#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 -3.04 -1.61 0.00 4.07 -1.26 -4.92 120.64 113.87 2cps n GLU 2 Ca 0.00 2.46 0.00 0.00 -0.06 0.00 0.00 57.16 59.56 2cps n GLU 2 Cb 0.00 -3.75 0.00 0.00 -0.06 0.00 0.00 31.44 27.63 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 1.09 -4.41 0.32 8.31 0.00 -1.26 -4.48 105.19 104.76 2cps n GLY 3 Ca -0.27 -0.76 0.17 0.00 0.00 0.00 0.00 46.02 45.16 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 0.99 0.00 -0.20 1.61 3.58 -2.10 -3.42 116.42 116.89 2cps h ASP 4 Ca 0.00 0.00 -0.49 0.00 0.42 0.00 0.00 57.03 56.96 2cps h ASP 4 Cb 0.45 0.00 -0.08 0.00 1.72 0.00 0.00 39.33 41.42 2cps h ASP 4 CO 0.00 0.00 1.75 -0.67 -2.88 0.00 0.00 179.24 177.44 2cps n ASP 5 N -3.65 0.47 0.13 2.28 -0.08 -1.26 -4.74 116.55 109.69 2cps n ASP 5 Ca -0.01 0.05 0.11 0.00 -1.51 0.00 0.00 54.79 53.42 2cps n ASP 5 Cb 0.19 -0.99 0.03 0.00 2.34 0.00 0.00 41.12 42.69 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 12.91 0.00 0.00 -0.67 0.13 -1.93 -3.33 132.00 139.12 2cps h PRO 6 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2cps h PRO 6 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2cps h PRO 6 CO 1.37 0.02 0.00 0.00 -0.23 0.00 0.00 178.00 179.16 2cps h ALA 7 N 1.96 1.00 -1.58 -0.56 0.00 -1.98 -2.94 119.26 115.16 2cps h ALA 7 Ca -0.01 0.00 0.49 0.00 0.00 0.00 0.00 54.91 55.39 2cps h ALA 7 Cb 1.03 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.72 2cps h ALA 7 CO 0.00 0.00 1.08 1.57 0.00 0.00 0.00 179.25 181.91 2cps h LYS 8 N 0.00 0.03 0.17 0.00 2.10 -1.96 1.13 116.57 118.03 2cps h LYS 8 Ca 0.00 -0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 2cps h LYS 8 Cb 0.02 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.34 2cps h LYS 8 CO 0.00 0.02 -0.08 0.00 -2.00 0.00 0.00 179.45 177.39 2cps h ALA 9 N 1.36 -0.34 -0.34 0.07 0.00 -1.85 -2.88 119.26 115.28 2cps h ALA 9 Ca 0.86 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.82 2cps h ALA 9 Cb 3.08 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 20.94 2cps h ALA 9 CO -0.24 -0.32 0.24 0.00 0.00 0.00 0.00 179.25 178.93 2cps h ALA 10 N -1.47 2.28 -0.46 0.00 0.00 -1.28 -0.30 119.26 118.03 2cps h ALA 10 Ca -0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2cps h ALA 10 Cb 0.17 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2cps h ALA 10 CO 0.04 -0.37 0.15 0.35 0.00 0.00 0.00 179.25 179.41 2cps h PHE 11 N 0.03 0.73 -0.09 0.00 3.04 0.11 0.88 116.94 121.65 2cps h PHE 11 Ca 0.16 -0.07 -0.22 0.00 3.98 0.00 0.00 57.97 61.82 2cps h PHE 11 Cb 0.60 -0.21 0.01 0.00 2.56 0.00 0.00 35.95 38.91 2cps h PHE 11 CO -0.00 0.65 -0.78 -0.97 -2.02 0.00 0.00 178.31 175.19 2cps h ASN 12 N 0.60 0.85 0.20 0.41 -1.24 -0.98 -2.30 115.58 113.12 2cps h ASN 12 Ca 0.15 -0.67 -0.20 0.00 0.71 0.00 0.00 56.30 56.29 2cps h ASN 12 Cb 0.26 -0.25 -0.00 0.00 0.73 0.00 0.00 38.32 39.06 2cps h ASN 12 CO -0.01 1.39 -0.78 0.28 -1.29 0.00 0.00 177.43 177.02 2cps h SER 13 N 0.37 0.58 -0.35 1.15 0.02 -1.04 -3.24 113.55 111.04 2cps h SER 13 Ca -0.07 -0.40 -0.14 0.00 -0.84 0.00 0.00 61.79 60.34 2cps h SER 13 Cb 1.43 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.79 2cps h SER 13 CO 0.16 1.16 -0.32 0.25 -1.14 0.00 0.00 176.83 176.93 2cps h LEU 14 N 0.32 0.89 -1.38 