#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 0.00 -0.41 0.00 0.00 -1.26 -5.16 120.64 113.81 2cps n GLU 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2cps n GLU 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 2cps n GLU 2 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2cps n GLY 3 N 0.00 -3.14 2.96 -1.84 0.00 -1.26 -4.87 105.19 97.03 2cps n GLY 3 Ca 0.00 -1.18 -0.30 0.00 0.00 0.00 0.00 46.02 44.54 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 -3.56 4.99 -0.47 1.61 2.15 -1.26 -4.91 116.67 115.21 2cps s ASP 4 Ca 0.00 -3.66 0.06 0.00 0.43 0.00 0.00 52.55 49.39 2cps s ASP 4 Cb 0.00 -1.70 0.23 0.00 -0.30 0.00 0.00 42.92 41.16 2cps s ASP 4 CO 0.00 -0.14 0.79 -0.67 -0.17 0.00 0.00 175.17 174.98 2cps n ASP 5 N 2.28 -2.35 0.12 -0.34 2.03 -1.26 -4.98 116.55 112.05 2cps n ASP 5 Ca 0.17 -3.13 0.12 0.00 0.52 0.00 0.00 54.79 52.47 2cps n ASP 5 Cb 0.35 1.32 0.24 0.00 -0.72 0.00 0.00 41.12 42.31 2cps n ASP 5 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2cps h PRO 6 N 4.15 0.00 0.00 -0.67 0.13 -2.00 -3.29 132.00 130.32 2cps h PRO 6 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2cps h PRO 6 Cb 1.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2cps h PRO 6 CO 0.32 0.00 0.02 0.00 -0.23 0.00 0.00 178.00 178.11 2cps h ALA 7 N 2.35 1.02 -1.58 -0.56 0.00 -2.01 -2.79 119.26 115.69 2cps h ALA 7 Ca 0.00 0.00 0.46 0.00 0.00 0.00 0.00 54.91 55.37 2cps h ALA 7 Cb 0.83 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.55 2cps h ALA 7 CO 0.00 -0.02 1.18 1.57 0.00 0.00 0.00 179.25 181.97 2cps h LYS 8 N 0.00 0.00 0.00 0.00 2.10 -1.99 0.27 116.57 116.96 2cps h LYS 8 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2cps h LYS 8 Cb 0.04 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.37 2cps h LYS 8 CO 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.45 2cps n ALA 9 N -2.80 -0.10 0.09 0.07 0.00 -1.05 -2.21 120.51 114.51 2cps n ALA 9 Ca 0.35 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.99 2cps n ALA 9 Cb 1.66 0.00 0.69 0.00 0.00 0.00 0.00 19.45 21.80 2cps n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cps h ALA 10 N -2.00 2.12 0.11 0.00 0.00 -1.57 0.63 119.26 118.55 2cps h ALA 10 Ca 0.00 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.60 2cps h ALA 10 Cb 0.00 0.03 0.03 0.00 0.00 0.00 0.00 17.79 17.85 2cps h ALA 10 CO 0.00 -0.78 -1.23 0.35 0.00 0.00 0.00 179.25 177.59 2cps h PHE 11 N 0.00 0.98 0.00 0.00 3.57 -0.58 -2.66 116.94 118.25 2cps h PHE 11 Ca 0.20 -0.61 -0.08 0.00 3.53 0.00 0.00 57.97 61.01 2cps h PHE 11 Cb 1.33 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.98 2cps h PHE 11 CO 0.00 1.46 -0.46 -0.97 -2.23 0.00 0.00 178.31 176.10 2cps h ASN 12 N 0.28 0.00 -0.34 0.41 -0.73 -0.02 -3.11 115.58 112.07 2cps h ASN 12 Ca -0.18 -0.77 0.06 0.00 1.87 0.00 0.00 56.30 57.28 2cps h ASN 12 Cb 1.90 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 40.47 2cps h ASN 12 CO 0.23 1.16 0.23 0.28 -0.37 0.00 0.00 177.43 178.96 2cps h SER 13 N -1.00 0.17 -0.17 1.15 0.02 -0.11 0.77 113.55 114.37 2cps h SER 13 Ca -0.13 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.63 2cps h SER 13 Cb 1.07 -0.04 0.01 0.00 0.14 0.00 0.00 62.40 63.58 2cps h SER 13 CO -0.08 0.11 -0.64 0.25 -1.14 0.00 0.00 176.83 175.34 2cps