#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wss n ALA 2 N 0.00 0.00 1.13 3.52 0.00 -1.26 -5.00 120.51 118.90 2wss n ALA 2 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 2wss n ALA 2 Cb 0.00 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.52 2wss n ALA 2 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2wss n TYR 3 N 0.00 0.27 0.00 0.00 0.18 -1.26 -3.25 117.16 113.11 2wss n TYR 3 Ca 0.00 -0.11 0.00 0.00 1.88 0.00 0.00 57.90 59.67 2wss n TYR 3 Cb 0.00 -0.09 0.00 0.00 -0.38 0.00 0.00 39.34 38.87 2wss n TYR 3 CO 0.00 0.00 0.00 -2.67 -2.08 0.00 0.00 176.86 172.11 2wss n TRP 4 N -0.00 0.00 0.00 -3.48 4.27 -1.26 -5.06 117.44 111.91 2wss n TRP 4 Ca 0.05 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.66 2wss n TRP 4 Cb 0.26 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.21 2wss n TRP 4 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 2wss n ARG 5 N -0.29 3.18 0.00 -2.67 5.12 -1.20 -4.45 116.66 116.34 2wss n ARG 5 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2wss n ARG 5 Cb 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.31 2wss n ARG 5 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64 2wss n GLN 6 N 0.00 0.00 0.09 5.56 -0.06 -1.26 -4.30 117.38 117.42 2wss n GLN 6 Ca 0.00 0.00 -0.06 0.00 -2.00 0.00 0.00 57.00 54.94 2wss n GLN 6 Cb 0.00 0.00 0.05 0.00 -4.06 0.00 0.00 30.24 26.23 2wss n GLN 6 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2wss h ALA 7 N 0.00 0.68 0.00 1.69 0.00 -1.95 -3.47 119.26 116.21 2wss h ALA 7 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2wss h ALA 7 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2wss h ALA 7 CO 0.00 0.88 0.00 0.41 0.00 0.00 0.00 179.25 180.54 2wss n GLY 8 N 0.65 0.70 2.93 0.00 0.00 -1.26 -5.13 105.19 103.07 2wss n GLY 8 Ca -0.02 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.32 2wss n GLY 8 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wss s LEU 9 N 0.00 2.54 0.53 0.99 2.96 -1.26 -5.12 118.68 119.33 2wss s LEU 9 Ca 0.00 -1.18 -0.21 0.00 -0.22 0.00 0.00 54.13 52.52 2wss s LEU 9 Cb 0.00 -1.16 -0.05 0.00 0.50 0.00 0.00 46.19 45.48 2wss s LEU 9 CO 0.00 -0.24 1.20 -0.94 -1.32 0.00 0.00 176.35 175.04 2wss s SER 10 N 1.41 5.64 0.41 3.68 1.04 -1.26 -4.56 113.70 120.06 2wss s SER 10 Ca -0.05 2.37 0.23 0.00 0.48 0.00 0.00 55.95 58.97 2wss s SER 10 Cb -0.19 -2.60 1.23 0.00 0.10 0.00 0.00 66.02 64.56 2wss s SER 10 CO -0.07 -1.29 1.71 0.22 0.98 0.00 0.00 173.24 174.80 2wss h TYR 11 N 1.41 0.62 -0.11 5.02 3.20 -1.99 -0.19 116.97 124.92 2wss h TYR 11 Ca -0.50 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.40 2wss h TYR 11 Cb 1.27 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 39.36 2wss h TYR 11 CO 0.50 -0.05 -0.07 0.82 -1.64 0.00 0.00 178.16 177.71 2wss h ILE 12 N 0.27 0.00 -1.01 1.81 1.08 -1.99 0.29 117.51 117.96 2wss h ILE 12 Ca 0.68 0.00 0.24 0.00 -0.39 0.00 0.00 64.86 65.39 2wss h ILE 12 Cb 1.91 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 35.56 2wss h ILE 12 CO -0.36 0.00 0.63 -0.09 -0.69 0.00 0.00 