#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 1.12 3.52 0.00 -1.26 -5.00 120.51 118.89 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 0.30 0.00 0.00 0.18 -1.26 -3.26 117.16 113.12 2wss n TYR 3 Ca 0.00 -0.12 0.00 0.00 1.88 0.00 0.00 57.90 59.66 2wss n TYR 3 Cb 0.00 -0.08 0.00 0.00 -0.38 0.00 0.00 39.34 38.88 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 0.02 0.00 0.00 -3.48 4.27 -1.26 -5.06 117.44 111.93 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 0.27 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.22 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 -0.33 3.16 0.00 -2.67 5.12 -1.20 -4.45 116.66 116.29 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 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.32 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 0.10 5.56 -0.06 -1.26 -4.29 117.38 117.43 2wss n GLN 6 Ca 0.00 0.00 -0.05 0.00 -2.00 0.00 0.00 57.00 54.95 2wss n GLN 6 Cb 0.00 0.00 0.06 0.00 -4.06 0.00 0.00 30.24 26.24 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 0.70 0.00 1.69 0.00 -1.95 -3.47 119.26 116.24 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 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2wss h ALA 7 CO 0.00 0.89 0.00 0.41 0.00 0.00 0.00 179.25 180.55 2wss n GLY 8 N 0.63 0.70 2.93 0.00 0.00 -1.26 -5.13 105.19 103.06 2wss n GLY 8 Ca -0.02 -0.39 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 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 2.62 0.53 0.99 2.96 -1.26 -5.12 118.68 119.40 2wss s LEU 9 Ca 0.00 -1.22 -0.21 0.00 -0.22 0.00 0.00 54.13 52.48 2wss s LEU 9 Cb 0.00 -1.18 -0.05 0.00 0.50 0.00 0.00 46.19 45.46 2wss s LEU 9 CO 0.00 -0.25 1.21 -0.94 -1.32 0.00 0.00 176.35 175.06 2wss s SER 10 N 1.39 5.61 0.40 3.68 1.04 -1.26 -4.55 113.70 120.01 2wss s SER 10 Ca -0.05 2.41 0.22 0.00 0.48 0.00 0.00 55.95 59.01 2wss s SER 10 Cb -0.19 -2.61 1.23 0.00 0.10 0.00 0.00 66.02 64.56 2wss s SER 10 CO -0.07 -1.31 1.68 0.22 0.98 0.00 0.00 173.24 174.75 2wss h TYR 11 N 1.45 0.68 -0.07 5.02 3.20 -1.99 -0.16 116.97 125.10 2wss h TYR 11 Ca -0.50 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.40 2wss h TYR 11 Cb 1.28 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 39.36 2wss h TYR 11 CO 0.49 -0.11 -0.04 0.82 -1.64 0.00 0.00 178.16 177.68 2wss h ILE 12 N 0.25 0.00 -1.01 1.81 1.08 -1.99 0.31 117.51 117.96 2wss h ILE 12 Ca 0.72 0.00 0.23 0.00 -0.39 0.00 0.00 64.86 65.43 2wss h ILE 12 Cb 1.99 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 35.64 2wss h ILE 12 CO -0.43 0.00 0.63 -0.09 -0.69 0.00 0.00 178.15 177.57 2wss h ARG 13 N -0.00 0.51 0.00 2.37 9.65 -1.37 0.27 114.38 125.80 2wss h ARG 13 Ca 0.01 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 2wss h ARG 13 Cb 0.03 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.49 2wss h ARG 13 CO -0.06 0.34 0.00 0.98 2.80 0.00 0.00 179.97 184.03 2wss n TYR 14 N -4.70 0.00 -0.43 2.20 4.19 0.63 -1.28 117.16 117.77 2wss n TYR 14 Ca 0.24 0.00 0.35 0.00 3.31 0.00 0.00 57.90 61.81 2wss n TYR 14 Cb 0.75 -0.45 0.63 0.00 0.49 0.00 0.00 39.34 40.77 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 0.27 0.25 2.98 0.87 0.12 -2.22 113.55 115.82 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 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 2wss h SER 15 CO 0.00 -0.18 -0.12 -0.61 -0.53 0.00 0.00 176.83 175.39 2wss h GLN 16 N 0.11 -0.33 -0.07 2.24 4.15 -0.07 -3.13 115.11 118.01 2wss h GLN 16 Ca 0.81 0.02 0.02 0.00 0.77 0.00 0.00 58.65 60.27 2wss h GLN 16 Cb 2.46 0.07 -0.00 0.00 0.21 0.00 0.00 27.48 30.22 2wss h GLN 16 CO -0.44 -0.22 0.29 0.82 -1.93 0.00 0.00 178.83 177.35 2wss h ILE 17 N -0.41 0.10 0.27 2.39 1.08 -0.58 -0.84 117.51 119.52 2wss h ILE 17 Ca -0.03 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.43 2wss h ILE 17 Cb 0.26 0.73 -0.01 0.00 -3.07 0.00 0.00 36.82 34.73 2wss h ILE 17 CO 0.06 0.00 -0.22 0.00 -0.69 0.00 0.00 178.15 177.30 2wss h ALA 19 N -1.47 1.66 0.00 0.00 0.00 -1.14 0.14 119.26 118.44 2wss h ALA 19 Ca -0.04 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2wss h ALA 19 Cb 0.39 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2wss h ALA 19 CO 0.00 -0.67 0.02 1.17 0.00 0.00 0.00 179.25 179.78 2wss n LYS 20 N -5.27 0.00 -0.04 0.00 4.81 -0.96 -0.78 118.16 115.92 2wss n LYS 20 Ca 0.29 0.14 -0.05 0.00 -0.87 0.00 0.00 58.31 57.82 2wss n LYS 20 Cb 0.95 -1.52 -0.05 0.00 0.02 0.00 0.00 35.03 34.43 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 -1.09 1.81 -0.14 3.14 0.00 0.47 -4.11 120.51 120.59 2wss n ALA 21 Ca 0.00 -0.43 -0.06 0.00 0.00 0.00 0.00 53.44 52.94 2wss n ALA 21 Cb 0.02 0.20 0.11 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 1.26 -0.12 0.00 2.07 -0.91 -0.44 116.25 118.10 2wss h VAL 22 Ca -0.20 -1.11 -0.15 0.00 0.82 0.00 0.00 66.70 66.06 2wss h VAL 22 Cb 1.38 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 2wss h VAL 22 CO -0.01 0.39 -0.56 0.03 0.02 0.00 0.00 177.57 177.44 2wss h ARG 23 N 0.81 0.38 0.00 1.57 3.08 -1.52 -2.55 114.38 116.15 2wss h ARG 23 Ca 0.15 -0.24 -0.03 0.00 0.07 0.00 0.00 59.98 59.93 2wss h ARG 23 Cb 0.53 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.61 2wss h ARG 23 CO 0.03 0.84 -0.12 -0.44 -1.07 0.00 0.00 179.97 179.20 2wss h ASP 24 N 0.29 0.00 -1.56 7.04 5.19 -1.62 -3.28 116.42 122.47 2wss h ASP 24 Ca 0.00 0.00 -0.77 0.00 -0.62 0.00 0.00 57.03 55.65 2wss h ASP 24 Cb 1.07 0.00 -0.18 0.00 0.18 0.00 0.00 39.33 40.41 2wss h ASP 24 CO 0.10 0.12 1.91 0.00 -3.12 0.00 0.00 179.24 178.25 2wss n ALA 25 N -2.18 6.48 -2.94 3.45 0.00 -0.21 -4.92 120.51 120.19 2wss n ALA 25 Ca -0.00 -4.28 -0.15 0.00 0.00 0.00 0.00 53.44 49.01 2wss n ALA 25 Cb 0.35 -2.58 -0.03 0.00 0.00 0.00 0.00 19.45 17.19 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 -2.81 1.01 0.00 0.00 1.43 -1.24 -4.95 118.68 112.12 2wss s LEU 26 Ca 0.48 -1.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.07 2wss s LEU 26 Cb 0.18 1.55 0.00 0.00 0.03 0.00 0.00 46.19 47.95 2wss s LEU 26 CO -0.10 -1.35 0.00 2.29 0.23 0.00 0.00 176.35 177.43 2wss n LYS 27 N -0.59 3.22 -0.01 1.70 2.85 -1.24 -5.07 118.16 119.02 2wss n LYS 27 Ca 0.01 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.29 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 0.77 0.11 0.58 -1.04 -1.26 -4.16 114.28 109.29 2wss n THR 28 Ca 0.00 -0.65 -0.03 0.00 -2.04 0.00 0.00 64.05 61.32 2wss n THR 28 Cb 0.00 -0.38 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 0.06 -3.30 -2.82 4.81 -2.07 -3.40 114.58 107.85 2wss h GLU 29 Ca -0.18 -0.05 -0.55 0.00 -0.13 0.00 0.00 59.36 58.45 2wss h GLU 29 Cb 1.48 0.01 -0.40 0.00 0.63 0.00 0.00 28.75 30.47 2wss h GLU 29 CO 0.02 0.73 -0.76 -0.06 -0.73 0.00 0.00 179.01 178.21 2wss s PHE 30 N -3.47 1.06 0.00 0.92 0.08 -1.26 -4.82 117.98 110.49 2wss s PHE 30 Ca -0.02 -1.20 0.00 0.00 0.12 0.00 0.00 56.93 55.83 2wss s PHE 30 Cb 0.12 -1.26 0.00 0.00 -0.57 0.00 0.00 43.02 41.31 2wss s PHE 30 CO 0.78 -0.78 0.00 1.17 -0.10 0.00 0.00 175.22 176.29 2wss n LYS 31 N 5.03 0.00 0.00 0.44 3.00 -1.26 -3.71 118.16 121.67 2wss n LYS 31 Ca -0.05 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.29 2wss n LYS 31 Cb 0.44 0.00 0.20 0.00 0.00 0.00 0.00 35.03 35.66 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 