#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cps n GLU 2 N 0.00 1.22 -0.15 0.00 4.07 -1.26 -4.84 120.64 119.68 2cps n GLU 2 Ca 0.00 0.45 0.09 0.00 -0.06 0.00 0.00 57.16 57.64 2cps n GLU 2 Cb 0.00 -2.14 0.15 0.00 -0.06 0.00 0.00 31.44 29.39 2cps n GLU 2 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2cps n GLY 3 N 4.00 4.89 0.23 8.31 0.00 -1.26 -4.70 105.19 116.66 2cps n GLY 3 Ca 0.25 -1.16 -0.09 0.00 0.00 0.00 0.00 46.02 45.02 2cps n GLY 3 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2cps h ASP 4 N 0.14 0.68 -4.39 1.61 1.82 -2.10 -3.49 116.42 110.69 2cps h ASP 4 Ca -0.00 -0.33 0.00 0.00 -0.39 0.00 0.00 57.03 56.31 2cps h ASP 4 Cb 1.00 -0.19 0.00 0.00 0.68 0.00 0.00 39.33 40.82 2cps h ASP 4 CO 0.00 1.04 -0.93 -0.67 -1.61 0.00 0.00 179.24 177.07 2cps n ASP 5 N -4.00 -8.85 -0.16 2.28 -0.08 -1.26 -4.77 116.55 99.71 2cps n ASP 5 Ca -0.03 1.34 0.02 0.00 -1.51 0.00 0.00 54.79 54.62 2cps n ASP 5 Cb 0.56 -4.97 0.08 0.00 2.34 0.00 0.00 41.12 39.13 2cps n ASP 5 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2cps n PRO 6 N 1.74 1.20 0.20 -0.67 -0.04 -1.26 -4.26 135.00 131.90 2cps n PRO 6 Ca 0.00 -0.31 -0.08 0.00 -0.04 0.00 0.00 63.50 63.08 2cps n PRO 6 Cb 0.00 -1.09 -0.04 0.00 -0.04 0.00 0.00 33.50 32.34 2cps n PRO 6 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cps h ALA 7 N 3.20 -1.10 -0.11 0.55 0.00 -2.02 -2.88 119.26 116.89 2cps h ALA 7 Ca 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.83 2cps h ALA 7 Cb 0.12 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2cps h ALA 7 CO 0.00 -1.07 0.10 1.57 0.00 0.00 0.00 179.25 179.85 2cps h LYS 8 N -0.51 0.00 -0.25 0.00 2.10 -1.90 -2.56 116.57 113.45 2cps h LYS 8 Ca -0.05 0.00 0.06 0.00 -2.00 0.00 0.00 60.65 58.66 2cps h LYS 8 Cb 0.38 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.64 2cps h LYS 8 CO 0.08 0.00 -0.25 0.00 -2.00 0.00 0.00 179.45 177.28 2cps h ALA 9 N 1.91 -0.15 -0.43 0.07 0.00 -1.73 0.73 119.26 119.66 2cps h ALA 9 Ca 0.05 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.09 2cps h ALA 9 Cb 0.25 0.53 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 2cps h ALA 9 CO -0.00 -0.68 0.15 0.00 0.00 0.00 0.00 179.25 178.72 2cps h ALA 10 N 0.77 0.51 -0.31 0.00 0.00 -1.33 1.09 119.26 119.99 2cps h ALA 10 Ca 0.14 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2cps h ALA 10 Cb 0.47 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2cps h ALA 10 CO -0.40 -0.23 -0.05 0.35 0.00 0.00 0.00 179.25 178.91 2cps h PHE 11 N 0.32 0.53 0.01 0.00 3.04 -1.35 -2.37 116.94 117.12 2cps h PHE 11 Ca 0.20 -0.06 -0.20 0.00 3.98 0.00 0.00 57.97 61.89 2cps h PHE 11 Cb 