#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 -0.95 -1.54 0.00 0.28 -1.26 -4.70 120.64 112.48 2cps n GLU 2 Ca 0.00 1.11 0.00 0.00 -0.16 0.00 0.00 57.16 58.11 2cps n GLU 2 Cb 0.00 -1.11 0.00 0.00 1.43 0.00 0.00 31.44 31.76 2cps n GLU 2 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2cps n GLY 3 N 1.89 -4.65 3.02 -1.84 0.00 -1.26 -5.03 105.19 97.33 2cps n GLY 3 Ca -0.01 -0.64 -0.01 0.00 0.00 0.00 0.00 46.02 45.36 2cps n GLY 3 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2cps s ASP 4 N -2.78 -1.43 -0.37 1.61 2.15 -1.26 -5.06 116.67 109.52 2cps s ASP 4 Ca 0.00 -1.09 -0.03 0.00 0.43 0.00 0.00 52.55 51.86 2cps s ASP 4 Cb 0.00 1.85 0.23 0.00 -0.30 0.00 0.00 42.92 44.69 2cps s ASP 4 CO 0.00 -0.12 1.07 -0.67 -0.17 0.00 0.00 175.17 175.28 2cps n ASP 5 N 3.82 -1.81 0.09 -0.34 -0.08 -1.26 -5.02 116.55 111.95 2cps n ASP 5 Ca 0.13 -1.58 0.02 0.00 -1.51 0.00 0.00 54.79 51.86 2cps n ASP 5 Cb 0.57 0.95 -0.03 0.00 2.34 0.00 0.00 41.12 44.95 2cps n ASP 5 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2cps h PRO 6 N 4.06 0.00 -3.90 -0.67 0.13 -2.05 -3.48 132.00 126.09 2cps h PRO 6 Ca -0.06 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.68 2cps h PRO 6 Cb 1.16 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.33 2cps h PRO 6 CO -0.08 0.35 -0.56 0.00 -0.23 0.00 0.00 178.00 177.47 2cps n ALA 7 N -2.30 -0.84 -2.90 -0.56 0.00 -1.26 -2.93 120.51 109.72 2cps n ALA 7 Ca -0.04 0.25 -0.19 0.00 0.00 0.00 0.00 53.44 53.46 2cps n ALA 7 Cb 0.77 -3.33 -0.04 0.00 0.00 0.00 0.00 19.45 16.85 2cps n ALA 7 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2cps n LYS 8 N -3.64 -1.18 -0.03 0.00 5.02 -1.26 -4.75 118.16 112.33 2cps n LYS 8 Ca -0.14 0.06 -0.02 0.00 -2.02 0.00 0.00 58.31 56.19 2cps n LYS 8 Cb 0.63 -2.79 -0.01 0.00 -0.02 0.00 0.00 35.03 32.85 2cps n LYS 8 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2cps h ALA 9 N 1.34 0.00 -0.22 7.82 0.00 -1.96 -3.34 119.26 122.91 2cps h ALA 9 Ca -0.27 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.29 2cps h ALA 9 Cb 0.77 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2cps h ALA 9 CO 0.40 0.20 0.07 0.00 0.00 0.00 0.00 179.25 179.92 2cps h ALA 10 N -1.59 0.29 -0.92 0.00 0.00 -1.86 -1.90 119.26 113.29 2cps h ALA 10 Ca 0.00 -0.13 0.21 0.00 0.00 0.00 0.00 54.91 54.99 2cps h ALA 10 Cb 0.20 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 17.78 2cps h ALA 10 CO 0.00 -0.09 0.45 0.35 0.00 0.00 0.00 179.25 179.96 2cps h PHE 11 N 0.19 0.77 -0.12 0.00 3.04 -1.91 0.08 116.94 118.99 2cps h PHE 11 Ca 0.07 0.04 -0.07 0.00 3.98 0.00 0.00 57.97 61.99 2cps h PHE 11 Cb 0.22 