178.15 177.64 2wss h ARG 13 N -0.00 0.51 0.00 2.37 9.65 -1.38 0.31 114.38 125.84 2wss h ARG 13 Ca 0.02 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2wss h ARG 13 Cb 0.05 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.52 2wss h ARG 13 CO -0.11 0.34 0.00 0.98 2.80 0.00 0.00 179.97 183.98 2wss n TYR 14 N -4.72 0.00 -0.42 2.20 4.19 0.67 -1.19 117.16 117.89 2wss n TYR 14 Ca 0.25 0.00 0.34 0.00 3.31 0.00 0.00 57.90 61.80 2wss n TYR 14 Cb 0.76 -0.48 0.62 0.00 0.49 0.00 0.00 39.34 40.73 2wss n TYR 14 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 2wss h SER 15 N 0.00 0.29 0.19 2.98 0.87 0.11 -2.19 113.55 115.79 2wss h SER 15 Ca 0.00 0.14 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 2wss h SER 15 Cb 0.00 0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 2wss h SER 15 CO 0.00 -0.16 -0.09 -0.61 -0.53 0.00 0.00 176.83 175.44 2wss h GLN 16 N 0.13 -0.24 -0.06 2.24 4.15 0.12 -3.09 115.11 118.36 2wss h GLN 16 Ca 0.79 0.02 0.02 0.00 0.77 0.00 0.00 58.65 60.24 2wss h GLN 16 Cb 2.38 0.05 -0.00 0.00 0.21 0.00 0.00 27.48 30.12 2wss h GLN 16 CO -0.43 -0.16 0.32 0.82 -1.93 0.00 0.00 178.83 177.45 2wss h ILE 17 N -0.30 0.06 0.41 2.39 1.08 -0.52 -0.25 117.51 120.38 2wss h ILE 17 Ca -0.03 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.43 2wss h ILE 17 Cb 0.19 0.69 -0.00 0.00 -3.07 0.00 0.00 36.82 34.63 2wss h ILE 17 CO 0.04 0.00 -0.27 0.00 -0.69 0.00 0.00 178.15 177.23 2wss h ALA 19 N -1.48 1.65 0.00 0.00 0.00 -1.03 0.19 119.26 118.60 2wss h ALA 19 Ca -0.05 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2wss h ALA 19 Cb 0.52 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2wss h ALA 19 CO 0.04 -0.63 0.03 1.17 0.00 0.00 0.00 179.25 179.87 2wss n LYS 20 N -5.23 0.00 -0.04 0.00 4.81 -0.95 -0.63 118.16 116.12 2wss n LYS 20 Ca 0.28 0.16 -0.05 0.00 -0.87 0.00 0.00 58.31 57.83 2wss n LYS 20 Cb 0.92 -1.53 -0.05 0.00 0.02 0.00 0.00 35.03 34.38 2wss n LYS 20 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2wss n ALA 21 N -1.10 1.80 -0.12 3.14 0.00 0.67 -4.08 120.51 120.82 2wss n ALA 21 Ca 0.00 -0.46 -0.06 0.00 0.00 0.00 0.00 53.44 52.92 2wss n ALA 21 Cb 0.03 0.18 0.12 0.00 0.00 0.00 0.00 19.45 19.78 2wss n ALA 21 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wss h VAL 22 N 0.00 1.25 -0.09 0.00 2.07 -0.81 -0.18 116.25 118.49 2wss h VAL 22 Ca -0.21 -1.11 -0.15 0.00 0.82 0.00 0.00 66.70 66.04 2wss h VAL 22 Cb 1.40 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 2wss h VAL 22 CO -0.01 0.39 -0.61 0.03 0.02 0.00 0.00 177.57 177.39 2wss h ARG 23 N 0.77 0.31 0.00 1.57 3.08 -1.50 -2.41 114.38 116.20 2wss h ARG 23 Ca 0.14 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 2wss h ARG 23 Cb 0.54 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.62 2wss h ARG 23 CO 0.03 0.82 -0.11 -0.44 -1.07 0.00 0.00 179.97 179.20 2wss h ASP 24 N 0.23 0.00 -1.57 7.04 5.19 -1.59 -3.28 116.42 122.44 2wss h ASP 24 Ca -0.01 0.00 -0.77 0.00 -0.62 0.00 0.00 57.03 55.64 2wss h ASP 24 Cb 1.12 0.00 -0.18 0.00 0.18 0.00 0.00 39.33 40.45 