0.19 -0.15 -0.02 0.00 2.56 0.00 0.00 35.95 38.53 2cps h PHE 11 CO -0.15 0.56 -0.93 -0.97 -2.02 0.00 0.00 178.31 174.80 2cps h ASN 12 N 0.48 0.11 0.25 0.41 -1.24 0.17 -3.14 115.58 112.62 2cps h ASN 12 Ca 0.10 -0.10 -0.04 0.00 0.71 0.00 0.00 56.30 56.97 2cps h ASN 12 Cb 0.40 -0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.41 2cps h ASN 12 CO 0.02 0.97 -0.20 -1.28 -1.29 0.00 0.00 177.43 175.65 2cps h SER 13 N 0.04 0.00 0.55 1.15 0.87 0.17 -1.16 113.55 115.16 2cps h SER 13 Ca -0.03 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.47 2cps h SER 13 Cb 1.61 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.56 2cps h SER 13 CO 0.13 0.20 -0.26 0.25 -0.53 0.00 0.00 176.83 176.62 2cps h LEU 14 N 0.00 0.00 0.10 2.23 5.85 -1.42 -1.50 115.31 120.58 2cps h LEU 14 Ca -0.00 0.00 -0.32 0.00 0.84 0.00 0.00 57.88 58.40 2cps h LEU 14 Cb 0.38 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 2cps h LEU 14 CO 0.03 0.26 -1.69 -0.61 -0.34 0.00 0.00 178.44 176.09 2cps h GLN 15 N 0.00 0.22 -0.65 1.25 5.75 -1.35 -3.33 115.11 117.00 2cps h GLN 15 Ca -0.00 -0.38 0.00 0.00 -0.15 0.00 0.00 58.65 58.12 2cps h GLN 15 Cb 0.61 0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.30 2cps h GLN 15 CO 0.03 1.05 0.00 0.00 -2.65 0.00 0.00 178.83 177.26 2cps n ALA 16 N -2.74 3.01 0.20 3.38 0.00 -0.65 -3.97 120.51 119.74 2cps n ALA 16 Ca -0.21 -0.96 0.09 0.00 0.00 0.00 0.00 53.44 52.36 2cps n ALA 16 Cb 1.05 -1.04 0.25 0.00 0.00 0.00 0.00 19.45 19.71 2cps n ALA 16 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2cps n SER 17 N 0.47 3.05 -2.31 0.00 2.88 -0.58 -4.27 113.62 112.85 2cps n SER 17 Ca 0.15 -2.04 -0.34 0.00 -1.33 0.00 0.00 58.87 55.32 2cps n SER 17 Cb 0.64 -0.38 0.09 0.00 -0.75 0.00 0.00 64.21 63.81 2cps n SER 17 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2cps n ALA 18 N 1.09 6.24 1.07 -1.46 0.00 -1.25 -4.44 120.51 121.76 2cps n ALA 18 Ca 0.19 -3.43 0.13 0.00 0.00 0.00 0.00 53.44 50.33 2cps n ALA 18 Cb 0.49 -1.72 0.36 0.00 0.00 0.00 0.00 19.45 18.59 2cps n ALA 18 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2cps n THR 19 N -0.94 0.00 0.92 0.00 -2.24 -1.26 -3.69 114.28 107.07 2cps n THR 19 Ca 0.62 -0.02 0.11 0.00 -2.27 0.00 0.00 64.05 62.50 2cps n THR 19 Cb 0.77 0.10 0.13 0.00 -2.10 0.00 0.00 70.33 69.23 2cps n THR 19 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2cps n GLU 20 N -1.34 0.05 0.04 -0.78 4.07 -1.26 -3.87 120.64 117.55 2cps n GLU 20 Ca 0.07 0.00 0.11 0.00 -0.06 0.00 0.00 57.16 57.29 2cps n GLU 20 Cb 0.33 -1.52 0.06 0.00 -0.06 0.00 0.00 31.44 30.25 2cps n GLU 20 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2cps