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 38.53 2cps h PHE 11 CO -0.00 0.03 -0.21 -0.97 -2.02 0.00 0.00 178.31 175.13 2cps h ASN 12 N 0.49 0.39 -0.85 0.41 -0.73 -1.62 -3.06 115.58 110.60 2cps h ASN 12 Ca 0.56 -0.55 0.20 0.00 1.87 0.00 0.00 56.30 58.39 2cps h ASN 12 Cb 1.03 -0.11 -0.05 0.00 0.27 0.00 0.00 38.32 39.45 2cps h ASN 12 CO -0.48 0.86 0.58 0.28 -0.37 0.00 0.00 177.43 178.30 2cps h SER 13 N -0.07 0.29 -0.19 1.15 0.02 -0.23 0.46 113.55 114.98 2cps h SER 13 Ca 0.01 0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 60.94 2cps h SER 13 Cb 0.79 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.29 2cps h SER 13 CO 0.05 0.12 -0.01 0.25 -1.14 0.00 0.00 176.83 176.10 2cps h LEU 14 N 0.29 0.43 -1.09 5.07 5.85 -1.03 -2.12 115.31 122.72 2cps h LEU 14 Ca 0.43 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 59.03 2cps h LEU 14 Cb 1.23 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 2cps h LEU 14 CO -0.12 0.51 0.10 -0.61 -0.34 0.00 0.00 178.44 177.98 2cps h GLN 15 N 0.45 0.75 -0.73 1.25 5.75 -0.11 -2.08 115.11 120.38 2cps h GLN 15 Ca 0.10 -0.15 -0.13 0.00 -0.15 0.00 0.00 58.65 58.31 2cps h GLN 15 Cb 0.31 -0.11 -0.08 0.00 1.07 0.00 0.00 27.48 28.67 2cps h GLN 15 CO 0.01 0.69 0.17 0.00 -2.65 0.00 0.00 178.83 177.05 2cps n ALA 16 N -2.47 4.21 -0.10 3.38 0.00 -0.84 -3.92 120.51 120.77 2cps n ALA 16 Ca 0.03 -1.99 -0.16 0.00 0.00 0.00 0.00 53.44 51.32 2cps n ALA 16 Cb 0.23 -1.20 -0.09 0.00 0.00 0.00 0.00 19.45 18.39 2cps n ALA 16 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2cps n SER 17 N 0.13 2.23 0.12 0.00 3.41 -0.79 -4.27 113.62 114.46 2cps n SER 17 Ca 0.33 -0.03 0.10 0.00 -0.26 0.00 0.00 58.87 59.01 2cps n SER 17 Cb 1.24 -0.39 0.03 0.00 -0.26 0.00 0.00 64.21 64.83 2cps n SER 17 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cps h ALA 18 N -0.16 0.62 -0.66 7.33 0.00 -1.73 -3.31 119.26 121.35 2cps h ALA 18 Ca -0.48 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.23 2cps h ALA 18 Cb 1.66 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 19.41 2cps h ALA 18 CO -0.13 0.11 0.14 0.25 0.00 0.00 0.00 179.25 179.62 2cps n THR 19 N -2.80 2.86 0.48 0.00 -2.24 -1.25 -4.22 114.28 107.11 2cps n THR 19 Ca -0.00 -1.51 0.12 0.00 -2.27 0.00 0.00 64.05 60.39 2cps n THR 19 Cb 0.58 -0.32 0.09 0.00 -2.10 0.00 0.00 70.33 68.58 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 0.26 0.35 -0.02 -0.78 4.07 -1.25 -3.80 120.64 119.46 2cps n GLU 20 Ca 0.34 0.06 0.05 0.00 -0.06 0.00 0.00 57.16 57.56 2cps n GLU 20 Cb 1.30 -1.68 -0.13 0.00 -0.06 0.00 0.00 31.44 30.87 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 -2.16 