#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emi s SER 2 N 0.00 -0.26 0.19 1.61 1.04 -1.26 -5.19 113.70 109.83 2emi s SER 2 Ca 0.00 0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.56 2emi s SER 2 Cb 0.00 0.25 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 2emi s SER 2 CO 0.00 -0.36 0.07 -0.44 0.98 0.00 0.00 173.24 173.49 2emi s SER 3 N -1.83 0.76 0.00 7.02 0.01 -1.26 -4.97 113.70 113.43 2emi s SER 3 Ca 0.05 -1.28 0.00 0.00 1.31 0.00 0.00 55.95 56.02 2emi s SER 3 Cb -0.01 0.23 0.00 0.00 0.21 0.00 0.00 66.02 66.45 2emi s SER 3 CO -0.04 -0.71 0.00 0.61 0.41 0.00 0.00 173.24 173.51 2emi n GLY 4 N -0.27 0.18 1.89 3.44 0.00 -1.26 -5.02 105.19 104.14 2emi n GLY 4 Ca -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 2emi n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2emi n SER 5 N 0.00 5.48 -4.38 1.61 2.88 -1.26 -4.79 113.62 113.15 2emi n SER 5 Ca 0.00 -2.57 -0.46 0.00 -1.33 0.00 0.00 58.87 54.52 2emi n SER 5 Cb 0.00 -1.29 -0.02 0.00 -0.75 0.00 0.00 64.21 62.15 2emi n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2emi s SER 6 N 1.72 6.69 0.00 -3.46 0.15 -1.26 -4.91 113.70 112.62 2emi s SER 6 Ca 0.43 -2.38 0.00 0.00 0.70 0.00 0.00 55.95 54.70 2emi s SER 6 Cb 0.22 -2.29 0.00 0.00 -1.71 0.00 0.00 66.02 62.24 2emi s SER 6 CO -0.02 -0.80 0.00 0.61 1.20 0.00 0.00 173.24 174.23 2emi n GLY 7 N 4.65 4.33 3.02 9.45 0.00 -1.26 -5.15 105.19 120.24 2emi n GLY 7 Ca 0.17 -0.55 -0.25 0.00 0.00 0.00 0.00 46.02 45.39 2emi n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2emi s THR 8 N -1.12 1.16 0.00 2.61 -1.32 -1.26 -5.09 115.64 110.61 2emi s THR 8 Ca 0.00 -0.48 0.00 0.00 -1.21 0.00 0.00 61.69 60.00 2emi s THR 8 Cb 0.00 -1.06 0.00 0.00 -1.51 0.00 0.00 72.50 69.93 2emi s THR 8 CO 0.00 0.36 0.00 0.61 -2.21 0.00 0.00 174.62 173.38 2emi n GLY 9 N 3.89 0.05 0.11 6.08 0.00 -1.26 -4.97 105.19 109.09 2emi n GLY 9 Ca -0.22 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.67 2emi n GLY 9 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2emi n GLU 10 N 0.00 0.74 -3.14 1.61 0.28 -1.26 -5.03 120.64 113.84 2emi n GLU 10 Ca 0.00 0.07 -0.14 0.00 -0.16 0.00 0.00 57.16 56.93 2emi n GLU 10 Cb 0.00 -1.49 0.07 0.00 1.43 0.00 0.00 31.44 31.45 2emi n GLU 10 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 2emi n ARG 11 N -2.97 -4.88 -1.59 3.44 0.63 -1.26 -4.90 116.66 105.13 2emi n ARG 11 Ca -0.37 0.70 -0.46 0.00 -0.92 0.00 0.00 57.85 56.80 2emi n ARG 11 Cb 1.04 -5.24 -0.02 0.00 0.45 0.00 0.00 32.46 28.69 2emi n ARG 11 CO 0.00 0.00 0.00 -2.39 -2.51 0.00 0.00 177.63 172.73 2emi n HIS 12 N -3.47 1.29 -1.55 -0.14 1.44 -1.26 -4.74 115.22 106.79 2emi n HIS 12 Ca -0.21 0.69 -0.35 0.00 -2.01 0.00 0.00 57.72 55.83 2emi n HIS 12 Cb 0.63 -2.26 -0.04 0.00 0.12 0.00 0.00 29.99 28.44 2emi n HIS 12 