n TYR 21 N -1.59 0.41 -0.06 4.31 4.02 -1.24 -4.32 117.16 118.68 2cps n TYR 21 Ca 0.05 0.12 -0.22 0.00 -0.01 0.00 0.00 57.90 57.84 2cps n TYR 21 Cb 0.35 -0.55 -0.12 0.00 -0.02 0.00 0.00 39.34 39.00 2cps n TYR 21 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 2cps h ILE 22 N 0.00 0.87 -1.61 -0.72 5.03 -1.72 -3.38 117.51 115.98 2cps h ILE 22 Ca 0.00 -2.25 0.49 0.00 -0.12 0.00 0.00 64.86 62.98 2cps h ILE 22 Cb 0.76 2.37 -0.09 0.00 -3.03 0.00 0.00 36.82 36.84 2cps h ILE 22 CO 0.00 0.52 1.12 1.23 -0.68 0.00 0.00 178.15 180.34 2cps h GLY 23 N -0.33 0.51 1.58 5.37 0.00 -1.75 1.00 103.07 109.45 2cps h GLY 23 Ca -0.36 -0.04 -0.16 0.00 0.00 0.00 0.00 47.33 46.77 2cps h GLY 23 CO -0.10 -0.16 -0.61 -0.97 0.00 0.00 0.00 176.54 174.71 2cps h TYR 24 N 0.03 0.55 0.00 5.60 0.05 -1.79 -2.92 116.97 118.49 2cps h TYR 24 Ca 0.84 -0.21 0.00 0.00 0.05 0.00 0.00 58.73 59.41 2cps h TYR 24 Cb 3.09 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 40.73 2cps h TYR 24 CO -0.00 0.93 0.15 0.00 -1.05 0.00 0.00 178.16 178.18 2cps h ALA 25 N 1.02 1.15 0.02 3.88 0.00 0.86 -1.72 119.26 124.47 2cps h ALA 25 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2cps h ALA 25 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2cps h ALA 25 CO 0.11 -0.15 -0.18 -1.49 0.00 0.00 0.00 179.25 177.54 2cps h TRP 26 N 0.00 0.15 0.21 0.00 4.06 -1.54 -3.02 115.95 115.81 2cps h TRP 26 Ca 0.00 -0.09 -0.00 0.00 2.06 0.00 0.00 58.89 60.85 2cps h TRP 26 Cb 0.30 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 28.44 2cps h TRP 26 CO 0.00 0.98 -0.16 0.00 -3.56 0.00 0.00 178.44 175.70 2cps h ALA 27 N 0.13 -0.35 -0.85 1.49 0.00 -1.43 -1.91 119.26 116.35 2cps h ALA 27 Ca -0.03 -0.06 0.17 0.00 0.00 0.00 0.00 54.91 54.99 2cps h ALA 27 Cb 1.05 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.99 2cps h ALA 27 CO 0.03 -0.71 0.56 0.52 0.00 0.00 0.00 179.25 179.65 2cps h MET 28 N -0.38 0.46 -0.32 0.00 2.86 -1.61 -0.39 114.93 115.56 2cps h MET 28 Ca -0.01 -0.03 0.06 0.00 -2.06 0.00 0.00 59.70 57.66 2cps h MET 28 Cb 0.33 -0.10 -0.05 0.00 0.06 0.00 0.00 31.60 31.84 2cps h MET 28 CO -0.01 0.30 -0.01 0.28 1.06 0.00 0.00 176.91 178.53 2cps h VAL 29 N 0.47 0.76 -0.32 -2.22 2.07 -1.21 -2.01 116.25 113.80 2cps h VAL 29 Ca 0.43 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.96 2cps h VAL 29 Cb 0.96 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 2cps h VAL 29 CO -0.16 0.01 0.08 0.58 0.02 0.00 0.00 177.57 178.10 2cps h VAL 30 N 0.08 0.86 0.00 2.57 2.07 -0.91 0.41 116.25 121.34 2cps h VAL 30 Ca 0.15 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.61 2cps h VAL 30 Cb 0.21 