0.00 1.12 4.31 4.01 -1.26 -4.32 117.16 118.85 2cps n TYR 21 Ca 0.02 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.90 2cps n TYR 21 Cb 0.46 -0.46 0.52 0.00 -0.31 0.00 0.00 39.34 39.55 2cps n TYR 21 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 2cps n ILE 22 N -2.19 0.00 0.21 -0.72 2.08 -1.26 -3.55 119.36 113.93 2cps n ILE 22 Ca -0.08 -0.01 0.08 0.00 0.56 0.00 0.00 62.75 63.30 2cps n ILE 22 Cb 0.56 -0.20 0.45 0.00 -0.75 0.00 0.00 39.64 39.69 2cps n ILE 22 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2cps h GLY 23 N 4.99 0.00 1.51 7.39 0.00 -1.75 -2.68 103.07 112.53 2cps h GLY 23 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.38 2cps h GLY 23 CO 0.00 0.00 0.20 -0.97 0.00 0.00 0.00 176.54 175.77 2cps h TYR 24 N 0.00 0.00 0.00 5.60 0.05 -1.84 0.42 116.97 121.20 2cps h TYR 24 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2cps h TYR 24 Cb 0.72 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.46 2cps h TYR 24 CO 0.00 0.00 -0.57 0.00 -1.05 0.00 0.00 178.16 176.54 2cps h ALA 25 N 1.76 0.69 -0.03 3.88 0.00 -1.74 -3.30 119.26 120.52 2cps h ALA 25 Ca 0.08 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2cps h ALA 25 Cb 0.47 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2cps h ALA 25 CO -0.00 0.00 -0.26 -1.49 0.00 0.00 0.00 179.25 177.49 2cps h TRP 26 N 0.00 0.05 -0.43 0.00 4.06 -0.24 -3.01 115.95 116.37 2cps h TRP 26 Ca 0.00 -0.01 0.09 0.00 2.06 0.00 0.00 58.89 61.03 2cps h TRP 26 Cb 0.92 -0.01 -0.09 0.00 -1.00 0.00 0.00 29.16 28.98 2cps h TRP 26 CO 0.00 0.31 -0.18 0.00 -3.56 0.00 0.00 178.44 175.02 2cps h ALA 27 N 1.69 0.17 -0.48 1.49 0.00 -1.63 0.15 119.26 120.65 2cps h ALA 27 Ca 0.01 0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.17 2cps h ALA 27 Cb 0.50 0.45 -0.10 0.00 0.00 0.00 0.00 17.79 18.64 2cps h ALA 27 CO 0.04 -0.52 -0.16 0.52 0.00 0.00 0.00 179.25 179.12 2cps h MET 28 N -0.09 -0.04 -0.71 0.00 2.86 -1.77 0.11 114.93 115.30 2cps h MET 28 Ca 0.21 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.83 2cps h MET 28 Cb 0.41 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.04 2cps h MET 28 CO -0.49 -0.03 0.33 0.28 1.06 0.00 0.00 176.91 178.06 2cps h VAL 29 N -0.05 1.23 -0.26 -2.22 2.07 -1.32 -1.77 116.25 113.93 2cps h VAL 29 Ca 0.23 -0.65 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 2cps h VAL 29 Cb 0.40 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2cps h VAL 29 CO -0.52 0.27 0.08 1.62 0.02 0.00 0.00 177.57 179.04 2cps h VAL 30 N 1.00 1.12 0.00 2.57 3.04 0.17 0.22 116.25 124.37 2cps h VAL 30 Ca 0.24 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 65.54 