#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cpg s LYS 2 N 0.00 0.38 -0.01 2.12 2.20 -1.26 -5.17 119.74 118.01 2cpg s LYS 2 Ca 0.00 0.90 -0.17 0.00 -0.36 0.00 0.00 55.97 56.34 2cpg s LYS 2 Cb 0.00 0.54 -0.06 0.00 -1.51 0.00 0.00 37.83 36.80 2cpg s LYS 2 CO 0.00 -0.20 0.48 0.15 -0.36 0.00 0.00 175.35 175.42 2cpg s LYS 3 N 2.67 4.12 0.58 4.03 -0.14 -1.26 -5.11 119.74 124.63 2cpg s LYS 3 Ca -0.01 0.53 -0.06 0.00 -1.36 0.00 0.00 55.97 55.07 2cpg s LYS 3 Cb -0.09 -3.28 -0.00 0.00 -1.68 0.00 0.00 37.83 32.77 2cpg s LYS 3 CO -0.18 0.53 0.90 1.03 -0.76 0.00 0.00 175.35 176.87 2cpg s ARG 4 N -0.64 3.09 -0.28 1.68 0.52 -1.26 -5.09 118.95 116.97 2cpg s ARG 4 Ca 0.26 0.11 -0.17 0.00 -0.52 0.00 0.00 55.73 55.42 2cpg s ARG 4 Cb -0.17 -2.27 0.09 0.00 0.52 0.00 0.00 34.95 33.12 2cpg s ARG 4 CO 0.14 -0.60 0.74 -1.17 0.02 0.00 0.00 175.30 174.43 2cpg s LEU 5 N -4.97 -0.86 -0.19 2.53 2.96 -1.26 -5.17 118.68 111.73 2cpg s LEU 5 Ca 0.53 1.39 -0.08 0.00 -0.22 0.00 0.00 54.13 55.74 2cpg s LEU 5 Cb -0.11 2.28 -0.04 0.00 0.50 0.00 0.00 46.19 48.82 2cpg s LEU 5 CO 0.46 -0.22 0.09 -0.89 -1.32 0.00 0.00 176.35 174.47 2cpg s THR 6 N 1.47 5.01 0.33 3.68 2.01 -1.26 -5.09 115.64 121.80 2cpg s THR 6 Ca -0.09 0.05 0.07 0.00 0.31 0.00 0.00 61.69 62.02 2cpg s THR 6 Cb -0.05 -3.28 -0.07 0.00 0.01 0.00 0.00 72.50 69.12 2cpg s THR 6 CO -0.17 0.44 -0.02 0.27 -0.69 0.00 0.00 174.62 174.44 2cpg s ILE 7 N 0.45 1.73 -0.08 1.82 -4.36 -1.26 -5.16 121.20 114.34 2cpg s ILE 7 Ca 0.05 -2.08 0.05 0.00 -0.26 0.00 0.00 60.65 58.40 2cpg s ILE 7 Cb -0.12 -2.69 -0.00 0.00 1.25 0.00 0.00 42.46 40.90 2cpg s ILE 7 CO -0.00 -0.15 -0.24 0.42 0.24 0.00 0.00 174.94 175.21 2cpg s THR 8 N -2.93 2.02 0.09 8.37 -4.23 -1.26 -5.15 115.64 112.55 2cpg s THR 8 Ca 0.33 -1.02 0.04 0.00 -1.18 0.00 0.00 61.69 59.87 2cpg s THR 8 Cb 0.06 -1.73 -0.03 0.00 1.34 0.00 0.00 72.50 72.14 2cpg s THR 8 CO 0.15 0.55 -0.12 -0.76 -0.54 0.00 0.00 174.62 173.91 2cpg s LEU 9 N 0.15 2.36 0.19 4.79 2.01 -1.26 -5.13 118.68 121.80 2cpg s LEU 9 Ca -0.13 -0.75 -0.33 0.00 0.01 0.00 0.00 54.13 52.94 2cpg s LEU 9 Cb -0.16 -0.41 -0.14 0.00 0.01 0.00 0.00 46.19 45.49 2cpg s LEU 9 CO 0.07 -0.19 1.44 -1.20 1.01 0.00 0.00 176.35 177.48 2cpg n SER 10 N 0.78 2.67 -0.05 2.29 7.64 -1.26 -4.80 113.62 120.88 2cpg n SER 10 Ca -0.18 1.12 0.14 0.00 1.01 0.00 0.00 58.87 60.96 2cpg n SER 10 Cb 0.56 -1.39 0.55 0.00 -1.01 0.00 0.00 64.21 62.92 2cpg n SER 10 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2cpg h GLU 11 N 4.77 0.29 -0.81 1.43 4.57 -2.00 1.54 114.58 124.37 2cpg h GLU 11 Ca -0.45 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 57.68 2cpg h GLU 11 Cb 1.28 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.77 2cpg h GLU 11 CO 0.80 0.19 0.37 1.03 -1.18 0.00 0.00 179.01 180.22 2cpg h SER 12 N 0.30 1.07 0.26 1.04 0.87 -2.00 -0.81 113.55 114.28 2cpg h SER 12 Ca 0.26 -0.14 -0.18 0.00 -1.23 0.00 0.00 61.79 60.50 2cpg h SER 12 Cb 0.65 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 2cpg h SER 12 CO -0.06 0.92 -0.72 0.58 -0.53 0.00 0.00 176.83 177.02 2cpg h VAL 13 N 1.15 1.38 -0.29 2.23 2.07 0.17 -2.77 116.25 120.19 2cpg h VAL 13 Ca 0.28 -2.13 -0.01 0.00 0.82 0.00 0.00 66.70 65.65 2cpg h VAL 13 Cb 0.14 2.