h LEU 14 N 0.20 0.86 0.10 5.07 5.85 -1.60 -2.00 115.31 123.78 2cps h LEU 14 Ca 0.15 -0.61 -0.29 0.00 0.84 0.00 0.00 57.88 57.98 2cps h LEU 14 Cb 0.36 -0.25 0.02 0.00 0.37 0.00 0.00 40.66 41.16 2cps h LEU 14 CO -0.03 1.32 -1.24 -0.61 -0.34 0.00 0.00 178.44 177.55 2cps h GLN 15 N 0.45 0.50 0.00 1.25 4.15 -1.23 -3.17 115.11 117.06 2cps h GLN 15 Ca -0.03 -0.71 0.00 0.00 0.77 0.00 0.00 58.65 58.68 2cps h GLN 15 Cb 1.26 0.24 0.00 0.00 0.21 0.00 0.00 27.48 29.20 2cps h GLN 15 CO 0.13 1.31 0.00 0.00 -1.93 0.00 0.00 178.83 178.35 2cps n ALA 16 N -2.63 2.58 -0.64 3.38 0.00 0.26 -2.83 120.51 120.63 2cps n ALA 16 Ca -0.12 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2cps n ALA 16 Cb 0.99 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.96 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 -1.03 0.00 0.29 0.00 2.88 -0.75 -3.69 113.62 111.32 2cps n SER 17 Ca 0.21 0.21 0.19 0.00 -1.33 0.00 0.00 58.87 58.15 2cps n SER 17 Cb 0.11 -0.18 0.93 0.00 -0.75 0.00 0.00 64.21 64.32 2cps n SER 17 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2cps h ALA 18 N -2.00 1.00 -0.77 -1.46 0.00 -1.72 -2.23 119.26 112.08 2cps h ALA 18 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.44 2cps h ALA 18 Cb 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 17.56 2cps h ALA 18 CO 0.00 0.00 0.60 2.41 0.00 0.00 0.00 179.25 182.26 2cps n THR 19 N -2.98 3.00 1.36 0.00 -1.04 -1.13 -4.33 114.28 109.15 2cps n THR 19 Ca -0.01 -1.94 0.14 0.00 -2.04 0.00 0.00 64.05 60.20 2cps n THR 19 Cb 0.17 -0.92 0.64 0.00 -1.82 0.00 0.00 70.33 68.40 2cps n THR 19 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2cps n GLU 20 N -0.57 0.51 -0.02 -2.82 0.00 -0.84 -2.97 120.64 113.93 2cps n GLU 20 Ca 0.48 -0.13 0.08 0.00 0.00 0.00 0.00 57.16 57.59 2cps n GLU 20 Cb 1.01 -1.50 -0.16 0.00 0.00 0.00 0.00 31.44 30.79 2cps n GLU 20 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2cps n TYR 21 N -1.13 0.05 0.02 4.31 4.01 -1.26 -4.45 117.16 118.71 2cps n TYR 21 Ca 0.13 0.01 -0.22 0.00 -0.16 0.00 0.00 57.90 57.67 2cps n TYR 21 Cb 0.27 -0.59 -0.14 0.00 -0.31 0.00 0.00 39.34 38.57 2cps n TYR 21 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 2cps h ILE 22 N 0.00 1.02 -0.93 -0.72 1.08 -1.87 -3.38 117.51 112.71 2cps h ILE 22 Ca -0.08 -2.43 0.28 0.00 -0.39 0.00 0.00 64.86 62.24 2cps h ILE 22 Cb 1.18 2.74 -0.16 0.00 -3.07 0.00 0.00 36.82 37.52 2cps h ILE 22 CO 0.00 0.74 0.28 1.23 -0.69 0.00 0.00 178.15 179.72 2cps h GLY 23 N 0.20 1.56 0.51 5.37 0.00 -1.75 1.46 103.07 110.41 2cps h GLY 23 Ca -0.31 -0.04 0.09 0.00 0.00 0.00 0.00 47.33 47.07 2cps h GLY 23 CO 0.09 -0.47 0.38 -0.97 0.00 0.00 0.00 176.54 175.57 2cps h TYR 24 N 0.16 0.69 0.00 5.60 0.05 -1.80 1.68 116.97 123.34 2cps h TYR 24 Ca 0.63 0.03 0.00 0.00 0.05 0.00 0.00 58.73 59.44 2cps h TYR 24 Cb 1.37 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.91 2cps h TYR 24 CO -0.24 0.27 -0.89 0.00 -1.05 0.00 0.00 178.16 176.25 2cps n ALA 25 N -2.40 3.37 0.05 3.88 0.00 0.48 -3.56 120.51 122.33 2cps n ALA 25 Ca 0.11 -0.38 0.04 0.00 0.00 0.00 0.00 53.44 53.21 2cps n ALA 25 Cb 0.26 -1.02 -0.07 0.00 0.00 0.00 0.00 19.45 18.63 2cps n ALA 25 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 2cps n TRP 26 N -1.92 0.90 -0.08 0.00 -0.00 0.47 -3.95 