2cps h VAL 30 Cb 0.11 0.84 0.00 0.00 -2.01 0.00 0.00 31.29 30.23 2cps h VAL 30 CO -0.03 0.14 0.00 0.52 -1.01 0.00 0.00 177.57 177.19 2cps n VAL 31 N -4.41 0.72 -0.06 1.51 0.31 -0.12 0.52 118.33 116.81 2cps n VAL 31 Ca 0.01 0.07 -0.19 0.00 -0.01 0.00 0.00 64.34 64.21 2cps n VAL 31 Cb 0.14 -0.93 -0.13 0.00 -0.91 0.00 0.00 33.84 32.02 2cps n VAL 31 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2cps n ILE 32 N -2.10 1.64 0.02 2.52 5.41 -0.03 -3.88 119.36 122.93 2cps n ILE 32 Ca 0.04 -0.63 -0.16 0.00 1.00 0.00 0.00 62.75 63.00 2cps n ILE 32 Cb 0.29 -1.55 -0.14 0.00 -0.71 0.00 0.00 39.64 37.53 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 0.04 0.88 -0.93 1.39 2.07 -1.26 -3.36 116.25 115.08 2cps h VAL 33 Ca -0.49 -2.61 0.00 0.00 0.82 0.00 0.00 66.70 64.43 2cps h VAL 33 Cb 1.98 2.57 -0.05 0.00 -1.52 0.00 0.00 31.29 34.28 2cps h VAL 33 CO 0.01 0.76 0.59 1.23 0.02 0.00 0.00 177.57 180.17 2cps h GLY 34 N 1.99 1.32 0.27 2.17 0.00 -0.15 -1.36 103.07 107.32 2cps h GLY 34 Ca -0.32 -0.52 0.24 0.00 0.00 0.00 0.00 47.33 46.73 2cps h GLY 34 CO 0.11 0.51 0.61 0.00 0.00 0.00 0.00 176.54 177.77 2cps h ALA 35 N 1.32 2.63 -0.03 3.60 0.00 -1.70 0.27 119.26 125.35 2cps h ALA 35 Ca 0.34 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.10 2cps h ALA 35 Cb -0.11 0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.73 2cps h ALA 35 CO -0.07 -0.89 -0.50 1.15 0.00 0.00 0.00 179.25 178.94 2cps h THR 36 N 0.12 1.43 -0.67 0.00 2.02 -1.43 -3.09 112.91 111.30 2cps h THR 36 Ca 0.43 -1.97 -0.04 0.00 0.77 0.00 0.00 66.41 65.60 2cps h THR 36 Cb 1.51 2.51 -0.03 0.00 -1.74 0.00 0.00 68.15 70.40 2cps h THR 36 CO -0.06 0.57 0.25 0.40 0.37 0.00 0.00 175.52 177.05 2cps h ILE 37 N -0.13 1.24 0.22 3.11 2.04 -0.54 -0.89 117.51 122.56 2cps h ILE 37 Ca -0.05 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 2cps h ILE 37 Cb 1.20 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 2cps h ILE 37 CO 0.10 0.31 -0.22 1.23 0.00 0.00 0.00 178.15 179.56 2cps h GLY 38 N 1.06 -0.96 0.61 5.37 0.00 -0.65 -0.15 103.07 108.35 2cps h GLY 38 Ca 0.22 0.43 0.07 0.00 0.00 0.00 0.00 47.33 48.06 2cps h GLY 38 CO -0.02 -0.32 0.38 -2.22 0.00 0.00 0.00 176.54 174.37 2cps h ILE 39 N -0.44 0.93 -0.84 2.60 2.04 -1.52 -0.72 117.51 119.57 2cps h ILE 39 Ca -0.03 -0.24 0.13 0.00 1.00 0.00 0.00 64.86 65.73 2cps h ILE 39 Cb 0.38 0.19 -0.06 0.00 -0.74 0.00 0.00 36.82 36.59 2cps h ILE 39 CO -0.03 0.13 0.55 0.50 0.00 0.00 0.00 178.15 179.29 2cps h LYS 40 N 0.69 0.63 -0.32 2.37 1.63 -0.94 -1.04 116.57 119.59 2cps h LYS 40 Ca 0.33 -0.04 -0.06 0.00 -0.85 0.00 0.00 60.65 60.03 2cps h LYS 40 Cb 0.25 