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.00 2cpg h VAL 13 CO -0.03 0.64 0.13 0.25 0.02 0.00 0.00 177.57 178.57 2cpg h LEU 14 N 0.27 0.39 -0.90 2.57 5.85 -0.59 -0.82 115.31 122.08 2cpg h LEU 14 Ca -0.03 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.58 2cpg h LEU 14 Cb 1.29 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 42.16 2cpg h LEU 14 CO 0.12 0.43 0.58 -0.33 -0.34 0.00 0.00 178.44 178.91 2cpg h GLU 15 N 0.33 1.09 -0.32 1.25 5.08 -1.06 -1.39 114.58 119.57 2cpg h GLU 15 Ca 0.10 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.28 2cpg h GLU 15 Cb 0.15 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2cpg h GLU 15 CO -0.01 0.72 -0.26 -0.97 -1.00 0.00 0.00 179.01 177.49 2cpg h ASN 16 N 1.13 0.66 -0.27 1.42 -1.24 -1.19 -1.87 115.58 114.21 2cpg h ASN 16 Ca 0.36 -0.24 -0.02 0.00 0.71 0.00 0.00 56.30 57.11 2cpg h ASN 16 Cb 0.02 -0.18 -0.01 0.00 0.73 0.00 0.00 38.32 38.88 2cpg h ASN 16 CO -0.12 0.90 0.10 0.25 -1.29 0.00 0.00 177.43 177.26 2cpg h LEU 17 N 0.56 0.39 -0.48 0.34 5.85 -0.54 -0.10 115.31 121.33 2cpg h LEU 17 Ca 0.08 -0.19 0.07 0.00 0.84 0.00 0.00 57.88 58.68 2cpg h LEU 17 Cb 0.74 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.61 2cpg h LEU 17 CO 0.06 0.47 0.12 -0.08 -0.34 0.00 0.00 178.44 178.67 2cpg h GLU 18 N 0.28 0.26 -0.32 1.25 4.57 -1.10 0.26 114.58 119.78 2cpg h GLU 18 Ca 0.09 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.25 2cpg h GLU 18 Cb 0.21 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.73 2cpg h GLU 18 CO -0.00 0.17 0.20 -0.22 -1.18 0.00 0.00 179.01 177.98 2cpg h LYS 19 N 0.27 0.43 -0.29 1.92 3.64 -0.99 -1.19 116.57 120.36 2cpg h LYS 19 Ca 0.24 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.55 2cpg h LYS 19 Cb 0.29 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2cpg h LYS 19 CO -0.28 0.32 0.08 0.52 -2.27 0.00 0.00 179.45 177.82 2cpg h MET 20 N 0.42 0.46 -0.28 1.90 2.86 -0.70 -1.15 114.93 118.44 2cpg h MET 20 Ca 0.12 -0.10 0.03 0.00 -2.06 0.00 0.00 59.70 57.69 2cpg h MET 20 Cb -0.01 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.56 2cpg h MET 20 CO -0.02 0.53 0.08 0.00 1.06 0.00 0.00 176.91 178.55 2cpg h ALA 21 N 0.92 0.31 -0.61 6.32 0.00 -0.38 -1.72 119.26 124.10 2cpg h ALA 21 Ca 0.09 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2cpg h ALA 21 Cb 0.26 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2cpg h ALA 21 CO -0.00 -0.33 0.34 