117.44 112.85 2cps n TRP 26 Ca 0.03 0.29 -0.14 0.00 -0.00 0.00 0.00 57.50 57.67 2cps n TRP 26 Cb 0.42 -1.02 -0.08 0.00 -0.00 0.00 0.00 31.31 30.63 2cps n TRP 26 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2cps h ALA 27 N 1.61 0.12 -1.17 5.87 0.00 0.23 -3.24 119.26 122.68 2cps h ALA 27 Ca -0.12 -0.78 0.34 0.00 0.00 0.00 0.00 54.91 54.35 2cps h ALA 27 Cb 1.41 0.46 -0.05 0.00 0.00 0.00 0.00 17.79 19.60 2cps h ALA 27 CO 0.03 0.44 0.84 0.52 0.00 0.00 0.00 179.25 181.08 2cps h MET 28 N -1.00 0.00 -0.27 0.00 2.86 -1.72 1.03 114.93 115.83 2cps h MET 28 Ca -0.16 -0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.36 2cps h MET 28 Cb 0.93 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.59 2cps h MET 28 CO -0.10 0.00 -0.27 0.28 1.06 0.00 0.00 176.91 177.89 2cps h VAL 29 N 0.00 1.31 -0.18 -2.22 2.07 -1.69 -2.90 116.25 112.64 2cps h VAL 29 Ca 0.56 -1.43 -0.04 0.00 0.82 0.00 0.00 66.70 66.61 2cps h VAL 29 Cb 2.23 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 33.61 2cps h VAL 29 CO -0.01 0.45 -0.03 0.58 0.02 0.00 0.00 177.57 178.59 2cps h VAL 30 N 0.39 1.28 -0.63 2.57 2.07 0.94 -2.67 116.25 120.20 2cps h VAL 30 Ca 0.04 -0.97 0.18 0.00 0.82 0.00 0.00 66.70 66.78 2cps h VAL 30 Cb 0.83 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 32.12 2cps h VAL 30 CO 0.07 0.29 0.49 0.58 0.02 0.00 0.00 177.57 179.02 2cps h VAL 31 N 0.07 0.57 0.00 2.57 2.07 -0.83 0.91 116.25 121.61 2cps h VAL 31 Ca 0.05 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.42 2cps h VAL 31 Cb 0.45 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 2cps h VAL 31 CO 0.02 0.00 -0.70 0.40 0.02 0.00 0.00 177.57 177.30 2cps h ILE 32 N 0.00 1.47 0.00 4.57 2.04 -1.26 -2.89 117.51 121.44 2cps h ILE 32 Ca 0.30 -2.44 -0.14 0.00 1.00 0.00 0.00 64.86 63.58 2cps h ILE 32 Cb 1.29 2.33 -0.02 0.00 -0.74 0.00 0.00 36.82 39.67 2cps h ILE 32 CO -0.00 0.69 -0.84 0.58 0.00 0.00 0.00 178.15 178.58 2cps h VAL 33 N 0.00 0.93 -0.25 1.67 2.07 0.85 -3.26 116.25 118.27 2cps h VAL 33 Ca -0.01 -2.40 -0.11 0.00 0.82 0.00 0.00 66.70 65.00 2cps h VAL 33 Cb 1.27 2.41 -0.01 0.00 -1.52 0.00 0.00 31.29 33.44 2cps h VAL 33 CO 0.09 0.53 -0.29 1.23 0.02 0.00 0.00 177.57 179.15 2cps h GLY 34 N 3.46 0.55 0.88 2.17 0.00 -0.48 -2.36 103.07 107.28 2cps h GLY 34 Ca -0.05 -0.48 0.12 0.00 0.00 0.00 0.00 47.33 46.92 2cps h GLY 34 CO 0.07 0.43 0.45 0.00 0.00 0.00 0.00 176.54 177.50 2cps h ALA 35 N 1.25 2.07 -0.36 3.60 0.00 -1.55 0.83 119.26 125.10 2cps h ALA 35 Ca 0.06 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2cps h ALA 35 Cb 0.73 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2cps h ALA 35 CO 0.06 -0.24 -0.10 1.15 0.00 0.00 0.00 179.25 180.12 2cps h THR 36 N 0.40 1.28 0.00 0.00 2.02 -1.56 -2.25 112.91 112.80 2cps h THR 36 Ca 0.32 -1.