#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pfi n VAL 2 N 0.00 0.38 0.00 1.61 0.31 -1.26 -4.33 118.33 115.04 1pfi n VAL 2 Ca 0.00 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1pfi n VAL 2 Cb 0.00 -0.74 0.00 0.00 -0.91 0.00 0.00 33.84 32.19 1pfi n VAL 2 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1pfi n ILE 3 N -2.69 0.00 0.30 2.52 2.08 -1.26 -1.94 119.36 118.37 1pfi n ILE 3 Ca -0.12 0.34 0.19 0.00 0.56 0.00 0.00 62.75 63.72 1pfi n ILE 3 Cb 0.63 -1.08 0.93 0.00 -0.75 0.00 0.00 39.64 39.37 1pfi n ILE 3 CO 0.00 0.00 0.00 -0.78 0.56 0.00 0.00 176.55 176.33 1pfi h ASP 4 N 0.00 0.00 -0.70 4.38 -0.00 -2.00 -2.32 116.42 115.78 1pfi h ASP 4 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.03 56.95 1pfi h ASP 4 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 39.33 39.30 1pfi h ASP 4 CO 0.00 0.02 0.14 0.74 -0.00 0.00 0.00 179.24 180.14 1pfi h THR 5 N 0.00 1.26 -0.67 2.25 2.02 -1.77 0.11 112.91 116.12 1pfi h THR 5 Ca -0.00 -1.01 -0.08 0.00 0.77 0.00 0.00 66.41 66.09 1pfi h THR 5 Cb 0.26 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 1pfi h THR 5 CO 0.00 0.39 0.11 0.77 0.37 0.00 0.00 175.52 177.15 1pfi h SER 6 N 1.07 1.06 -0.67 4.18 4.64 -0.81 -0.54 113.55 122.48 1pfi h SER 6 Ca 0.22 -0.25 -0.08 0.00 -0.47 0.00 0.00 61.79 61.20 1pfi h SER 6 Cb 0.41 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 62.19 1pfi h SER 6 CO 0.01 1.05 0.11 0.00 -0.87 0.00 0.00 176.83 177.13 1pfi h ALA 7 N 1.07 0.92 -0.69 5.18 0.00 -1.46 -0.35 119.26 123.93 1pfi h ALA 7 Ca 0.20 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1pfi h ALA 7 Cb 0.44 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1pfi h ALA 7 CO 0.01 0.67 0.13 -0.24 0.00 0.00 0.00 179.25 179.82 1pfi h VAL 8 N 1.04 1.26 -0.68 0.00 3.04 -0.78 -0.33 116.25 119.80 1pfi h VAL 8 Ca 0.21 -1.03 -0.08 0.00 -1.01 0.00 0.00 66.70 64.79 1pfi h VAL 8 Cb 0.44 0.60 -0.03 0.00 -2.01 0.00 0.00 31.29 30.29 1pfi h VAL 8 CO 0.01 0.39 0.13 -0.08 -1.01 0.00 0.00 177.57 177.01 1pfi h GLU 9 N 1.06 1.12 -0.69 4.17 4.81 -0.90 -0.25 114.58 123.90 1pfi h GLU 9 Ca 0.21 -0.29 -0.08 0.00 -0.13 0.00 0.00 59.36 59.07 1pfi h GLU 9 Cb 0.43 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 1pfi h GLU 9 CO 0.01 1.01 0.13 0.66 -0.73 0.00 0.00 179.01 180.09 1pfi h SER 10 N 1.04 1.08 -0.69 1.04 4.64 -0.87 -1.08 113.55 118.71 1pfi h SER 10 Ca 0.21 -0.25 -0.08 0.00 -0.47 0.00 0.00 61.79 61.20 1pfi h SER 10 Cb 0.42 -0.29 -0.03 0.00 -0.31 0.00 0.00 62.40 62.20 1pfi h SER 10 CO 0.01 1.05 0.13 0.00 -0.87 0.00 0.00 176.83 177.15 1pfi h ALA 11 N 1.07 0.92 -0.68 5.18 0.00 -0.86 -1.55 119.26 123.34 1pfi h ALA 11 Ca 0.21 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1pfi h ALA 11 Cb 0.42 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1pfi h ALA 11 CO 0.01 0.67 0.12 -0.84 0.00 0.00 0.00 179.25 179.21 1pfi h ILE 12 N 1.06 1.26 -0.69 0.00 3.07 -0.84 0.19 117.51 121.57 1pfi h ILE 12 Ca 0.21 -1.03 -0.07 0.00 1.55 0.00 0.00 64.86 