5.07 5.85 0.73 -3.02 115.31 123.76 2cps h LEU 14 Ca -0.04 -0.46 0.16 0.00 0.84 0.00 0.00 57.88 58.38 2cps h LEU 14 Cb 1.38 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 42.09 2cps h LEU 14 CO 0.14 1.17 0.57 -0.61 -0.34 0.00 0.00 178.44 179.37 2cps h GLN 15 N 0.62 0.55 0.00 1.25 4.15 -1.45 0.71 115.11 120.95 2cps h GLN 15 Ca 0.06 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.45 2cps h GLN 15 Cb 0.91 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.47 2cps h GLN 15 CO 0.08 0.36 0.00 0.00 -1.93 0.00 0.00 178.83 177.35 2cps n ALA 16 N -2.46 1.78 -0.07 3.38 0.00 -1.14 -3.13 120.51 118.87 2cps n ALA 16 Ca 0.18 0.05 -0.08 0.00 0.00 0.00 0.00 53.44 53.59 2cps n ALA 16 Cb 0.55 -1.39 -0.11 0.00 0.00 0.00 0.00 19.45 18.51 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 -2.16 1.72 -3.86 0.00 3.41 0.18 -4.67 113.62 108.25 2cps n SER 17 Ca 0.03 -0.02 -0.42 0.00 -0.26 0.00 0.00 58.87 58.20 2cps n SER 17 Cb 0.26 0.66 0.01 0.00 -0.26 0.00 0.00 64.21 64.88 2cps n SER 17 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cps n ALA 18 N -2.60 5.50 0.76 7.33 0.00 0.19 -4.77 120.51 126.91 2cps n ALA 18 Ca -0.24 -4.74 0.07 0.00 0.00 0.00 0.00 53.44 48.53 2cps n ALA 18 Cb 0.94 -2.27 0.39 0.00 0.00 0.00 0.00 19.45 18.51 2cps n ALA 18 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2cps n THR 19 N 0.80 0.45 1.94 0.00 5.66 -1.25 -2.34 114.28 119.55 2cps n THR 19 Ca 0.34 0.11 0.16 0.00 -3.05 0.00 0.00 64.05 61.61 2cps n THR 19 Cb 0.31 -0.87 0.92 0.00 -1.55 0.00 0.00 70.33 69.14 2cps n THR 19 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 2cps n GLU 20 N -1.22 1.00 0.00 1.09 2.13 -1.26 -2.96 120.64 119.41 2cps n GLU 20 Ca 0.08 -0.05 0.11 0.00 0.66 0.00 0.00 57.16 57.96 2cps n GLU 20 Cb 0.10 -1.50 0.08 0.00 0.27 0.00 0.00 31.44 30.40 2cps n GLU 20 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2cps n TYR 21 N -0.96 0.00 -2.92 4.31 4.02 -0.99 -4.68 117.16 115.95 2cps n TYR 21 Ca 0.23 0.00 -0.44 0.00 -0.01 0.00 0.00 57.90 57.68 2cps n TYR 21 Cb 0.13 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.45 2cps n TYR 21 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 2cps n ILE 22 N 1.13 4.29 0.00 -0.72 5.41 -1.16 -2.19 119.36 126.12 2cps n ILE 22 Ca 0.13 -4.75 0.00 0.00 1.00 0.00 0.00 62.75 59.13 2cps n ILE 22 Cb 0.55 -2.46 0.00 0.00 -0.71 0.00 0.00 39.64 37.02 2cps n ILE 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2cps n GLY 23 N 3.88 1.53 0.10 7.39 0.00 -1.26 -4.95 105.19 111.88 2cps n GLY 23 Ca 0.36 -0.08 -0.12 0.00 0.00 0.00 0.00 46.02 46.19 2cps n GLY 23 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2cps n TYR 24 N 0.00 0.76 0.23 1.61 4.01 -1.25 -4.05 117.16 118.49 2cps n TYR 24 Ca 0.00 0.25 0.09 0.00 -0.16 0.00 0.00 57.90 58.07 2cps n TYR 24 Cb 0.00 -1.13 0.57 0.00 -0.31 0.00 0.00 39.34 38.47 2cps n TYR 24 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2cps h ALA 25 N 0.79 1.32 -0.27 -0.72 0.00 -1.78 -2.76 119.26 115.83 2cps h ALA 25 Ca -0.38 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.32 2cps h ALA 25 Cb 2.06 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.81 2cps h ALA 25 CO 0.06 0.26 0.10 -1.49 0.00 0.00 0.00 179.25 178.17 2cps h TRP 26 N 0.00 0.42 0.00 0.00 4.06 -1.76 0.60 