#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 1.34 -3.68 0.00 0.28 -1.26 -4.82 120.64 112.50 2cps n GLU 2 Ca 0.00 -1.34 -0.39 0.00 -0.16 0.00 0.00 57.16 55.27 2cps n GLU 2 Cb 0.00 -2.50 -0.12 0.00 1.43 0.00 0.00 31.44 30.25 2cps n GLU 2 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2cps s GLY 3 N 4.47 1.86 -0.15 -1.84 0.00 -1.26 -4.93 107.32 105.46 2cps s GLY 3 Ca 0.40 -1.57 0.16 0.00 0.00 0.00 0.00 44.72 43.71 2cps s GLY 3 CO 0.05 0.74 1.41 1.34 0.00 0.00 0.00 173.10 176.64 2cps n ASP 4 N 4.92 3.80 -2.96 1.64 2.03 -1.26 -5.04 116.55 119.68 2cps n ASP 4 Ca -0.13 -2.87 -0.01 0.00 0.52 0.00 0.00 54.79 52.29 2cps n ASP 4 Cb 0.47 -0.50 -0.01 0.00 -0.72 0.00 0.00 41.12 40.36 2cps n ASP 4 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2cps n ASP 5 N -0.34 -6.14 -0.66 1.67 -0.08 -1.26 -4.72 116.55 105.02 2cps n ASP 5 Ca 0.20 0.94 0.03 0.00 -1.51 0.00 0.00 54.79 54.45 2cps n ASP 5 Cb 0.84 -3.04 0.12 0.00 2.34 0.00 0.00 41.12 41.37 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 1.55 1.85 0.00 -0.67 -0.04 -1.26 -3.58 135.00 132.85 2cps n PRO 6 Ca -0.07 -0.93 0.00 0.00 -0.04 0.00 0.00 63.50 62.46 2cps n PRO 6 Cb 0.29 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.32 2cps n PRO 6 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cps n ALA 7 N 0.20 0.00 0.08 0.55 0.00 -1.26 -4.46 120.51 115.62 2cps n ALA 7 Ca 0.08 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.35 2cps n ALA 7 Cb 0.35 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.66 2cps n ALA 7 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2cps h LYS 8 N 0.00 0.28 0.12 0.00 2.10 -1.97 -3.33 116.57 113.77 2cps h LYS 8 Ca 0.00 -0.48 0.01 0.00 -2.00 0.00 0.00 60.65 58.18 2cps h LYS 8 Cb 0.00 0.18 -0.04 0.00 -0.90 0.00 0.00 32.23 31.47 2cps h LYS 8 CO 0.00 1.16 -0.41 0.00 -2.00 0.00 0.00 179.45 178.20 2cps h ALA 9 N 0.47 -0.92 -0.80 0.07 0.00 -1.86 0.17 119.26 116.40 2cps h ALA 9 Ca -0.22 -0.09 0.19 0.00 0.00 0.00 0.00 54.91 54.79 2cps h ALA 9 Cb 2.02 0.79 -0.13 0.00 0.00 0.00 0.00 17.79 20.47 2cps h ALA 9 CO 0.18 -1.01 0.11 0.00 0.00 0.00 0.00 179.25 178.52 2cps h ALA 10 N -0.80 0.98 -0.77 0.00 0.00 -1.73 0.75 119.26 117.70 2cps h ALA 10 Ca -0.01 0.23 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 2cps h ALA 10 Cb 0.60 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 2cps h ALA 10 CO -0.21 -0.43 0.29 0.35 0.00 0.00 0.00 179.25 179.25 2cps h PHE 11 N 0.16 1.18 0.00 0.00 3.04 -1.51 -2.24 116.94 117.57 2cps h PHE 11 Ca 0.46 -0.10 -0.09 0.00 3.98 0.00 0.00 57.97 62.22 2cps h PHE 11 Cb 0.86 -0.35 -0.01 0.00 2.56 0.00 0.00 35.95 39.00 2cps h PHE 11 CO -0.35 0.90 -0.45 -0.91 -2.02 0.00 0.00 178.31 175.48 2cps h ASN 12 N 1.12 0.00 0.07 0.41 4.21 0.26 -2.96 115.58 118.69 2cps h ASN 12 Ca 0.25 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.76 2cps h ASN 12 Cb 0.24 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.44 2cps h ASN 12 CO -0.02 0.45 -0.00 0.28 -1.29 0.00 0.00 177.43 176.85 2cps h SER 13 N 0.00 0.00 0.14 5.81 0.02 0.94 -0.60 113.55 119.85 2cps h SER 13 Ca -0.00 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.68 2cps h SER 13 Cb 1.02 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.57 2cps h SER 13 CO 0.06 