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 2cps h VAL 30 CO -0.27 0.04 0.07 0.58 0.02 0.00 0.00 177.57 178.01 2cps h VAL 31 N 0.19 0.00 0.03 2.57 2.07 -1.15 0.51 116.25 120.48 2cps h VAL 31 Ca 0.15 0.00 -0.38 0.00 0.82 0.00 0.00 66.70 67.29 2cps h VAL 31 Cb 0.15 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 30.72 2cps h VAL 31 CO -0.18 0.00 -2.17 -0.38 0.02 0.00 0.00 177.57 174.86 2cps n ILE 32 N -2.90 1.58 0.25 4.57 5.41 0.01 -3.65 119.36 124.63 2cps n ILE 32 Ca -0.03 -0.46 0.09 0.00 1.00 0.00 0.00 62.75 63.36 2cps n ILE 32 Cb 0.13 -1.72 0.62 0.00 -0.71 0.00 0.00 39.64 37.96 2cps n ILE 32 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 2cps h VAL 33 N -0.39 0.90 0.08 1.39 2.07 0.32 -2.89 116.25 117.73 2cps h VAL 33 Ca -0.53 -0.48 -0.00 0.00 0.82 0.00 0.00 66.70 66.51 2cps h VAL 33 Cb 1.77 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 32.81 2cps h VAL 33 CO -0.15 0.13 -0.04 1.23 0.02 0.00 0.00 177.57 178.76 2cps h GLY 34 N 0.52 -0.11 -0.41 2.17 0.00 -1.10 -3.16 103.07 100.98 2cps h GLY 34 Ca -0.00 0.04 0.35 0.00 0.00 0.00 0.00 47.33 47.72 2cps h GLY 34 CO 0.02 -0.04 0.86 0.00 0.00 0.00 0.00 176.54 177.38 2cps h ALA 35 N -0.13 3.11 -0.18 3.60 0.00 -1.59 0.66 119.26 124.73 2cps h ALA 35 Ca -0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2cps h ALA 35 Cb 0.60 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2cps h ALA 35 CO 0.02 -1.46 0.02 1.15 0.00 0.00 0.00 179.25 178.99 2cps h THR 36 N 0.02 1.23 -0.07 0.00 2.02 -1.49 -2.32 112.91 112.30 2cps h THR 36 Ca 0.58 -0.74 0.02 0.00 0.77 0.00 0.00 66.41 67.03 2cps h THR 36 Cb 2.28 1.38 -0.00 0.00 -1.74 0.00 0.00 68.15 70.07 2cps h THR 36 CO -0.02 0.23 0.25 0.40 0.37 0.00 0.00 175.52 176.74 2cps h ILE 37 N 0.08 0.12 0.00 3.11 1.08 0.36 0.41 117.51 122.67 2cps h ILE 37 Ca 0.05 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.47 2cps h ILE 37 Cb 0.32 0.77 -0.01 0.00 -3.07 0.00 0.00 36.82 34.83 2cps h ILE 37 CO 0.00 0.00 -0.77 1.23 -0.69 0.00 0.00 178.15 177.92 2cps h GLY 38 N 0.00 0.00 0.66 5.37 0.00 -1.19 -3.14 103.07 104.77 2cps h GLY 38 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.02 2cps h GLY 38 CO -0.00 0.00 -1.95 1.39 0.00 0.00 0.00 176.54 175.98 2cps n ILE 39 N -2.90 1.67 -0.14 2.60 2.08 0.12 -3.99 119.36 118.80 2cps n ILE 39 Ca -0.01 -0.71 -0.07 0.00 0.56 0.00 0.00 62.75 62.52 2cps n ILE 39 Cb 0.63 -1.38 0.01 0.00 -0.75 0.00 0.00 39.64 38.16 2cps n ILE 39 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 2cps h LYS 40 N 0.04 0.55 -0.17 0.38 1.63 -0.81 0.34 116.57 118.52 2cps h LYS 40 Ca -0.39 -0.03 0.05 0.00 -0.85 0.00 0.00 60.65 59.42 2cps h LYS 40 Cb 2.03 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 33.53 2cps h LYS 40 CO 0.07 0.37 0.20 -0.07 -3.45 0.00 0.00 179.45 176.56 2cps h LEU 41 N 0.57 0.00 0.15 5.20 3.38 -1.70 0.41 115.31 123.32 2cps h LEU 41 Ca 0.17 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.79 2cps h LEU 41 Cb -0.