53 -0.00 0.00 0.00 0.00 0.00 54.97 53.63 2dmv s GLU 13 Cb -0.12 -2.32 0.02 0.00 2.00 0.00 0.00 34.13 33.72 2dmv s GLU 13 CO 0.09 -0.08 -0.09 -1.14 -0.56 0.00 0.00 175.26 173.48 2dmv s GLN 14 N -4.03 1.72 0.24 4.30 0.74 -1.26 -1.93 119.66 119.44 2dmv s GLN 14 Ca 0.44 -0.34 -0.04 0.00 0.05 0.00 0.00 55.36 55.48 2dmv s GLN 14 Cb -0.03 -1.69 -0.02 0.00 1.10 0.00 0.00 33.01 32.37 2dmv s GLN 14 CO 0.26 -0.24 0.28 1.03 -0.55 0.00 0.00 175.29 176.08 2dmv s ARG 15 N 1.57 1.44 0.06 1.67 0.52 -0.55 -5.00 118.95 118.67 2dmv s ARG 15 Ca 0.03 -1.58 0.04 0.00 -0.52 0.00 0.00 55.73 53.70 2dmv s ARG 15 Cb -0.13 0.35 -0.03 0.00 0.52 0.00 0.00 34.95 35.67 2dmv s ARG 15 CO -0.08 -0.54 -0.11 0.08 0.02 0.00 0.00 175.30 174.67 2dmv s VAL 16 N -3.91 0.87 0.67 3.52 1.01 -1.26 -0.84 120.40 120.47 2dmv s VAL 16 Ca 0.34 -1.25 0.01 0.00 0.00 0.00 0.00 61.98 61.08 2dmv s VAL 16 Cb 0.03 -0.92 0.13 0.00 0.00 0.00 0.00 36.38 35.63 2dmv s VAL 16 CO 0.14 -0.32 0.92 -0.67 0.00 0.00 0.00 175.10 175.17 2dmv n ASP 17 N 1.28 1.37 0.00 3.32 2.03 -1.23 -4.97 116.55 118.35 2dmv n ASP 17 Ca -0.21 -2.13 0.13 0.00 0.52 0.00 0.00 54.79 53.10 2dmv n ASP 17 Cb 0.55 -0.58 0.72 0.00 -0.72 0.00 0.00 41.12 41.08 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 -2.67 0.56 -0.01 -0.67 10.64 -1.26 -2.83 117.38 121.14 2dmv n GLN 18 Ca 0.16 0.02 0.02 0.00 -1.83 0.00 0.00 57.00 55.37 2dmv n GLN 18 Cb 0.56 -1.50 -0.12 0.00 -0.86 0.00 0.00 30.24 28.32 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 -1.18 0.45 0.00 2.61 8.25 -1.26 -4.98 115.22 119.11 2dmv n HIS 19 Ca 0.16 0.15 0.00 0.00 -0.26 0.00 0.00 57.72 57.76 2dmv n HIS 19 Cb 0.17 -0.88 0.00 0.00 1.12 0.00 0.00 29.99 30.40 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 1.42 1.15 3.45 -1.41 0.00 -1.13 -5.07 105.19 103.60 2dmv n GLY 20 Ca -0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.53 3.02 0.32 1.61 0.52 -1.26 -4.91 118.95 117.72 2dmv s ARG 21 Ca 0.00 -1.02 -0.29 0.00 -0.52 0.00 0.00 55.73 53.90 2dmv s ARG 21 Cb 0.00 -4.02 -0.11 0.00 0.52 0.00 0.00 34.95 31.33 2dmv s ARG 21 CO 0.00 -0.89 1.56 0.08 0.02 0.00 0.00 175.30 176.08 2dmv s VAL 22 N 1.88 2.07 -0.04 3.52 1.01 -1.26 -3.47 120.40 124.10 2dmv s VAL 22 Ca 0.08 0.06 -0.07 0.00 0.00 0.00 0.00 61.98 62.05 2dmv s VAL 22 Cb -0.20 -3.04 0.01 0.00 0.00 0.00 0.00 36.38 33.16 2dmv s VAL 22 CO 0.10 0.01 0.17 -0.72 0.00 0.00 0.00 175.10 174.66 2dmv s TYR 23 N -0.32 -0.12 0.15 5.22 -0.85 -0.02 -4.34 117.35 117.07 2dmv s TYR 23 Ca 0.60 0.29 -0.03 0.00 -0.52 0.00 0.00 57.07 57.41 2dmv s TYR 23 Cb -0.47 0.03 -0.05 0.00 0.38 0.00 0.00 41.96 