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.73 2cps h LYS 40 CO -0.21 0.41 -0.02 -0.07 -3.45 0.00 0.00 179.45 176.11 2cps h LEU 41 N 0.64 0.57 -0.38 5.20 3.38 0.52 -3.15 115.31 122.09 2cps h LEU 41 Ca 0.41 -0.33 0.07 0.00 0.09 0.00 0.00 57.88 58.13 2cps h LEU 41 Cb 0.68 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.21 2cps h LEU 41 CO -0.17 0.76 -0.05 0.15 0.09 0.00 0.00 178.44 179.21 2cps h PHE 42 N 0.36 -0.12 -0.20 1.13 3.04 -0.81 0.92 116.94 121.26 2cps h PHE 42 Ca 0.09 0.03 0.06 0.00 3.98 0.00 0.00 57.97 62.12 2cps h PHE 42 Cb 0.48 0.11 -0.01 0.00 2.56 0.00 0.00 35.95 39.09 2cps h PHE 42 CO 0.04 -0.12 0.45 0.87 -2.02 0.00 0.00 178.31 177.52 2cps h LYS 43 N 0.04 0.00 0.00 1.11 1.79 -1.42 1.32 116.57 119.41 2cps h LYS 43 Ca 0.18 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.65 2cps h LYS 43 Cb 0.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 2cps h LYS 43 CO -0.35 0.00 0.00 1.17 -1.08 0.00 0.00 179.45 179.19 2cps n LYS 44 N -3.20 0.00 -0.09 3.15 3.00 0.21 -4.70 118.16 116.52 2cps n LYS 44 Ca 0.03 0.07 -0.11 0.00 -0.00 0.00 0.00 58.31 58.29 2cps n LYS 44 Cb 0.55 -0.41 0.01 0.00 0.00 0.00 0.00 35.03 35.19 2cps n LYS 44 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.40 178.14 2cps h PHE 45 N 0.00 1.01 -6.99 5.64 0.04 -1.24 -3.47 116.94 111.93 2cps h PHE 45 Ca 0.00 -0.30 -0.59 0.00 2.80 0.00 0.00 57.97 59.88 2cps h PHE 45 Cb 0.00 -0.22 -0.29 0.00 2.20 0.00 0.00 35.95 37.65 2cps h PHE 45 CO 0.00 1.09 -0.89 -2.37 -0.60 0.00 0.00 178.31 175.54 2cps n THR 46 N -4.05 -0.64 -1.18 -1.55 5.66 0.45 0.17 114.28 113.14 2cps n THR 46 Ca -0.02 -0.08 -0.06 0.00 -3.05 0.00 0.00 64.05 60.84 2cps n THR 46 Cb 0.53 -1.10 -0.03 0.00 -1.55 0.00 0.00 70.33 68.18 2cps n THR 46 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2cps n SER 47 N -2.60 -4.42 -0.05 1.09 2.88 -1.26 -4.91 113.62 104.35 2cps n SER 47 Ca 0.04 0.15 -0.08 0.00 -1.33 0.00 0.00 58.87 57.65 2cps n SER 47 Cb 0.50 -2.47 -0.02 0.00 -0.75 0.00 0.00 64.21 61.48 2cps n SER 47 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2cps h LYS 48 N 0.21 -0.24 -2.25 -1.46 1.79 0.14 -3.12 116.57 111.65 2cps h LYS 48 Ca -0.13 0.02 -0.58 0.00 -2.18 0.00 0.00 60.65 57.78 2cps h LYS 48 Cb 0.63 0.05 -0.42 0.00 -1.58 0.00 0.00 32.23 30.92 2cps h LYS 48 CO 0.18 -0.16 -0.71 0.00 -1.08 0.00 0.00 179.45 177.69 2cps n ALA 49 N -2.81 4.31 0.00 3.86 0.00 -1.26 -5.18 120.51 119.42 2cps n ALA 49 Ca -0.01 -4.54 0.00 0.00 0.00 0.00 0.00 53.44 48.89 2cps n ALA 49 Cb 0.29 -0.76 0.00 0.00 0.00 0.00 0.00 19.45 18.98 2cps n ALA 49 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95