65.52 1pfi h ILE 12 Cb 0.42 0.61 -0.03 0.00 -0.27 0.00 0.00 36.82 37.56 1pfi h ILE 12 CO 0.01 0.39 0.15 0.74 -1.05 0.00 0.00 178.15 178.39 1pfi h THR 13 N 1.05 1.26 -0.69 0.16 2.02 -1.04 1.26 112.91 116.92 1pfi h THR 13 Ca 0.21 -1.00 -0.08 0.00 0.77 0.00 0.00 66.41 66.32 1pfi h THR 13 Cb 0.43 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 1pfi h THR 13 CO 0.01 0.38 0.13 0.44 0.37 0.00 0.00 175.52 176.85 1pfi h ASP 14 N 1.06 1.08 -0.05 4.18 3.45 -1.12 0.16 116.42 125.17 1pfi h ASP 14 Ca 0.22 -0.25 -0.25 0.00 0.43 0.00 0.00 57.03 57.17 1pfi h ASP 14 Cb 0.40 -0.29 0.02 0.00 -0.56 0.00 0.00 39.33 38.90 1pfi h ASP 14 CO 0.01 1.05 -0.95 1.23 -1.57 0.00 0.00 179.24 179.01 1pfi h GLY 15 N 1.06 0.82 1.50 2.75 0.00 -0.75 -3.03 103.07 105.42 1pfi h GLY 15 Ca 0.21 -1.33 0.00 0.00 0.00 0.00 0.00 47.33 46.21 1pfi h GLY 15 CO 0.01 1.18 0.00 -0.18 0.00 0.00 0.00 176.54 177.55 1pfi n GLN 16 N -3.88 0.37 0.28 4.80 7.27 0.43 -2.76 117.38 123.89 1pfi n GLN 16 Ca -0.10 0.06 0.17 0.00 0.07 0.00 0.00 57.00 57.21 1pfi n GLN 16 Cb 0.84 -1.50 0.70 0.00 2.41 0.00 0.00 30.24 32.69 1pfi n GLN 16 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 1pfi h GLY 17 N 3.76 0.00 1.08 1.69 0.00 -0.55 -2.89 103.07 106.16 1pfi h GLY 17 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 1pfi h GLY 17 CO 0.00 0.00 0.12 1.29 0.00 0.00 0.00 176.54 177.95 1pfi h ASP 18 N 0.00 1.07 -0.68 0.19 2.03 -1.69 -1.57 116.42 115.78 1pfi h ASP 18 Ca -0.00 -0.25 -0.08 0.00 -0.73 0.00 0.00 57.03 55.97 1pfi h ASP 18 Cb 0.50 -0.28 -0.03 0.00 -0.83 0.00 0.00 39.33 38.69 1pfi h ASP 18 CO 0.00 1.06 0.12 0.00 -1.03 0.00 0.00 179.24 179.38 1pfi h MET 19 N 1.05 1.13 -0.70 4.15 -0.00 -1.74 0.60 114.93 119.42 1pfi h MET 19 Ca 0.21 -0.30 -0.08 0.00 -0.00 0.00 0.00 59.70 59.53 1pfi h MET 19 Cb 0.44 -0.13 -0.03 0.00 -0.00 0.00 0.00 31.60 31.87 1pfi h MET 19 CO 0.01 1.03 0.14 0.87 -0.00 0.00 0.00 176.91 178.96 1pfi h LYS 20 N 1.06 1.13 -0.69 -0.10 1.57 -1.55 -0.04 116.57 117.95 1pfi h LYS 20 Ca 0.21 -0.29 -0.08 0.00 -1.87 0.00 0.00 60.65 58.62 1pfi h LYS 20 Cb 0.44 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 1pfi h LYS 20 CO 0.01 1.02 0.13 0.00 -0.57 0.00 0.00 179.45 180.04 1pfi h ALA 21 N 1.07 0.92 -0.69 3.86 0.00 -1.11 -2.82 119.26 120.49 1pfi h ALA 21 Ca 0.21 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1pfi h ALA 21 Cb 0.41 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1pfi h ALA 21 CO 0.01 0.67 0.13 -0.84 0.00 0.00 0.00 179.25 179.22 1pfi h ILE 22 N 1.06 1.26 0.00 0.00 -2.65 -0.67 -2.02 117.51 114.50 1pfi h ILE 22 Ca 0.21 -1.03 0.00 0.00 1.03 0.00 0.00 64.86 65.08 1pfi h ILE 22 Cb 0.43 0.59 0.00 0.00 -2.05 0.00 0.00 36.82 35.79 1pfi h ILE 22 CO 0.01 0.39 0.00 1.23 0.03 0.00 0.00 178.15 179.81 1pfi h GLY 23 N 1.06 0.00 2.00 0.16 0.00 -0.80 -0.18 103.07 105.31 1pfi h GLY 23 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 1pfi h GLY 23 CO 0.01 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.22 