1.67 0.04 3.14 0.00 -1.26 -1.61 120.51 122.49 2wss n ALA 32 Ca 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 53.44 53.41 2wss n ALA 32 Cb 0.00 -1.11 -0.01 0.00 0.00 0.00 0.00 19.45 18.33 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 1.35 0.02 0.00 5.03 -1.26 -4.39 115.26 114.90 2wss n ASN 33 Ca 0.05 -0.38 0.07 0.00 0.87 0.00 0.00 54.58 55.19 2wss n ASN 33 Cb 0.04 1.02 -0.11 0.00 -1.02 0.00 0.00 39.78 39.70 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 -1.17 2.46 -0.06 5.41 0.00 -0.63 -2.29 120.51 124.23 2wss n ALA 34 Ca 0.00 -0.54 -0.12 0.00 0.00 0.00 0.00 53.44 52.78 2wss n ALA 34 Cb 0.02 -0.81 -0.11 0.00 0.00 0.00 0.00 19.45 18.55 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 -0.32 0.00 2.86 -1.78 -3.35 114.93 112.32 2wss h MET 35 Ca -0.09 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.63 2wss h MET 35 Cb 1.22 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 32.81 2wss h MET 35 CO 0.01 0.80 -0.21 0.87 1.06 0.00 0.00 176.91 179.44 2wss h LYS 36 N -0.95 -0.17 -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 0.82 0.04 0.15 0.00 0.08 0.00 0.00 32.23 33.32 2wss h LYS 36 CO 0.00 -0.11 0.21 0.99 -0.57 0.00 0.00 179.45 179.97 2wss s THR 37 N -6.12 2.00 0.23 -0.16 2.01 -0.97 -4.90 115.64 107.73 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 -2.55 0.00 0.00 0.01 0.00 0.00 72.50 70.10 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 -4.13 -3.93 0.00 3.53 3.41 -1.26 -4.82 113.62 106.42 2wss n SER 38 Ca 0.05 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.28 2wss n SER 38 Cb 0.58 -1.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.05 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 -1.34 4.40 2.72 5.00 0.00 -1.26 -4.99 105.19 109.72 2wss n GLY 39 Ca 0.00 -1.21 -0.33 0.00 0.00 0.00 0.00 46.02 44.48 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 5.95 -0.31 1.61 3.41 -1.26 -4.86 113.62 118.15 2wss n SER 40 Ca 0.00 -3.75 0.00 0.00 -0.26 0.00 0.00 58.87 54.86 2wss n SER 40 Cb 0.00 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.18 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 -0.39 0.00 -3.60 6.66 -1.04 -1.26 -4.65 114.28 109.99 2wss n THR 41 Ca 0.43 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 62.23 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 -1.38 4.72 0.51 12.58 -1.09 -1.26 -5.13 121.20 130.15 2wss s ILE 42 Ca 0.00 -0.85 0.04 0.00 -2.23 0.00 0.00 60.65 57.61 2wss s ILE 42 Cb 0.00 -3.68 0.00 0.00 -1.58 0.00 0.00 42.46 37.20 2wss s ILE 42 CO 0.00 -0.31 0.17 -0.75 -1.23 0.00 0.00 174.94 172.82 2wss s LYS 43 N -4.16 2.21 -0.58 2.79 2.47 -1.26 -5.10 119.74 116.11 2wss s LYS 43 Ca 0.40 -2.19 0.05 0.00 -1.56 0.00 0.00 55.97 52.67 2wss s LYS 43 Cb -0.09 -1.80 0.20 0.00 -1.46 0.00 0.00 37.83 34.68 2wss s LYS 43 CO 0.32 -0.43 0.52 -0.89 0.16 0.00 0.00 175.35 175.04 2wss n ILE 44 N -1.45 0.82 -2.87 5.43 2.08 -1.26 -5.10 119.36 117.01 2wss n ILE 44 Ca -0.10 -4.50 -0.41 0.00 0.56 0.00 0.00 62.75 58.30 2wss n ILE 44 Cb 0.66 -2.01 -0.04 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 -1.31 4.87 -0.03 1.39 1.01 -1.26 -4.88 120.40 120.19 2wss s VAL 45 Ca 0.32 1.67 0.05 0.00 0.00 0.00 0.00 61.98 64.01 2wss s VAL 45 Cb 0.05 -4.15 0.08 0.00 0.00 0.00 0.00 36.38 32.36 2wss s VAL 45 CO -0.13 0.02 0.96 2.29 0.00 0.00 0.00 175.10 178.25 2wss n LYS 46 N 5.21 0.57 0.00 2.72 0.00 -1.26 -5.36 118.16 120.04 2wss n LYS 46 Ca 0.05 -1.38 0.00 0.00 -0.00 0.00 0.00 58.31 56.98 2wss n LYS 46 Cb 0.49 -0.80 0.00 0.00 -0.00 0.00 0.00 35.03 34.72 2wss n LYS 46 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68