2wss h ASP 24 CO 0.10 0.11 1.87 0.00 -3.12 0.00 0.00 179.24 178.20 2wss n ALA 25 N -2.17 6.53 -2.86 3.45 0.00 -0.12 -4.92 120.51 120.42 2wss n ALA 25 Ca 0.00 -4.27 -0.16 0.00 0.00 0.00 0.00 53.44 49.01 2wss n ALA 25 Cb 0.36 -2.54 -0.04 0.00 0.00 0.00 0.00 19.45 17.23 2wss n ALA 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2wss s LEU 26 N -2.98 1.12 0.00 0.00 1.43 -1.24 -4.95 118.68 112.05 2wss s LEU 26 Ca 0.48 -1.56 0.00 0.00 -1.03 0.00 0.00 54.13 52.03 2wss s LEU 26 Cb 0.19 1.43 0.00 0.00 0.03 0.00 0.00 46.19 47.84 2wss s LEU 26 CO -0.11 -1.32 0.00 2.29 0.23 0.00 0.00 176.35 177.44 2wss n LYS 27 N -0.60 3.18 -0.00 1.70 2.85 -1.24 -5.07 118.16 118.98 2wss n LYS 27 Ca 0.02 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.30 2wss n LYS 27 Cb 0.61 0.00 -0.12 0.00 -0.65 0.00 0.00 35.03 34.87 2wss n LYS 27 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 2wss n THR 28 N 0.00 0.75 0.12 0.58 -1.04 -1.26 -4.15 114.28 109.28 2wss n THR 28 Ca 0.00 -0.65 -0.03 0.00 -2.04 0.00 0.00 64.05 61.34 2wss n THR 28 Cb 0.00 -0.37 0.10 0.00 -1.82 0.00 0.00 70.33 68.24 2wss n THR 28 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 2wss h GLU 29 N 0.00 0.00 -3.27 -2.82 4.81 -2.07 -3.41 114.58 107.82 2wss h GLU 29 Ca -0.18 0.00 -0.54 0.00 -0.13 0.00 0.00 59.36 58.51 2wss h GLU 29 Cb 1.46 0.00 -0.40 0.00 0.63 0.00 0.00 28.75 30.44 2wss h GLU 29 CO 0.02 0.71 -0.77 -0.06 -0.73 0.00 0.00 179.01 178.19 2wss s PHE 30 N -3.37 0.99 0.00 0.92 0.08 -1.26 -4.83 117.98 110.51 2wss s PHE 30 Ca -0.01 -1.14 0.00 0.00 0.12 0.00 0.00 56.93 55.90 2wss s PHE 30 Cb 0.12 -1.21 0.00 0.00 -0.57 0.00 0.00 43.02 41.36 2wss s PHE 30 CO 0.78 -0.77 0.00 1.17 -0.10 0.00 0.00 175.22 176.30 2wss n LYS 31 N 5.06 0.00 0.00 0.44 3.00 -1.26 -3.67 118.16 121.73 2wss n LYS 31 Ca -0.05 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.30 2wss n LYS 31 Cb 0.44 0.00 0.23 0.00 0.00 0.00 0.00 35.03 35.70 2wss n LYS 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2wss n ALA 32 N 0.00 1.71 0.04 3.14 0.00 -1.26 -1.55 120.51 122.59 2wss n ALA 32 Ca 0.00 -0.05 0.01 0.00 0.00 0.00 0.00 53.44 53.40 2wss n ALA 32 Cb 0.00 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.31 2wss n ALA 32 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2wss n ASN 33 N -1.11 1.61 0.03 0.00 5.03 -1.26 -4.39 115.26 115.17 2wss n ASN 33 Ca 0.05 -0.35 0.07 0.00 0.87 0.00 0.00 54.58 55.22 2wss n ASN 33 Cb 0.04 1.02 -0.10 0.00 -1.02 0.00 0.00 39.78 39.72 2wss n ASN 33 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2wss n ALA 34 N -1.20 2.43 -0.06 5.41 0.00 -0.60 -2.32 120.51 124.18 2wss n ALA 34 Ca 0.00 -0.51 -0.13 0.00 0.00 0.00 0.00 53.44 52.80 2wss n ALA 34 Cb 0.03 -0.85 -0.11 0.00 0.00 0.00 0.00 19.45 18.52 2wss n ALA 34 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2wss h MET 35 N 0.00 -0.01 -0.33 0.00 2.86 -1.78 -3.35 114.93 112.32 2wss h MET 35 Ca -0.08 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.63 2wss h MET 35 Cb 1.23 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 