0.00 -1.31 -0.07 -1.14 0.00 0.00 176.83 174.37 2cps h LEU 14 N 0.00 0.45 -1.28 5.07 3.38 -1.53 -3.33 115.31 118.08 2cps h LEU 14 Ca -0.00 -0.89 -0.05 0.00 0.09 0.00 0.00 57.88 57.03 2cps h LEU 14 Cb 0.04 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2cps h LEU 14 CO 0.00 1.59 -0.25 -0.61 0.09 0.00 0.00 178.44 179.26 2cps h GLN 15 N -0.25 0.00 0.00 1.13 5.75 -1.48 -2.48 115.11 117.78 2cps h GLN 15 Ca -0.27 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.23 2cps h GLN 15 Cb 1.79 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.34 2cps h GLN 15 CO 0.11 0.25 0.00 0.00 -2.65 0.00 0.00 178.83 176.54 2cps n ALA 16 N -2.28 2.24 -1.18 3.38 0.00 -0.29 -3.52 120.51 118.86 2cps n ALA 16 Ca -0.01 -0.12 -0.25 0.00 0.00 0.00 0.00 53.44 53.06 2cps n ALA 16 Cb 0.40 -1.35 0.03 0.00 0.00 0.00 0.00 19.45 18.53 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 -1.10 6.88 -3.98 0.00 2.88 -0.93 -4.72 113.62 112.66 2cps n SER 17 Ca 0.14 -3.34 -0.43 0.00 -1.33 0.00 0.00 58.87 53.92 2cps n SER 17 Cb 0.11 -1.07 0.01 0.00 -0.75 0.00 0.00 64.21 62.51 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 0.04 5.21 0.37 -1.46 0.00 -1.23 -4.80 120.51 118.63 2cps n ALA 18 Ca 0.44 -4.80 0.04 0.00 0.00 0.00 0.00 53.44 49.12 2cps n ALA 18 Cb 0.57 -2.32 0.20 0.00 0.00 0.00 0.00 19.45 17.91 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 1.24 0.99 1.08 0.00 5.66 -1.26 -1.49 114.28 120.50 2cps n THR 19 Ca 0.27 0.25 0.12 0.00 -3.05 0.00 0.00 64.05 61.64 2cps n THR 19 Cb 0.33 -1.11 0.31 0.00 -1.55 0.00 0.00 70.33 68.31 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 -1.34 0.26 -0.00 1.09 0.00 -1.26 -3.88 120.64 115.51 2cps n GLU 20 Ca 0.03 -0.15 0.04 0.00 0.00 0.00 0.00 57.16 57.09 2cps n GLU 20 Cb 0.07 -1.50 -0.05 0.00 0.00 0.00 0.00 31.44 29.96 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 -1.24 0.00 -2.91 4.31 4.01 -0.56 -4.80 117.16 115.98 2cps n TYR 21 Ca 0.08 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.38 2cps n TYR 21 Cb 0.34 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.31 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 -1.36 4.35 0.00 -0.72 2.08 -1.16 -3.80 119.36 118.75 2cps n ILE 22 Ca 0.01 -4.80 0.00 0.00 0.56 0.00 0.00 62.75 58.51 2cps n ILE 22 Cb 0.16 -2.45 0.00 0.00 -0.75 0.00 0.00 39.64 36.59 2cps n ILE 22 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2cps n GLY 23 N 3.61 -1.29 0.22 7.39 0.00 -1.26 -4.94 105.19 108.91 2cps n GLY 23 Ca 0.35 0.45 0.08 0.00 0.00 0.00 0.00 46.02 46.90 2cps n GLY 23 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2cps h TYR 24 N 0.00 0.00 -0.07 1.61 0.05 -1.87 -2.61 116.97 114.08 2cps h TYR 24 Ca 0.00 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.67 2cps h TYR 24 Cb 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.73 2cps h TYR 24 CO 0.00 0.27 -0.44 0.00 -1.05 0.00 0.00 178.16 176.94 2cps h ALA 25 N 1.73 1.12 -0.53 3.88 0.00 -1.93 -2.78 119.26 120.76 2cps h ALA 25 Ca -0.00 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.39 2cps h ALA 25 Cb 0.66 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2cps h ALA 25 CO 0.04 0.60 -0.03 -1.49 0.00 0.00 0.00 179.25 178.36 2cps h TRP 26 N 0.14 1.05 -0.52 0.00 4.06 -1.78 -2.11 115.95 116.78 2cps