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.30 2cps h THR 36 Cb 0.69 1.30 -0.00 0.00 -1.74 0.00 0.00 68.15 68.40 2cps h THR 36 CO -0.09 0.39 -0.04 0.40 0.37 0.00 0.00 175.52 176.55 2cps h ILE 37 N 0.50 0.40 0.00 3.11 2.04 -0.79 0.23 117.51 122.99 2cps h ILE 37 Ca 0.09 -0.21 -0.10 0.00 1.00 0.00 0.00 64.86 65.65 2cps h ILE 37 Cb 0.62 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 2cps h ILE 37 CO 0.04 0.04 -0.46 1.23 0.00 0.00 0.00 178.15 179.00 2cps h GLY 38 N 0.40 0.00 0.51 5.37 0.00 -0.68 -1.50 103.07 107.16 2cps h GLY 38 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.97 2cps h GLY 38 CO 0.01 0.00 -1.96 1.39 0.00 0.00 0.00 176.54 175.97 2cps n ILE 39 N -3.36 1.74 -0.05 2.60 2.08 -0.12 -2.71 119.36 119.55 2cps n ILE 39 Ca 0.01 -0.59 -0.10 0.00 0.56 0.00 0.00 62.75 62.63 2cps n ILE 39 Cb 0.64 -1.75 -0.03 0.00 -0.75 0.00 0.00 39.64 37.74 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 -0.05 0.28 -0.52 0.38 1.63 -0.70 -1.94 116.57 115.66 2cps h LYS 40 Ca -0.43 -0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 59.31 2cps h LYS 40 Cb 1.95 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 33.50 2cps h LYS 40 CO 0.04 0.21 0.16 -0.07 -3.45 0.00 0.00 179.45 176.35 2cps h LEU 41 N 0.27 0.75 -0.78 5.20 3.38 -1.44 -2.80 115.31 119.90 2cps h LEU 41 Ca 0.08 -0.20 0.17 0.00 0.09 0.00 0.00 57.88 58.01 2cps h LEU 41 Cb -0.00 -0.20 -0.11 0.00 0.09 0.00 0.00 40.66 40.44 2cps h LEU 41 CO -0.02 0.76 0.26 0.15 0.09 0.00 0.00 178.44 179.69 2cps h PHE 42 N 0.71 0.43 0.00 1.13 3.04 -1.24 0.71 116.94 121.72 2cps h PHE 42 Ca 0.17 0.04 0.00 0.00 3.98 0.00 0.00 57.97 62.16 2cps h PHE 42 Cb 0.27 -0.07 0.00 0.00 2.56 0.00 0.00 35.95 38.71 2cps h PHE 42 CO 0.02 -0.03 0.00 0.87 -2.02 0.00 0.00 178.31 177.15 2cps h LYS 43 N 0.36 0.00 0.00 1.11 1.79 -1.09 -0.94 116.57 117.80 2cps h LYS 43 Ca 0.45 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.84 2cps h LYS 43 Cb 0.76 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.40 2cps h LYS 43 CO -0.48 0.00 -0.57 -0.22 -1.08 0.00 0.00 179.45 177.10 2cps h LYS 44 N 0.00 0.00 0.00 3.15 3.11 0.42 -3.23 116.57 120.02 2cps h LYS 44 Ca 0.00 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2cps h LYS 44 Cb 0.25 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.48 2cps h LYS 44 CO 0.00 0.55 -0.01 0.74 -2.81 0.00 0.00 179.45 177.93 2cps h PHE 45 N -1.00 0.00 -0.38 1.91 0.04 -1.13 0.33 116.94 116.71 2cps h PHE 45 Ca -0.12 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.65 2cps h PHE 45 Cb 0.79 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.94 2cps h PHE 45 CO 0.03 0.01 0.00 0.25 -0.60 0.00 0.00 178.31 178.00 2cps n THR 46 N -4.10 1.60 -2.67 -1.55 -2.24 -0.36 -4.04 114.28 100.91 2cps n THR 46 Ca -0.03 -0.85 -0.05 0.00 -2.27 0.00 0.00 64.05 60.85 2cps n THR 46 Cb 0.09 -0.26 0.03 0.00 -2.10 0.00 0.00 70.33 68.10 2cps n THR 46 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2cps n SER 47 N 0.48 -1.38 -0.26 3.42 2.88 0.86 -4.98 113.62 114.64 2cps n SER 47 Ca 0.17 -1.94 0.06 0.00 -1.33 0.00 0.00 58.87 55.84 2cps n SER 47 Cb 0.79 1.06 0.19 0.00 -0.75 0.00 0.00 64.21 65.49 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 1.53 0.19 -5.08 -1.46 1.57 -0.87 -3.39 116.57 109.05 2cps h LYS 48 Ca -0.47 -0.01 -0.35 0.00 -1.87 0.00 0.00 60.65 57.95 2cps h LYS 48 Cb 1.25 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 33.43 2cps h LYS 48 CO -0.15 0.12 1.69 0.00 -0.57 0.00 0.00 179.45 180.55 2cps n ALA 49 N -2.77 0.81 0.00 3.86 0.00 -1.26 -5.03 120.51 116.12 2cps n ALA 49 Ca 0.15 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.82 2cps n ALA 49 Cb 0.50 -2.53 0.00 0.00 0.00 0.00 0.00 19.45 17.42 2cps n ALA 49 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37