32.81 2wss h MET 35 CO 0.01 0.84 -0.20 0.87 1.06 0.00 0.00 176.91 179.49 2wss h LYS 36 N -0.95 -0.15 -7.39 1.72 1.57 -1.77 -3.41 116.57 106.18 2wss h LYS 36 Ca -0.00 0.01 -0.45 0.00 -1.87 0.00 0.00 60.65 58.34 2wss h LYS 36 Cb 0.85 0.03 0.15 0.00 0.08 0.00 0.00 32.23 33.35 2wss h LYS 36 CO 0.00 -0.10 0.21 0.99 -0.57 0.00 0.00 179.45 179.98 2wss s THR 37 N -6.13 2.00 0.22 -0.16 2.01 -0.98 -4.91 115.64 107.70 2wss s THR 37 Ca -0.14 0.00 0.00 0.00 0.31 0.00 0.00 61.69 61.86 2wss s THR 37 Cb 0.13 -2.56 0.00 0.00 0.01 0.00 0.00 72.50 70.09 2wss s THR 37 CO 0.69 -0.00 0.00 -1.54 -0.69 0.00 0.00 174.62 173.08 2wss n SER 38 N -4.11 -3.72 0.00 3.53 3.41 -1.26 -4.82 113.62 106.65 2wss n SER 38 Ca 0.05 0.61 0.00 0.00 -0.26 0.00 0.00 58.87 59.27 2wss n SER 38 Cb 0.58 -1.35 0.00 0.00 -0.26 0.00 0.00 64.21 63.17 2wss n SER 38 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wss n GLY 39 N -1.40 4.49 2.73 5.00 0.00 -1.26 -4.99 105.19 109.75 2wss n GLY 39 Ca 0.00 -1.25 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 2wss n GLY 39 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wss n SER 40 N 0.00 5.79 -0.30 1.61 3.41 -1.26 -4.86 113.62 118.00 2wss n SER 40 Ca 0.00 -3.74 0.00 0.00 -0.26 0.00 0.00 58.87 54.87 2wss n SER 40 Cb 0.00 -0.75 0.00 0.00 -0.26 0.00 0.00 64.21 63.20 2wss n SER 40 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2wss n THR 41 N -0.37 0.00 -3.53 6.66 -1.04 -1.26 -4.65 114.28 110.09 2wss n THR 41 Ca 0.42 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 62.22 2wss n THR 41 Cb 0.42 -0.21 -0.01 0.00 -1.82 0.00 0.00 70.33 68.71 2wss n THR 41 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2wss s ILE 42 N -1.39 4.59 0.51 12.58 -1.09 -1.26 -5.13 121.20 130.01 2wss s ILE 42 Ca 0.00 -0.83 0.04 0.00 -2.23 0.00 0.00 60.65 57.63 2wss s ILE 42 Cb 0.00 -3.63 -0.00 0.00 -1.58 0.00 0.00 42.46 37.24 2wss s ILE 42 CO 0.00 -0.30 0.17 -0.75 -1.23 0.00 0.00 174.94 172.82 2wss s LYS 43 N -4.20 2.21 -0.58 2.79 2.47 -1.26 -5.10 119.74 116.06 2wss s LYS 43 Ca 0.41 -2.19 0.06 0.00 -1.56 0.00 0.00 55.97 52.69 2wss s LYS 43 Cb -0.09 -1.79 0.21 0.00 -1.46 0.00 0.00 37.83 34.69 2wss s LYS 43 CO 0.32 -0.41 0.55 -0.89 0.16 0.00 0.00 175.35 175.08 2wss n ILE 44 N -1.43 0.94 -2.63 5.43 2.08 -1.26 -5.07 119.36 117.43 2wss n ILE 44 Ca -0.10 -4.57 -0.42 0.00 0.56 0.00 0.00 62.75 58.22 2wss n ILE 44 Cb 0.66 -2.02 -0.03 0.00 -0.75 0.00 0.00 39.64 37.50 2wss n ILE 44 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 2wss s VAL 45 N -1.45 4.09 0.00 1.39 1.01 -1.26 -4.61 120.40 119.57 2wss s VAL 45 Ca 0.33 0.82 0.00 0.00 0.00 0.00 0.00 61.98 63.12 2wss s VAL 45 Cb 0.07 -4.69 0.00 0.00 0.00 0.00 0.00 36.38 31.76 2wss s VAL 45 CO -0.12 -1.29 0.29 2.29 0.00 0.00 0.00 175.10 176.28 2wss n LYS 46 N 8.25 -0.22 0.00 2.72 2.85 -1.26 -5.36 118.16 125.13 2wss n LYS 46 Ca 0.08 -0.29 0.00 0.00 -1.05 0.00 0.00 58.31 57.04 2wss n LYS 46 Cb 0.49 -0.78 0.00 0.00 -0.65 0.00 0.00 35.03 34.09 2wss n LYS 46 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63