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2cps h LEU 41 CO -0.05 0.00 -1.78 0.15 0.09 0.00 0.00 178.44 176.85 2cps h PHE 42 N 0.00 0.59 -0.10 1.13 3.57 -1.22 -3.36 116.94 117.56 2cps h PHE 42 Ca 0.08 -0.43 -0.02 0.00 3.53 0.00 0.00 57.97 61.13 2cps h PHE 42 Cb 0.48 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 2cps h PHE 42 CO 0.00 1.63 -0.04 0.87 -2.23 0.00 0.00 178.31 178.54 2cps h LYS 43 N 0.09 0.20 -0.75 1.11 1.79 0.18 -2.01 116.57 117.18 2cps h LYS 43 Ca -0.35 -0.08 0.14 0.00 -2.18 0.00 0.00 60.65 58.18 2cps h LYS 43 Cb 2.07 -0.01 -0.14 0.00 -1.58 0.00 0.00 32.23 32.57 2cps h LYS 43 CO 0.15 0.53 -0.26 -0.22 -1.08 0.00 0.00 179.45 178.58 2cps h LYS 44 N -0.15 -0.05 -0.40 3.15 3.11 -1.15 0.14 116.57 121.23 2cps h LYS 44 Ca 0.02 0.00 -0.15 0.00 -2.81 0.00 0.00 60.65 57.71 2cps h LYS 44 Cb 0.47 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.70 2cps h LYS 44 CO 0.01 -0.03 -0.35 0.74 -2.81 0.00 0.00 179.45 177.01 2cps h PHE 45 N -0.05 1.12 -1.10 1.91 0.04 -1.69 -3.21 116.94 113.97 2cps h PHE 45 Ca 0.33 -0.33 -0.71 0.00 2.80 0.00 0.00 57.97 60.06 2cps h PHE 45 Cb 0.57 -0.24 -0.12 0.00 2.20 0.00 0.00 35.95 38.36 2cps h PHE 45 CO -0.65 1.16 2.23 0.25 -0.60 0.00 0.00 178.31 180.69 2cps n THR 46 N -4.08 5.00 0.06 -1.55 -2.24 0.45 -4.01 114.28 107.92 2cps n THR 46 Ca -0.02 -4.10 0.00 0.00 -2.27 0.00 0.00 64.05 57.66 2cps n THR 46 Cb 0.53 -2.04 0.00 0.00 -2.10 0.00 0.00 70.33 66.72 2cps n THR 46 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2cps n SER 47 N 1.69 -1.09 -3.53 3.42 3.41 -0.95 -4.79 113.62 111.78 2cps n SER 47 Ca 0.61 0.24 -0.43 0.00 -0.26 0.00 0.00 58.87 59.04 2cps n SER 47 Cb 0.28 1.35 -0.09 0.00 -0.26 0.00 0.00 64.21 65.49 2cps n SER 47 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2cps n LYS 48 N -2.72 0.63 -3.63 4.33 5.02 -1.21 -4.66 118.16 115.91 2cps n LYS 48 Ca 0.00 -1.33 -0.07 0.00 -2.02 0.00 0.00 58.31 54.89 2cps n LYS 48 Cb 0.00 -2.65 -0.06 0.00 -0.02 0.00 0.00 35.03 32.30 2cps n LYS 48 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2cps s ALA 49 N 6.09 -2.04 0.00 7.82 0.00 -1.26 -5.08 121.76 127.29 2cps s ALA 49 Ca 0.62 1.77 0.00 0.00 0.00 0.00 0.00 51.96 54.35 2cps s ALA 49 Cb 0.14 -1.37 0.00 0.00 0.00 0.00 0.00 23.12 21.89 2cps s ALA 49 CO 0.24 -0.22 0.00 0.45 0.00 0.00 0.00 175.76 176.23