1pfi h GLY 24 N 0.02 0.00 1.07 4.60 0.00 -1.12 -1.20 103.07 106.45 1pfi h GLY 24 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 1pfi h GLY 24 CO 0.00 0.00 0.12 -1.82 0.00 0.00 0.00 176.54 174.84 1pfi h TYR 25 N 0.00 1.20 -0.70 5.60 3.20 -1.18 -0.34 116.97 124.76 1pfi h TYR 25 Ca 0.00 -0.16 -0.08 0.00 3.14 0.00 0.00 58.73 61.63 1pfi h TYR 25 Cb 0.00 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 37.91 1pfi h TYR 25 CO 0.00 0.99 0.14 -0.84 -1.64 0.00 0.00 178.16 176.81 1pfi h ILE 26 N 1.06 1.26 -0.68 1.81 -0.00 -1.41 -1.56 117.51 117.99 1pfi h ILE 26 Ca 0.21 -1.02 -0.08 0.00 -0.00 0.00 0.00 64.86 63.97 1pfi h ILE 26 Cb 0.43 0.58 -0.03 0.00 -0.00 0.00 0.00 36.82 37.80 1pfi h ILE 26 CO 0.01 0.39 0.12 0.58 -0.00 0.00 0.00 178.15 179.25 1pfi h VAL 27 N 1.07 1.26 0.00 0.16 2.07 -1.46 -1.64 116.25 117.71 1pfi h VAL 27 Ca 0.21 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.70 1pfi h VAL 27 Cb 0.42 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1pfi h VAL 27 CO 0.01 0.39 0.00 0.61 0.02 0.00 0.00 177.57 178.60 1pfi n GLY 28 N -0.59 -1.00 0.32 2.17 0.00 -0.15 -3.13 105.19 102.80 1pfi n GLY 28 Ca 0.05 -0.11 -0.08 0.00 0.00 0.00 0.00 46.02 45.87 1pfi n GLY 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pfi h ALA 29 N 3.13 0.91 -0.69 4.61 0.00 -0.27 -0.43 119.26 126.52 1pfi h ALA 29 Ca 0.00 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 1pfi h ALA 29 Cb 0.19 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1pfi h ALA 29 CO 0.00 0.67 0.15 -0.07 0.00 0.00 0.00 179.25 180.00 1pfi h LEU 30 N 1.06 1.07 -0.70 0.00 3.38 -1.67 -0.34 115.31 118.12 1pfi h LEU 30 Ca 0.21 -0.24 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 1pfi h LEU 30 Cb 0.42 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1pfi h LEU 30 CO 0.01 1.04 0.12 0.58 0.09 0.00 0.00 178.44 180.28 1pfi h VAL 31 N 1.06 1.26 -0.69 1.22 2.07 -1.67 -0.18 116.25 119.32 1pfi h VAL 31 Ca 0.22 -1.03 -0.08 0.00 0.82 0.00 0.00 66.70 66.63 1pfi h VAL 31 Cb 0.40 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1pfi h VAL 31 CO 0.01 0.39 0.14 0.40 0.02 0.00 0.00 177.57 178.53 1pfi h ILE 32 N 1.05 1.26 -0.67 4.57 2.04 -0.89 -0.12 117.51 124.75 1pfi h ILE 32 Ca 0.21 -1.02 -0.08 0.00 1.00 0.00 0.00 64.86 64.97 1pfi h ILE 32 Cb 0.43 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 1pfi h ILE 32 CO 0.01 0.39 0.11 0.17 0.00 0.00 0.00 178.15 178.83 1pfi h LEU 33 N 1.06 1.07 -0.68 1.44 8.10 -0.86 -0.17 115.31 125.27 1pfi h LEU 33 Ca 0.21 -0.25 -0.08 0.00 0.11 0.00 0.00 57.88 57.87 1pfi h LEU 33 Cb 0.41 -0.28 -0.03 0.00 -0.44 0.00 0.00 40.66 40.32 1pfi h LEU 33 CO 0.01 1.05 0.12 0.00 -4.11 0.00 0.00 178.44 175.51 1pfi h ALA 34 N 1.07 0.90 -0.70 0.17 0.00 -0.82 -0.23 119.26 119.66 1pfi h ALA 34 Ca 0.21 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1pfi h ALA 34 Cb 0.44 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1pfi h ALA 34 CO 0.01 0.67 0.14 -0.39 0.00 0.00 0.00 179.25 179.68 1pfi h VAL 