115.95 119.26 2cps h TRP 26 Ca -0.00 -0.04 -0.00 0.00 2.06 0.00 0.00 58.89 60.91 2cps h TRP 26 Cb 0.47 -0.12 -0.00 0.00 -1.00 0.00 0.00 29.16 28.51 2cps h TRP 26 CO 0.00 0.44 -0.02 0.00 -3.56 0.00 0.00 178.44 175.30 2cps h ALA 27 N 0.93 1.87 0.13 1.49 0.00 -1.66 -1.88 119.26 120.14 2cps h ALA 27 Ca 0.09 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.71 2cps h ALA 27 Cb 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2cps h ALA 27 CO -0.01 0.02 -1.35 0.52 0.00 0.00 0.00 179.25 178.44 2cps h MET 28 N 0.00 0.28 -0.81 0.00 2.86 -1.34 -3.30 114.93 112.62 2cps h MET 28 Ca -0.00 -0.47 0.13 0.00 -2.06 0.00 0.00 59.70 57.30 2cps h MET 28 Cb 0.03 0.18 -0.09 0.00 0.06 0.00 0.00 31.60 31.78 2cps h MET 28 CO 0.00 1.23 0.40 0.28 1.06 0.00 0.00 176.91 179.88 2cps h VAL 29 N -0.26 0.74 -0.84 -2.22 2.07 0.63 -0.68 116.25 115.69 2cps h VAL 29 Ca -0.28 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 2cps h VAL 29 Cb 1.79 0.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.61 2cps h VAL 29 CO 0.09 0.11 0.48 0.58 0.02 0.00 0.00 177.57 178.85 2cps h VAL 30 N 0.59 1.24 0.00 2.57 2.07 -1.49 -0.10 116.25 121.14 2cps h VAL 30 Ca 0.43 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 67.37 2cps h VAL 30 Cb 0.59 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2cps h VAL 30 CO -0.35 0.27 0.00 0.52 0.02 0.00 0.00 177.57 178.03 2cps n VAL 31 N -4.40 0.73 -0.11 2.57 0.31 -0.33 -3.33 118.33 113.77 2cps n VAL 31 Ca 0.09 0.14 -0.17 0.00 -0.01 0.00 0.00 64.34 64.38 2cps n VAL 31 Cb 0.08 -0.92 -0.13 0.00 -0.91 0.00 0.00 33.84 31.97 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 -1.83 1.51 -0.34 2.52 5.41 -0.65 -3.49 119.36 122.50 2cps n ILE 32 Ca 0.04 -0.61 0.21 0.00 1.00 0.00 0.00 62.75 63.38 2cps n ILE 32 Cb 0.25 -1.35 0.43 0.00 -0.71 0.00 0.00 39.64 38.25 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 0.01 0.39 0.00 1.39 2.07 -1.05 0.89 116.25 119.95 2cps h VAL 33 Ca -0.56 -0.14 -0.09 0.00 0.82 0.00 0.00 66.70 66.74 2cps h VAL 33 Cb 1.95 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 2cps h VAL 33 CO -0.06 0.08 -0.76 1.23 0.02 0.00 0.00 177.57 178.08 2cps h GLY 34 N 0.41 0.00 -0.12 2.17 0.00 -1.77 -3.30 103.07 100.45 2cps h GLY 34 Ca 0.69 0.00 0.30 0.00 0.00 0.00 0.00 47.33 48.31 2cps h GLY 34 CO -0.56 0.00 0.77 0.00 0.00 0.00 0.00 176.54 176.76 2cps h ALA 35 N -0.80 2.95 -0.04 3.60 0.00 -1.53 0.47 119.26 123.90 2cps h ALA 35 Ca -0.13 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2cps h ALA 35 Cb 0.79 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2cps h ALA 35 CO -0.08 -1.30 0.01 1.15 0.00 0.00 0.00 179.25 179.03 2cps h THR 36 N 0.00 1.21 -0.63 0.00 2.02 0.67 -2.26 112.91 113.91 2cps h THR 36 Ca 0.49 -0.62 0.01 0.00 0.77 0.00 0.00 66.41 67.06 2cps h THR 36 Cb 2.03 1.55 -0.03 0.00 -1.74 0.00 0.00 68.15 69.96 2cps h THR 36 CO -0.01 0.17 0.42 0.40 0.37 0.00 0.00 175.52 176.87 2cps h ILE 37 N -0.18 1.15 0.00 3.11 2.04 -0.18 -1.20 117.51 122.25 2cps h ILE 37 Ca 0.01 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.58 2cps h ILE 37 Cb 0.26 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2cps h ILE 37 CO 0.00 0.15 0.00 0.61 0.00 0.00 0.00 178.15 178.91 2cps n GLY 38 N -1.44 -2.27 0.42 5.37 0.00 -0.66 -1.57 