h TRP 26 Ca 0.01 -0.19 -0.03 0.00 2.06 0.00 0.00 58.89 60.73 2cps h TRP 26 Cb 0.84 -0.27 -0.02 0.00 -1.00 0.00 0.00 29.16 28.71 2cps h TRP 26 CO 0.01 0.97 0.19 0.00 -3.56 0.00 0.00 178.44 176.05 2cps h ALA 27 N 0.94 1.37 -0.45 1.49 0.00 -1.50 -2.07 119.26 119.04 2cps h ALA 27 Ca 0.15 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2cps h ALA 27 Cb 0.57 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2cps h ALA 27 CO 0.03 0.47 -0.11 1.98 0.00 0.00 0.00 179.25 181.62 2cps h MET 28 N 0.74 0.81 -0.52 0.00 -1.53 -1.21 -2.83 114.93 110.39 2cps h MET 28 Ca 0.18 -0.27 0.01 0.00 -3.44 0.00 0.00 59.70 56.17 2cps h MET 28 Cb 0.17 -0.07 -0.03 0.00 -0.55 0.00 0.00 31.60 31.13 2cps h MET 28 CO -0.01 0.88 0.34 0.28 0.14 0.00 0.00 176.91 178.53 2cps h VAL 29 N 0.73 1.11 -0.43 -5.77 2.07 -0.71 -1.52 116.25 111.73 2cps h VAL 29 Ca 0.12 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.41 2cps h VAL 29 Cb 0.60 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 2cps h VAL 29 CO 0.04 0.12 0.28 0.58 0.02 0.00 0.00 177.57 178.61 2cps h VAL 30 N 0.68 1.11 0.00 2.57 2.07 -1.30 0.95 116.25 122.33 2cps h VAL 30 Ca 0.20 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2cps h VAL 30 Cb -0.05 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 2cps h VAL 30 CO -0.06 0.11 0.00 0.52 0.02 0.00 0.00 177.57 178.17 2cps n VAL 31 N -4.46 0.75 -0.09 2.57 0.31 -0.61 0.09 118.33 116.88 2cps n VAL 31 Ca 0.03 0.12 -0.23 0.00 -0.01 0.00 0.00 64.34 64.26 2cps n VAL 31 Cb 0.06 -0.97 -0.12 0.00 -0.91 0.00 0.00 33.84 31.91 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 -2.04 1.58 -0.05 2.52 5.41 0.24 -3.69 119.36 123.34 2cps n ILE 32 Ca 0.03 -0.19 -0.01 0.00 1.00 0.00 0.00 62.75 63.59 2cps n ILE 32 Cb 0.26 -1.96 -0.00 0.00 -0.71 0.00 0.00 39.64 37.23 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 -0.79 0.00 -0.72 1.39 2.07 -1.30 -3.31 116.25 113.59 2cps h VAL 33 Ca -0.41 -0.86 0.21 0.00 0.82 0.00 0.00 66.70 66.46 2cps h VAL 33 Cb 1.48 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 2cps h VAL 33 CO -0.18 0.00 0.72 1.23 0.02 0.00 0.00 177.57 179.36 2cps h GLY 34 N -0.86 0.00 2.00 2.17 0.00 -0.58 1.29 103.07 107.10 2cps h GLY 34 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2cps h GLY 34 CO 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 176.54 176.34 2cps h ALA 35 N 1.23 1.07 0.03 3.60 0.00 -1.63 -3.10 119.26 120.46 2cps h ALA 35 Ca 0.34 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 2cps h ALA 35 Cb 1.78 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.54 2cps h ALA 35 CO -0.00 0.25 -0.45 0.00 0.00 0.00 0.00 179.25 179.05 2cps h THR 36 N 0.00 1.55 -1.10 0.00 1.03 0.16 -3.29 112.91 111.25 2cps h THR 36 Ca -0.00 -2.36 0.30 0.00 -0.01 0.00 0.00 66.41 64.34 2cps h THR 36 Cb 0.66 3.12 -0.08 0.00 -1.07 0.00 0.00 68.15 70.78 2cps h THR 36 CO 0.03 0.59 0.74 0.40 -0.01 0.00 0.00 175.52 177.26 2cps h ILE 37 N -0.84 0.46 0.46 0.00 2.04 -1.48 0.67 117.51 118.82 2cps h ILE 37 Ca -0.10 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 2cps h ILE 37 Cb 1.21 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 2cps h ILE 37 CO -0.01 0.04 -0.22 1.23 0.00 0.00 0.00 178.15 179.20 2cps h GLY 38 N 0.24 -0.64 1.65 5.37 0.00 -1.64 -0.03 103.07 108.03 2cps h GLY 38 Ca 0.60 0.24 -0.02 0.00 0.00 0.00 0.00 47.33 48.14 2cps h GLY 38 CO -0.21 -0.23 0.10 -2.22 0.00 0.00 0.00 176.54 173.97 2cps h ILE 39 N -0.75 1.14 -0.03 2.60 2.04 -1.42 -2.48 117.51 118.60 2cps h ILE 39 Ca -0.06 -0.47 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 2cps h ILE 39 Cb 0.47 0.80 -0.00 0.00 -0.74 0.00 0.00 36.82 37.35 2cps h ILE 39 CO 0.10 0.17 0.01 0.50 0.00 0.00 0.00 178.15 178.94 2cps h LYS 40 N 0.45 0.05 -0.12 2.37 1.63 0.33 -2.18 116.57 119.09 2cps h LYS 40 Ca 0.11 -0.01 0.04 0.00 -0.85 0.00 0.00 60.65 59.94 2cps h LYS 40 Cb 0.14 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.76 2cps h LYS 40 CO -0.01 0.18 0.11 -0.07 -3.45 0.00 0.00 179.45 176.21 2cps h LEU 41 N -0.10 0.00 -0.20 5.20 3.38 -0.59 -1.80 115.31 121.20 2cps h LEU 41 Ca 0.01 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 2cps h LEU 41 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2cps h LEU 41 CO -0.00 0.00 -0.34 0.15 0.09 0.00 0.00 178.44 178.34 2cps h PHE 42 N 0.00 0.72 -0.76 1.13 3.57 -0.98 -3.05 116.94 117.57 2cps h PHE 42 Ca 0.06 -0.25 -0.03 0.00 3.53 0.00 0.00 57.97 61.28 2cps h PHE 42 Cb 0.27 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.84 2cps h PHE 42 CO 0.00 0.99 0.36 0.87 -2.23 0.00 0.00 178.31 178.30 2cps h LYS 43 N 0.25 1.09 0.06 1.11 1.79 -0.85 -0.03 116.57 120.00 2cps h LYS 43 Ca 0.01 -0.15 -0.00 0.00 -2.18 0.00 0.00 60.65 58.32 2cps h LYS 43 Cb 0.93 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.39 2cps h LYS 43 CO 0.08 0.84 -0.03 -0.22 -1.08 0.00 0.00 179.45 179.04 2cps h LYS 44 N 1.08 -0.08 0.00 3.15 3.11 -1.49 1.23 116.57 123.57 2cps h LYS 44 Ca 0.26 0.01 -0.07 0.00 -2.81 0.00 0.00 60.65 58.04 2cps h LYS 44 Cb 0.11 0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.35 2cps h LYS 44 CO -0.03 -0.03 -0.32 0.74 -2.81 0.00 0.00 179.45 176.99 2cps h PHE 45 N -0.11 0.00 -0.01 1.91 0.04 -1.41 -2.86 116.94 114.50 2cps h PHE 45 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 2cps h PHE 45 Cb 0.09 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.24 2cps h PHE 45 CO -0.07 0.32 -0.49 0.25 -0.60 0.00 0.00 178.31 177.72 2cps n THR 46 N -3.55 0.00 -0.15 -1.55 -2.24 -0.04 -4.08 114.28 102.68 2cps n THR 46 Ca -0.00 -0.16 0.05 0.00 -2.27 0.00 0.00 64.05 61.67 2cps n THR 46 Cb 0.46 0.87 0.14 0.00 -2.10 0.00 0.00 70.33 69.70 2cps n THR 46 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2cps n SER 47 N -0.56 2.82 0.37 3.42 7.64 0.42 -4.68 113.62 123.06 2cps n SER 47 Ca 0.09 -1.99 -0.17 0.00 1.01 0.00 0.00 58.87 57.81 2cps n SER 47 Cb 0.40 -0.21 -0.09 0.00 -1.01 0.00 0.00 64.21 63.31 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 1.85 -0.92 -6.42 1.43 1.79 -1.66 -3.47 116.57 109.18 2cps h LYS 48 Ca 0.00 0.06 -0.48 0.00 -2.18 0.00 0.00 60.65 58.05 2cps h LYS 48 Cb 0.71 0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 31.55 2cps h LYS 48 CO 0.00 -0.58 -0.90 0.00 -1.08 0.00 0.00 179.45 176.89 2cps n ALA 49 N -2.58 -2.13 0.87 3.86 0.00 -1.26 -5.16 120.51 114.11 2cps n ALA 49 Ca -0.13 -0.26 0.07 0.00 0.00 0.00 0.00 53.44 53.11 2cps n ALA 49 Cb 0.39 -2.04 0.41 0.00 0.00 0.00 0.00 19.45 18.22 2cps n ALA 49 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95