35 N 1.05 1.26 -0.69 0.00 -1.51 -0.82 -0.33 116.25 115.21 1pfi h VAL 35 Ca 0.21 -1.02 -0.08 0.00 -1.23 0.00 0.00 66.70 64.58 1pfi h VAL 35 Cb 0.43 0.58 -0.03 0.00 -2.13 0.00 0.00 31.29 30.14 1pfi h VAL 35 CO 0.01 0.39 0.13 0.00 -1.23 0.00 0.00 177.57 176.87 1pfi h ALA 36 N 1.07 0.93 -0.68 5.19 0.00 -0.82 -0.21 119.26 124.74 1pfi h ALA 36 Ca 0.21 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1pfi h ALA 36 Cb 0.41 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1pfi h ALA 36 CO 0.01 0.67 0.11 0.78 0.00 0.00 0.00 179.25 180.82 1pfi h GLY 37 N 1.07 1.21 1.08 0.00 0.00 -0.85 -0.26 103.07 105.31 1pfi h GLY 37 Ca 0.21 -0.80 -0.08 0.00 0.00 0.00 0.00 47.33 46.66 1pfi h GLY 37 CO 0.01 0.75 0.12 1.41 0.00 0.00 0.00 176.54 178.82 1pfi h LEU 38 N 1.05 1.08 -0.69 3.11 -0.00 -0.86 -0.32 115.31 118.68 1pfi h LEU 38 Ca 0.20 -0.25 -0.08 0.00 -0.00 0.00 0.00 57.88 57.75 1pfi h LEU 38 Cb 0.45 -0.29 -0.03 0.00 -0.00 0.00 0.00 40.66 40.79 1pfi h LEU 38 CO 0.01 1.06 0.13 0.40 -0.00 0.00 0.00 178.44 180.04 1pfi h ILE 39 N 1.05 1.26 -0.69 1.22 5.03 -0.84 -0.22 117.51 124.33 1pfi h ILE 39 Ca 0.21 -1.03 -0.08 0.00 -0.12 0.00 0.00 64.86 63.84 1pfi h ILE 39 Cb 0.43 0.60 -0.03 0.00 -3.03 0.00 0.00 36.82 34.79 1pfi h ILE 39 CO 0.01 0.39 0.13 0.10 -0.68 0.00 0.00 178.15 178.10 1pfi h TYR 40 N 1.06 1.19 -0.69 1.37 -0.00 -0.84 -0.28 116.97 118.79 1pfi h TYR 40 Ca 0.21 -0.16 -0.08 0.00 0.00 0.00 0.00 58.73 58.71 1pfi h TYR 40 Cb 0.43 -0.33 -0.03 0.00 0.00 0.00 0.00 36.73 36.80 1pfi h TYR 40 CO 0.03 0.99 0.13 0.66 -0.00 0.00 0.00 178.16 179.97 1pfi h SER 41 N 1.06 1.08 -0.69 0.10 4.64 -0.85 -0.31 113.55 118.57 1pfi h SER 41 Ca 0.21 -0.25 -0.08 0.00 -0.47 0.00 0.00 61.79 61.20 1pfi h SER 41 Cb 0.42 -0.29 -0.03 0.00 -0.31 0.00 0.00 62.40 62.20 1pfi h SER 41 CO 0.01 1.05 0.13 0.00 -0.87 0.00 0.00 176.83 177.16 1pfi h MET 42 N 1.06 1.13 -0.69 4.77 -0.00 -0.84 -0.35 114.93 120.01 1pfi h MET 42 Ca 0.21 -0.29 -0.08 0.00 -0.00 0.00 0.00 59.70 59.54 1pfi h MET 42 Cb 0.42 -0.14 -0.03 0.00 -0.00 0.00 0.00 31.60 31.86 1pfi h MET 42 CO 0.01 1.02 0.13 1.25 -0.00 0.00 0.00 176.91 179.32 1pfi h LEU 43 N 1.06 1.08 -0.70 -0.10 7.12 -0.85 -0.28 115.31 122.65 1pfi h LEU 43 Ca 0.21 -0.25 -0.08 0.00 0.13 0.00 0.00 57.88 57.89 1pfi h LEU 43 Cb 0.42 -0.29 -0.03 0.00 -0.53 0.00 0.00 40.66 40.24 1pfi h LEU 43 CO 0.01 1.06 0.12 -0.09 -0.13 0.00 0.00 178.44 179.41 1pfi h ARG 44 N 1.06 1.12 -0.68 1.25 2.43 -0.85 -2.92 114.38 115.80 1pfi h ARG 44 Ca 0.21 -0.29 -0.08 0.00 -0.81 0.00 0.00 59.98 59.01 1pfi h ARG 44 Cb 0.43 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 1pfi h ARG 44 CO 0.01 1.01 0.12 0.87 -1.51 0.00 0.00 179.97 180.47 1pfi h LYS 45 N 1.05 1.12 0.00 0.20 1.79 -0.87 -3.51 116.57 116.35 1pfi h LYS 45 Ca 0.21 -0.30 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1pfi h LYS 45 Cb 0.43 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.95 1pfi h LYS 45 CO 0.01 1.02 0.00 0.00 -1.08 0.00 0.00 179.45 179.40