0.00 0.00 0.00 0.00 179.25 179.26 2cpg h ARG 22 N 0.20 0.86 -0.08 0.00 3.08 -1.07 -0.97 114.38 116.40 2cpg h ARG 22 Ca 0.13 -0.10 0.02 0.00 0.07 0.00 0.00 59.98 60.10 2cpg h ARG 22 Cb 0.12 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 2cpg h ARG 22 CO -0.15 0.65 0.07 0.93 -1.07 0.00 0.00 179.97 180.40 2cpg h GLU 23 N 0.83 0.00 -0.00 0.04 5.08 -0.88 -1.95 114.58 117.70 2cpg h GLU 23 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2cpg h GLU 23 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2cpg h GLU 23 CO -0.03 0.00 -0.67 -1.33 -1.00 0.00 0.00 179.01 175.98 2cpg n MET 24 N -4.22 0.22 -1.94 2.33 2.81 -0.68 -4.97 117.12 110.68 2cpg n MET 24 Ca -0.01 -0.16 -0.04 0.00 -1.81 0.00 0.00 57.70 55.67 2cpg n MET 24 Cb 0.17 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.18 2cpg n MET 24 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2cpg n GLY 25 N 1.47 0.27 3.33 3.03 0.00 -0.42 -5.02 105.19 107.86 2cpg n GLY 25 Ca 0.06 -0.74 -0.15 0.00 0.00 0.00 0.00 46.02 45.19 2cpg n GLY 25 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2cpg s LEU 26 N -1.19 1.28 0.74 0.99 0.05 -0.95 -5.05 118.68 114.56 2cpg s LEU 26 Ca 0.00 -1.52 -0.11 0.00 0.05 0.00 0.00 54.13 52.55 2cpg s LEU 26 Cb 0.00 0.81 0.03 0.00 -2.05 0.00 0.00 46.19 44.98 2cpg s LEU 26 CO 0.00 -1.05 1.07 -0.94 -0.55 0.00 0.00 176.35 174.88 2cpg s SER 27 N -3.25 4.97 0.33 1.48 1.04 -1.26 -4.30 113.70 112.70 2cpg s SER 27 Ca 0.36 1.54 0.02 0.00 0.48 0.00 0.00 55.95 58.35 2cpg s SER 27 Cb 0.03 -2.35 0.56 0.00 0.10 0.00 0.00 66.02 64.35 2cpg s SER 27 CO 0.20 -1.70 1.91 0.11 0.98 0.00 0.00 173.24 174.74 2cpg h LYS 28 N -0.90 0.73 -0.31 4.02 1.57 -1.93 -0.00 116.57 119.75 2cpg h LYS 28 Ca -0.45 -0.11 0.03 0.00 -1.87 0.00 0.00 60.65 58.25 2cpg h LYS 28 Cb 1.23 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 33.38 2cpg h LYS 28 CO 0.57 0.61 0.12 0.77 -0.57 0.00 0.00 179.45 180.95 2cpg h SER 29 N 0.72 0.15 -0.69 0.86 0.02 -1.99 -0.63 113.55 111.99 2cpg h SER 29 Ca 0.17 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 61.09 2cpg h SER 29 Cb 0.16 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.68 2cpg h SER 29 CO -0.02 0.12 0.22 0.00 -1.14 0.00 0.00 176.83 176.02 2cpg h ALA 30 N 1.19 1.05 -0.55 3.77 0.00 -1.82 0.22 119.26 123.13 2cpg h ALA 30 Ca 0.14 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2cpg h ALA 30 Cb 0.09 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 2cpg h ALA 30 CO -0.13 0.64 0.26 1.98 0.00 0.00 0.00 179.25 182.01 2cpg h MET 31 N 1.05 0.79 -0.58 0.00 -1.53 -0.63 0.44 114.93 114.47 2cpg h MET 31 Ca 0.23 -0.12 0.01 0.00 -3.44 0.00 0.00 59.70 56.38 2cpg h MET 31 Cb 0.30 -0.14 -0.03 0.00 -0.55 0.00 0.00 31.60 31.17 2cpg h MET 31 CO -0.01 0.65 0.38 0.82 0.14 0.00 0.00 176.91 178.90 2cpg h ILE 32 N 0.74 1.15 -0.36 1.77 2.04 -0.80 -1.27 117.51 120.78 2cpg h ILE 32 Ca 0.19 -0.28 0.05 0.00 1.00 0.00 0.00 64.86 65.82 2cpg h ILE 32 Cb 0.12 0.30 -0.05 0.00 -0.74 0.00 0.00 36.82 36.45 2cpg h ILE 32 CO -0.02 0.15 0.08 -1.28 0.00 0.00 0.00 178.15 177.08 2cpg h SER 33 N 0.79 0.04 -0.58 1.72 0.87 -0.53 0.49 113.55 116.35 2cpg h SER 33 Ca 0.21 0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.84 2cpg h SER 33 Cb -0.09 0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 61.91 2cpg h SER 33 CO -0.05 0.06 0.37 0.58 -0.53 0.00 0.00 176.83 177.26 2cpg h VAL 34 N 0.21 1.12 -0.41 2.23 2.07 -0.76 -1.31 116.25 119.39 2cpg h VAL 34 Ca 0.17 -0.26 -0.11 0.00 0.82 0.00 0.00 66.70 67.32 2cpg h VAL 34 Cb 0.19 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 2cpg h VAL 34 CO -0.21 0.14 -0.19 0.00 0.02 0.00 0.00 177.57 177.32 2cpg h ALA 35 N 1.23 0.90 -0.57 1.67 0.00 -0.76 -0.79 119.26 120.94 2cpg h ALA 35 Ca 0.22 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 2cpg h ALA 35 Cb -0.05 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2cpg h ALA 35 CO -0.07 0.63 0.06 -0.07 0.00 0.00 0.00 179.25 179.80 2cpg h LEU 36 N 0.70 0.93 -0.80 0.00 3.38 -0.70 -1.61 115.31 117.22 2cpg h LEU 36 Ca 0.10 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 2cpg h LEU 36 Cb 0.70 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 2cpg h LEU 36 CO 0.05 0.98 0.42 -0.08 0.09 0.00 0.00 178.44 179.90 2cpg h GLU 37 N 0.85 1.13 -0.61 1.13 4.57 -0.94 -1.68 114.58 119.04 2cpg h GLU 37 Ca 0.17 -0.14 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 2cpg h GLU 37 Cb 0.47 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 28.81 2cpg h GLU 37 CO 0.02 0.84 0.35 -0.97 -1.18 0.00 0.00 179.01 178.07 2cpg h ASN 38 N 1.12 0.73 0.13 1.04 -1.24 -0.94 -2.81 115.58 113.60 2cpg h ASN 38 Ca 0.28 -0.04 -0.23 0.00 0.71 0.00 0.00 56.30 57.02 2cpg h ASN 38 Cb 0.06 -0.18 0.01 0.00 0.73 0.00 0.00 38.32 38.93 2cpg h ASN 38 CO -0.04 0.57 -0.89 0.22 -1.29 0.00 0.00 177.43 176.00 2cpg h TYR 39 N 0.83 0.81 -0.78 0.67 3.20 -0.84 -2.77 116.97 118.09 2cpg h TYR 39 Ca 0.22 -0.40 0.09 0.00 3.14 0.00 0.00 58.73 61.77 2cpg h TYR 39 Cb -0.01 -0.11 -0.07 0.00 1.54 0.00 0.00 36.73 38.08 2cpg h TYR 39 CO 0.00 1.22 0.44 -0.22 -1.64 0.00 0.00 178.16 177.96 2cpg h LYS 40 N 0.35 0.73 0.00 1.82 3.64 -1.19 -3.34 116.57 118.57 2cpg h LYS 40 Ca -0.08 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 2cpg h LYS 40 Cb 1.51 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 33.17 2cpg h LYS 40 CO 0.16 0.48 0.00 1.63 -2.27 0.00 0.00 179.45 179.46 2cpg n LYS 41 N -4.76 0.00 0.00 1.90 5.02 -1.06 -5.13 118.16 114.13 2cpg n LYS 41 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 2cpg n LYS 41 Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.26 2cpg n LYS 41 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29