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 2emi n TYR 13 N 0.70 1.35 -3.04 -1.40 4.02 0.58 -4.56 117.16 114.81 2emi n TYR 13 Ca 0.12 0.13 -0.39 0.00 -0.01 0.00 0.00 57.90 57.74 2emi n TYR 13 Cb 0.30 -2.61 -0.06 0.00 -0.02 0.00 0.00 39.34 36.94 2emi n TYR 13 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 2emi s GLU 14 N 8.37 4.48 -0.28 -0.72 2.02 -1.26 -1.66 118.70 129.65 2emi s GLU 14 Ca 1.01 1.05 -0.29 0.00 0.02 0.00 0.00 54.97 56.76 2emi s GLU 14 Cb -0.25 -3.28 -0.01 0.00 0.10 0.00 0.00 34.13 30.69 2emi s GLU 14 CO 0.27 0.51 1.45 0.00 0.02 0.00 0.00 175.26 177.51 2emi n SER 16 N 8.14 5.54 0.00 0.00 7.64 -1.26 -2.74 113.62 130.95 2emi n SER 16 Ca 0.17 -2.53 0.00 0.00 1.01 0.00 0.00 58.87 57.52 2emi n SER 16 Cb 0.46 -1.13 0.00 0.00 -1.01 0.00 0.00 64.21 62.53 2emi n SER 16 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2emi n GLU 17 N 1.36 0.00 0.01 1.43 -0.58 -1.26 -4.99 120.64 116.60 2emi n GLU 17 Ca 0.08 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.80 2emi n GLU 17 Cb 0.54 -0.51 -0.00 0.00 -0.57 0.00 0.00 31.44 30.89 2emi n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2emi n GLY 19 N 3.04 0.31 4.02 0.00 0.00 -1.11 -5.09 105.19 106.37 2emi n GLY 19 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 2emi n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2emi s LYS 20 N 0.00 2.37 -0.05 1.61 2.20 -1.25 -4.89 119.74 119.73 2emi s LYS 20 Ca 0.00 -1.61 -0.03 0.00 -0.36 0.00 0.00 55.97 53.97 2emi s LYS 20 Cb 0.00 -2.63 0.02 0.00 -1.51 0.00 0.00 37.83 33.71 2emi s LYS 20 CO 0.00 -0.77 0.11 0.00 -0.36 0.00 0.00 175.35 174.33 2emi s ALA 21 N -2.63 -0.24 0.04 3.13 0.00 -1.26 -1.35 121.76 119.43 2emi s ALA 21 Ca 0.59 0.41 0.03 0.00 0.00 0.00 0.00 51.96 53.00 2emi s ALA 21 Cb -0.06 -0.26 -0.02 0.00 0.00 0.00 0.00 23.12 22.78 2emi s ALA 21 CO 0.37 -0.08 -0.10 -0.06 0.00 0.00 0.00 175.76 175.89 2emi s PHE 22 N 0.44 0.83 0.21 0.00 0.08 -0.66 -4.97 117.98 113.90 2emi s PHE 22 Ca -0.03 -0.38 0.00 0.00 0.12 0.00 0.00 56.93 56.64 2emi s PHE 22 Cb -0.05 -0.49 0.15 0.00 -0.57 0.00 0.00 43.02 42.07 2emi s PHE 22 CO -0.02 -0.02 1.51 0.97 -0.10 0.00 0.00 175.22 177.56 2emi h ILE 23 N 4.58 1.36 -3.60 0.64 6.09 -1.93 0.17 117.51 124.81 2emi h ILE 23 Ca -0.35 -1.94 -0.67 0.00 -1.37 0.00 0.00 64.86 60.53 2emi h ILE 23 Cb 1.19 1.93 -0.19 0.00 0.47 0.00 0.00 36.82 40.23 2emi h ILE 23 CO 0.43 0.59 -0.80 -1.10 -3.07 0.00 0.00 178.15 174.19 2emi s GLN 24 N -3.82 1.72 0.02 2.19 -1.52 -1.26 -4.63 119.66 112.36 2emi s GLN 24 Ca -0.06 -1.26 -0.27 0.00 -1.95 0.00 0.00 55.36 51.82 2emi s GLN 24 Cb 0.11 -2.05 -0.16 0.00 -0.22 0.00 0.00 33.01 30.69 2emi s GLN 24 CO 0.82 0.46 1.20 -0.22 -0.25 0.00 0.00 175.29 177.31 2emi h LYS 25 N 3.59 -0.80 -0.83 2.91 1.63 -1.94 -3.07 116.57 118.06 2emi h LYS 25 Ca -0.49 0.05 0.17 