105.19 105.04 2cps n GLY 38 Ca 0.07 0.00 0.24 0.00 0.00 0.00 0.00 46.02 46.32 2cps n GLY 38 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2cps h ILE 39 N 0.00 0.53 0.46 -0.61 2.04 -1.40 -0.45 117.51 118.08 2cps h ILE 39 Ca 0.00 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 2cps h ILE 39 Cb 0.00 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.24 2cps h ILE 39 CO 0.00 0.06 -0.22 0.50 0.00 0.00 0.00 178.15 178.49 2cps h LYS 40 N 0.35 -0.59 -0.62 2.37 1.63 -1.14 -2.07 116.57 116.49 2cps h LYS 40 Ca 0.57 0.04 0.18 0.00 -0.85 0.00 0.00 60.65 60.59 2cps h LYS 40 Cb 1.54 0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 33.28 2cps h LYS 40 CO -0.25 -0.37 0.54 -0.07 -3.45 0.00 0.00 179.45 175.86 2cps h LEU 41 N -0.65 0.00 0.02 5.20 3.38 -0.05 -1.11 115.31 122.10 2cps h LEU 41 Ca -0.06 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2cps h LEU 41 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2cps h LEU 41 CO 0.10 0.00 -0.01 0.15 0.09 0.00 0.00 178.44 178.77 2cps h PHE 42 N 0.00 -0.03 0.00 1.13 3.57 -1.02 -3.10 116.94 117.49 2cps h PHE 42 Ca 0.30 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.79 2cps h PHE 42 Cb 1.38 0.01 0.00 0.00 2.79 0.00 0.00 35.95 40.13 2cps h PHE 42 CO 0.00 0.51 0.16 0.87 -2.23 0.00 0.00 178.31 177.62 2cps h LYS 43 N -0.59 0.00 0.19 1.11 1.79 -0.82 0.29 116.57 118.54 2cps h LYS 43 Ca -0.00 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.14 2cps h LYS 43 Cb 0.55 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.22 2cps h LYS 43 CO 0.01 0.00 -1.59 0.87 -1.08 0.00 0.00 179.45 177.66 2cps h LYS 44 N 0.00 0.41 0.18 3.15 6.56 -1.49 -1.57 116.57 123.81 2cps h LYS 44 Ca 0.00 -0.69 -0.31 0.00 -1.06 0.00 0.00 60.65 58.59 2cps h LYS 44 Cb 0.32 0.26 0.01 0.00 -0.57 0.00 0.00 32.23 32.26 2cps h LYS 44 CO 0.00 1.33 -1.48 0.74 -2.06 0.00 0.00 179.45 177.98 2cps h PHE 45 N 0.03 0.69 0.14 -1.35 0.04 -1.20 -2.83 116.94 112.45 2cps h PHE 45 Ca -0.31 -0.50 -0.26 0.00 2.80 0.00 0.00 57.97 59.70 2cps h PHE 45 Cb 2.04 -0.03 0.01 0.00 2.20 0.00 0.00 35.95 40.17 2cps h PHE 45 CO 0.12 1.58 -1.25 1.79 -0.60 0.00 0.00 178.31 179.95 2cps h THR 46 N -0.05 1.19 -1.96 -1.55 1.35 -0.66 -3.35 112.91 107.88 2cps h THR 46 Ca -0.29 -2.47 -0.73 0.00 -0.55 0.00 0.00 66.41 62.38 2cps h THR 46 Cb 1.97 2.89 -0.31 0.00 -1.73 0.00 0.00 68.15 70.96 2cps h THR 46 CO 0.17 0.72 0.56 -1.20 -0.25 0.00 0.00 175.52 175.52 2cps n SER 47 N -3.96 6.69 -0.18 5.36 7.64 -0.59 -4.79 113.62 123.79 2cps n SER 47 Ca -0.21 -3.78 -0.01 0.00 1.01 0.00 0.00 58.87 55.88 2cps n SER 47 Cb 0.90 -0.92 0.08 0.00 -1.01 0.00 0.00 64.21 63.25 2cps n SER 47 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2cps h LYS 48 N 3.12 0.11 -1.01 1.43 1.57 -1.52 0.85 116.57 121.13 2cps h LYS 48 Ca 0.48 -0.01 0.23 0.00 -1.87 0.00 0.00 60.65 59.48 2cps h LYS 48 Cb 0.30 -0.02 -0.11 0.00 0.08 0.00 0.00 32.23 32.47 2cps h LYS 48 CO 1.23 0.07 0.62 0.00 -0.57 0.00 0.00 179.45 180.79 2cps h ALA 49 N 1.50 1.87 0.00 3.86 0.00 -1.86 -3.49 119.26 121.14 2cps h ALA 49 Ca 0.28 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2cps h ALA 49 Cb 0.44 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2cps h ALA 49 CO -0.47 -0.29 0.00 -1.13 0.00 0.00 0.00 179.25 177.35