41.85 2dmv s TYR 23 CO 0.52 -0.16 0.36 0.71 -1.52 0.00 0.00 175.55 175.46 2dmv s TYR 24 N -0.39 3.48 -0.13 -3.49 2.02 0.96 -1.48 117.35 118.33 2dmv s TYR 24 Ca -0.05 0.44 -0.00 0.00 -0.37 0.00 0.00 57.07 57.08 2dmv s TYR 24 Cb -0.03 -1.92 0.03 0.00 -0.40 0.00 0.00 41.96 39.64 2dmv s TYR 24 CO 0.01 0.44 -0.07 0.08 -1.57 0.00 0.00 175.55 174.43 2dmv s VAL 25 N -1.71 1.08 -0.14 0.71 1.01 -0.81 -2.26 120.40 118.28 2dmv s VAL 25 Ca 0.39 -0.40 -0.25 0.00 0.00 0.00 0.00 61.98 61.72 2dmv s VAL 25 Cb -0.12 -1.13 -0.02 0.00 0.00 0.00 0.00 36.38 35.11 2dmv s VAL 25 CO 0.27 0.31 0.82 -0.62 0.00 0.00 0.00 175.10 175.88 2dmv s ASP 26 N 1.68 6.99 0.13 3.32 -1.08 -0.83 -0.30 116.67 126.59 2dmv s ASP 26 Ca 0.04 1.22 0.25 0.00 -0.52 0.00 0.00 52.55 53.54 2dmv s ASP 26 Cb -0.13 -2.46 0.58 0.00 -1.46 0.00 0.00 42.92 39.46 2dmv s ASP 26 CO -0.08 -0.34 1.53 1.41 0.52 0.00 0.00 175.17 178.21 2dmv n HIS 27 N 4.88 0.60 -0.05 -5.34 8.25 -1.01 -0.11 115.22 122.45 2dmv n HIS 27 Ca 0.04 0.18 0.01 0.00 -0.26 0.00 0.00 57.72 57.68 2dmv n HIS 27 Cb 0.49 -0.71 -0.15 0.00 1.12 0.00 0.00 29.99 30.74 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 -2.07 0.60 -0.03 1.59 0.31 -1.26 -4.53 118.33 112.94 2dmv n VAL 28 Ca 0.05 -0.60 0.01 0.00 -0.01 0.00 0.00 64.34 63.78 2dmv n VAL 28 Cb 0.42 -0.22 -0.11 0.00 -0.91 0.00 0.00 33.84 33.03 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 -2.42 1.10 -3.07 5.55 -0.58 -1.25 -5.04 120.64 114.94 2dmv n GLU 29 Ca -0.16 -0.07 -0.13 0.00 -0.42 0.00 0.00 57.16 56.38 2dmv n GLU 29 Cb 0.79 -1.33 0.07 0.00 -0.57 0.00 0.00 31.44 30.40 2dmv n GLU 29 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2dmv n LYS 30 N -2.21 -3.67 -4.11 3.49 4.76 0.84 -5.01 118.16 112.25 2dmv n LYS 30 Ca -0.11 0.71 -0.15 0.00 -2.87 0.00 0.00 58.31 55.89 2dmv n LYS 30 Cb 0.62 -5.20 -0.12 0.00 -1.84 0.00 0.00 35.03 28.50 2dmv n LYS 30 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2dmv s ARG 31 N -4.64 0.65 -0.09 1.97 1.70 -1.23 -4.94 118.95 112.37 2dmv s ARG 31 Ca 0.19 -0.85 0.04 0.00 -0.47 0.00 0.00 55.73 54.64 2dmv s ARG 31 Cb -0.03 -0.50 0.00 0.00 -0.57 0.00 0.00 34.95 33.86 2dmv s ARG 31 CO 0.61 0.10 -0.22 0.95 -1.08 0.00 0.00 175.30 175.66 2dmv s THR 32 N -1.39 1.92 -0.05 4.99 -4.23 -1.26 -1.96 115.64 113.66 2dmv s THR 32 Ca -0.06 -0.94 -0.07 0.00 -1.18 0.00 0.00 61.69 59.44 2dmv s THR 32 Cb -0.10 -1.67 0.01 0.00 1.34 0.00 0.00 72.50 72.09 2dmv s THR 32 CO 0.01 0.53 0.17 0.28 -0.54 0.00 0.00 174.62 175.07 2dmv s THR 33 N 0.38 0.02 -0.10 3.99 -1.32 -0.96 -4.99 115.64 112.67 2dmv s THR 33 Ca -0.18 -0.18 0.21 0.00 -1.21 0.00 0.00 61.69 60.33 2dmv s THR 33 Cb -0.18 -0.31 0.21 0.00 -1.51 0.00 0.00 72.50 70.71 2dmv s THR 33 CO 0.08 -0.10 1.65 -0.50 -2.21 0.00 0.00 174.62 173.54 2dmv h TRP 34 N 5.42 0.00 -5.30 9.09 4.06 -1.88 0.27 115.95 127.61 2dmv h TRP 34 Ca -0.27 0.00 -0.33 0.00 2.06 0.00 0.00 58.89 60.35 2dmv h TRP 34 Cb 1.20 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.34 2dmv h TRP 34 CO 0.45 0.26 -0.12 -0.40 -3.56 0.00 0.00 178.44 175.07 2dmv n ASP 35 N -3.25 1.80 -4.82 -3.49 5.68 -1.26 -4.37 116.55 106.84 2dmv n ASP 35 Ca 0.02 -2.08 -0.33 0.00 -0.50 0.00 0.00 54.79 51.90 2dmv n ASP 35 Cb 0.55 -0.11 -0.01 0.00 -1.14 0.00 0.00 41.12 40.41 2dmv n ASP 35 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 2dmv s ARG 36 N -3.47 3.64 0.77 0.11 0.52 -1.26 -4.57 118.95 114.70 2dmv s ARG 36 Ca 0.26 1.13 -0.10 0.00 -0.52 0.00 0.00 55.73 56.49 2dmv s ARG 36 Cb -0.02 -2.08 0.06 0.00 0.52 0.00 0.00 34.95 33.42 2dmv s ARG 36 CO 0.16 -0.54 1.09 -1.25 0.02 0.00 0.00 175.30 174.79 2dmv s PRO 37 N -3.93 2.24 -0.11 3.54 0.04 -1.26 -4.99 135.00 130.53 2dmv s PRO 37 Ca 0.62 1.17 0.12 0.00 0.04 0.00 0.00 61.00 62.95 2dmv s PRO 37 Cb -0.14 -1.90 -0.24 0.00 0.04 0.00 0.00 34.50 32.27 2dmv s PRO 37 CO 0.32 -1.65 0.41 -1.13 0.04 0.00 0.00 177.00 174.98 2dmv n SER 38 N -3.53 0.79 -3.50 6.66 3.41 -1.26 -5.05 113.62 111.14 2dmv n SER 38 Ca 0.09 0.24 -0.01 0.00 -0.26 0.00 0.00 58.87 58.93 2dmv n SER 38 Cb 0.53 0.17 0.02 0.00 -0.26 0.00 0.00 64.21 64.66 2dmv n SER 38 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dmv s GLY 39 N -5.35 0.04 0.28 5.00 0.00 -1.26 -5.03 107.32 101.01 2dmv s GLY 39 Ca -0.10 -0.22 0.07 0.00 0.00 0.00 0.00 44.72 44.47 2dmv s GLY 39 CO 0.81 3.32 1.67 -0.56 0.00 0.00 0.00 173.10 178.34 2dmv h PRO 40 N 2.00 0.21 0.00 2.90 0.13 -2.02 -3.42 132.00 131.80 2dmv h PRO 40 Ca -0.26 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2dmv h PRO 40 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2dmv h PRO 40 CO 0.35 0.64 0.00 0.45 -0.23 0.00 0.00 178.00 179.20 2dmv n SER 41 N -3.98 0.00 -2.77 1.44 2.88 -1.26 -4.96 113.62 104.97 2dmv n SER 41 Ca -0.02 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.31 2dmv n SER 41 Cb 0.52 -0.04 0.01 0.00 -0.75 0.00 0.00 64.21 63.94 2dmv n SER 41 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dmv n SER 42 N -1.94 -5.58 0.00 -3.46 7.64 -1.26 -5.09 113.62 103.94 2dmv n SER 42 Ca 0.00 -0.15 0.00 0.00 1.01 0.00 0.00 58.87 59.73 2dmv n SER 42 Cb 0.00 -4.58 0.00 0.00 -1.01 0.00 0.00 64.21 58.62 2dmv n SER 42 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64