0.00 -0.85 0.00 0.00 60.65 59.53 2emi h LYS 25 Cb 1.18 0.18 -0.16 0.00 -0.60 0.00 0.00 32.23 32.83 2emi h LYS 25 CO 0.46 -0.49 -0.22 0.77 -3.45 0.00 0.00 179.45 176.53 2emi h SER 26 N -1.10 -0.80 -0.69 4.20 0.02 -2.00 0.33 113.55 113.50 2emi h SER 26 Ca -0.09 0.25 0.14 0.00 -0.84 0.00 0.00 61.79 61.26 2emi h SER 26 Cb 0.68 0.52 -0.10 0.00 0.14 0.00 0.00 62.40 63.65 2emi h SER 26 CO 0.14 -0.28 0.16 0.74 -1.14 0.00 0.00 176.83 176.45 2emi h THR 27 N -0.00 0.56 -0.08 -2.27 2.02 -1.99 -1.27 112.91 109.88 2emi h THR 27 Ca 0.40 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.48 2emi h THR 27 Cb 0.61 0.26 -0.00 0.00 -1.74 0.00 0.00 68.15 67.28 2emi h THR 27 CO -0.86 0.05 0.05 0.25 0.37 0.00 0.00 175.52 175.38 2emi h LEU 28 N 0.27 0.09 -0.83 2.58 5.85 -0.28 -2.67 115.31 120.32 2emi h LEU 28 Ca 0.38 -0.03 0.18 0.00 0.84 0.00 0.00 57.88 59.26 2emi h LEU 28 Cb 0.62 -0.02 -0.11 0.00 0.37 0.00 0.00 40.66 41.51 2emi h LEU 28 CO -0.47 0.09 0.33 -1.28 -0.34 0.00 0.00 178.44 176.77 2emi h SER 29 N 0.08 0.27 -0.20 1.25 0.87 -0.48 0.51 113.55 115.86 2emi h SER 29 Ca 0.03 0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 2emi h SER 29 Cb 0.02 0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 2emi h SER 29 CO -0.01 0.04 0.13 0.24 -0.53 0.00 0.00 176.83 176.70 2emi h MET 30 N 0.41 0.26 0.00 2.24 2.86 -1.06 -2.91 114.93 116.73 2emi h MET 30 Ca 0.49 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 58.10 2emi h MET 30 Cb 0.85 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.45 2emi h MET 30 CO -0.48 0.17 -0.07 1.25 1.06 0.00 0.00 176.91 178.84 2emi h HIS 31 N 0.27 0.00 -1.10 -0.22 -0.00 0.01 -3.29 115.15 110.82 2emi h HIS 31 Ca 0.07 0.00 0.32 0.00 -0.00 0.00 0.00 60.37 60.76 2emi h HIS 31 Cb -0.03 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 27.34 2emi h HIS 31 CO -0.00 0.99 1.24 1.04 -0.00 0.00 0.00 177.93 181.20 2emi n GLN 32 N -4.61 0.01 -0.25 5.26 6.02 0.52 0.37 117.38 124.70 2emi n GLN 32 Ca -0.11 1.02 0.05 0.00 -0.01 0.00 0.00 57.00 57.95 2emi n GLN 32 Cb 0.48 -2.53 0.18 0.00 1.02 0.00 0.00 30.24 29.39 2emi n GLN 32 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 2emi h ARG 33 N 0.00 0.40 -0.21 -1.09 0.11 -1.62 0.18 114.38 112.15 2emi h ARG 33 Ca 0.52 -0.02 0.06 0.00 0.10 0.00 0.00 59.98 60.64 2emi h ARG 33 Cb 2.99 -0.09 -0.01 0.00 1.11 0.00 0.00 29.97 33.97 2emi h ARG 33 CO -0.01 0.27 0.77 -0.84 0.10 0.00 0.00 179.97 180.27 2emi h ILE 34 N 0.42 0.04 0.11 0.08 3.07 -0.34 0.61 117.51 121.49 2emi h ILE 34 Ca 0.41 0.00 -0.34 0.00 1.55 0.00 0.00 64.86 66.48 2emi h ILE 34 Cb 0.63 0.27 -0.02 0.00 -0.27 0.00 0.00 36.82 37.43 2emi h ILE 34 CO -0.41 0.00 -1.83 0.45 -1.05 0.00 0.00 178.15 175.30 2emi h HIS 35 N 0.00 0.41 -3.55 0.16 3.86 -0.84 -3.43 115.15 111.76 2emi h HIS 35 Ca 0.10 -0.30 -0.71 0.00 -1.16 0.00 0.00 60.37 58.31 2emi h HIS 35 Cb 1.65 -0.02 -0.34 0.00 1.06 0.00 0.00 27.41 29.76 2emi h HIS 35 CO 0.00 1.72 -0.34 -0.98 0.86 0.00 0.00 177.93 179.19 2emi s ARG 36 N -2.52 2.61 0.00 2.45 3.03 0.21 -5.02 118.95 119.71 2emi s ARG 36 Ca -0.23 -2.43 0.00 0.00 2.03 0.00 0.00 55.73 55.10 2emi s ARG 36 Cb 0.06 -3.79 0.00 0.00 -1.03 0.00 0.00 34.95 30.19 2emi s ARG 36 CO 0.74 -1.18 0.00 0.41 -1.13 0.00 0.00 175.30 174.14 2emi n GLY 37 N 3.69 -0.39 2.37 3.88 0.00 -1.22 -4.35 105.19 109.17 2emi n GLY 37 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 2emi n GLY 37 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2emi n GLU 38 N 0.00 0.00 -4.07 1.61 1.02 -1.26 -1.61 120.64 116.33 2emi n GLU 38 Ca 0.00 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.78 2emi n GLU 38 Cb 0.00 -0.72 -0.02 0.00 -0.02 0.00 0.00 31.44 30.68 2emi n GLU 38 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2emi n LYS 39 N 0.96 -1.20 0.23 3.49 5.02 -1.26 -4.81 118.16 120.58 2emi n LYS 39 Ca 0.08 0.20 0.16 0.00 -2.02 0.00 0.00 58.31 56.72 2emi n LYS 39 Cb 0.29 -3.47 0.64 0.00 -0.02 0.00 0.00 35.03 32.46 2emi n LYS 39 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2emi h PRO 40 N -2.12 0.00 -2.54 1.97 0.13 -1.50 -3.40 132.00 124.55 2emi h PRO 40 Ca -0.68 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.10 2emi h PRO 40 Cb 1.39 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 32.16 2emi h PRO 40 CO 0.59 0.00 -0.66 -1.12 -0.23 0.00 0.00 178.00 176.59 2emi s SER 41 N -5.15 1.74 0.00 1.44 0.01 -1.26 -5.03 113.70 105.46 2emi s SER 41 Ca 0.02 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 56.82 2emi s SER 41 Cb 0.09 0.27 0.00 0.00 0.21 0.00 0.00 66.02 66.59 2emi s SER 41 CO 0.48 -0.35 0.00 0.61 0.41 0.00 0.00 173.24 174.39 2emi n GLY 42 N 5.31 0.43 3.77 3.44 0.00 -1.26 -4.97 105.19 111.91 2emi n GLY 42 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 2emi n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2emi s PRO 43 N 0.00 2.93 -1.62 1.61 0.04 -1.26 -3.49 135.00 133.21 2emi s PRO 43 Ca 0.00 1.44 -0.14 0.00 0.04 0.00 0.00 61.00 62.34 2emi s PRO 43 Cb 0.00 -1.96 0.12 0.00 0.04 0.00 0.00 34.50 32.69 2emi s PRO 43 CO 0.00 -1.16 0.75 0.43 0.04 0.00 0.00 177.00 177.06 2emi n SER 44 N -2.17 -2.96 -4.45 6.66 7.64 -1.26 -4.84 113.62 112.24 2emi n SER 44 Ca 0.11 -0.97 -0.39 0.00 1.01 0.00 0.00 58.87 58.62 2emi n SER 44 Cb 0.52 -3.00 0.03 0.00 -1.01 0.00 0.00 64.21 60.75 2emi n SER 44 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2emi n SER 45 N -2.75 -1.14 0.00 6.43 2.88 -1.23 -5.19 113.62 112.62 2emi n SER 45 Ca -0.01 0.77 0.00 0.00 -1.33 0.00 0.00 58.87 58.30 2emi n SER 45 Cb 0.54 -1.14 0.00 0.00 -0.75 0.00 0.00 64.21 62.85 2emi n SER 45 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42