#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bal s ALA 2 N 0.00 0.36 0.00 2.98 0.00 -1.26 -4.85 121.76 118.99 1bal s ALA 2 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 50.66 1bal s ALA 2 Cb 0.00 -1.69 0.00 0.00 0.00 0.00 0.00 23.12 21.43 1bal s ALA 2 CO 0.00 -1.97 0.00 0.45 0.00 0.00 0.00 175.76 174.24 1bal n SER 3 N 4.50 0.00 0.00 0.00 2.88 -1.26 -4.91 113.62 114.83 1bal n SER 3 Ca 0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.60 1bal n SER 3 Cb 0.41 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.87 1bal n SER 3 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1bal n LEU 4 N 0.00 0.00 -0.66 2.46 7.94 -1.26 -4.77 117.00 120.71 1bal n LEU 4 Ca 0.00 -0.17 0.06 0.00 -1.11 0.00 0.00 56.01 54.79 1bal n LEU 4 Cb 0.00 0.00 0.18 0.00 0.53 0.00 0.00 43.42 44.13 1bal n LEU 4 CO 0.00 0.18 0.64 -0.62 -1.11 0.00 0.00 177.39 176.49 1bal n GLU 5 N 0.00 2.85 0.00 1.96 4.71 -1.26 -4.53 120.64 124.37 1bal n GLU 5 Ca 0.00 -2.29 0.00 0.00 -0.01 0.00 0.00 57.16 54.86 1bal n GLU 5 Cb 0.47 -1.45 0.00 0.00 -1.01 0.00 0.00 31.44 29.45 1bal n GLU 5 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1bal n GLU 6 N 0.04 2.73 -1.55 3.49 1.02 -1.26 -5.02 120.64 120.09 1bal n GLU 6 Ca 0.14 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 57.06 1bal n GLU 6 Cb 0.57 -0.23 -0.07 0.00 -0.02 0.00 0.00 31.44 31.70 1bal n GLU 6 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1bal n GLN 7 N 0.00 0.65 -0.02 3.49 -0.06 -1.26 -4.70 117.38 115.48 1bal n GLN 7 Ca 0.00 -0.50 0.06 0.00 -2.00 0.00 0.00 57.00 54.56 1bal n GLN 7 Cb 0.00 -3.35 0.31 0.00 -4.06 0.00 0.00 30.24 23.14 1bal n GLN 7 CO 0.00 0.00 0.00 -1.71 -0.20 0.00 0.00 177.06 175.15 1bal n ASN 8 N 16.65 0.23 -1.32 1.69 5.15 -1.26 -4.04 115.26 132.37 1bal n ASN 8 Ca 0.46 -1.69 0.00 0.00 -0.60 0.00 0.00 54.58 52.75 1bal n ASN 8 Cb 0.43 -0.02 0.00 0.00 -0.53 0.00 0.00 39.78 39.66 1bal n ASN 8 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1bal n ASN 9 N -0.53 4.45 -4.81 1.20 4.05 -1.26 -4.83 115.26 113.54 1bal n ASN 9 Ca 0.09 -2.25 -0.36 0.00 0.45 0.00 0.00 54.58 52.51 1bal n ASN 9 Cb 0.07 -0.89 -0.07 0.00 1.23 0.00 0.00 39.78 40.12 1bal n ASN 9 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1bal s ASP 10 N 1.63 5.99 0.00 1.20 -1.08 -1.26 -5.05 116.67 118.11 1bal s ASP 10 Ca 0.00 0.35 0.00 0.00 -0.52 0.00 0.00 52.55 52.38 1bal s ASP 10 Cb 0.00 -1.87 0.00 0.00 -1.46 0.00 0.00 42.92 39.59 1bal s ASP 10 CO 0.00 0.39 0.13 0.00 0.52 0.00 0.00 175.17 176.21 1bal n ALA 11 N 2.08 -0.06 -1.95 3.66 0.00 -1.26 -4.88 120.51 118.10 1bal n ALA 11 Ca -0.19 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.94 1bal n ALA 11 Cb 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.98 1bal n ALA 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1bal s LEU 12 N -3.46 3.49 0.35 0.00 1.43 -1.26 -5.07 118.68 114.15 1bal s LEU 12 Ca 0.00 1.38 0.03 0.00 -1.03 0.00 0.00 54.13 54.51 1bal s LEU 12 Cb 0.00 -4.36 -0.02 0.00 0.03 0.00 0.00 46.19 41.84 1bal s LEU 12 CO 0.00 -0.68 0.52 -0.44 0.23 0.00 0.00 176.35 175.98 1bal s SER 13 N -3.65 6.05 0.04 2.29 0.01 -1.26 -5.03 113.70 112.15 1bal s SER 13 Ca 0.55 0.11 -0.25 0.00 1.31 0.00 0.00 55.95 57.67 1bal s SER 13 Cb -0.10 -1.58 -0.17 0.00 0.21 0.00 0.00 66.02 64.37 1bal s SER 13 CO 0.42 -0.42 1.48 1.55 0.41 0.00 0.00 173.24 176.68 1bal h PRO 14 N 0.78 -0.14 0.00 12.44 0.13 -2.01 -2.68 132.00 140.51 1bal h PRO 14 Ca -0.48 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1bal h PRO 14 Cb 1.24 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1bal h PRO 14 CO 0.57 0.10 0.41 0.00 -0.23 0.00 0.00 178.00 178.85 1bal h ALA 15 N 0.49 1.30 -0.22 -0.56 0.00 -1.97 -1.93 119.26 116.36 1bal h ALA 15 Ca -0.01 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1bal h ALA 15 Cb 0.31 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1bal h ALA 15 CO 0.02 -0.30 0.76 0.97 0.00 0.00 0.00 179.25 180.71 1bal h ILE 16 N 0.00 0.04 0.01 0.00 2.10 -1.88 0.55 117.51 118.33 1bal h ILE 16 Ca 0.00 0.00 -0.16 0.00 1.08 0.00 0.00 64.86 65.78 1bal h ILE 16 Cb 0.82 0.29 -0.02 0.00 -1.09 0.00 0.00 36.82 36.81 1bal h ILE 16 CO 0.00 0.00 -0.84 0.03 -1.08 0.00 0.00 178.15 176.26 1bal h ARG 17 N 0.00 0.02 -0.57 2.19 2.47 -1.61 -3.34 114.38 113.55 1bal h ARG 17 Ca 0.11 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.79 1bal h ARG 17 Cb 1.63 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.97 1bal h ARG 17 CO -0.00 1.02 0.00 0.54 0.56 0.00 0.00 179.97 182.09 1bal n ARG 18 N -4.44 1.90 -0.05 0.04 5.12 0.93 -3.99 116.66 116.17 1bal n ARG 18 Ca -0.24 -0.91 -0.15 0.00 -1.93 0.00 0.00 57.85 54.62 1bal n ARG 18 Cb 0.63 -1.48 -0.13 0.00 -1.16 0.00 0.00 32.46 30.32 1bal n ARG 18 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 1bal h LEU 19 N 1.29 0.07 -0.34 0.55 5.85 -0.23 -3.08 115.31 119.42 1bal h LEU 19 Ca 0.00 -0.98 0.00 0.00 0.84 0.00 0.00 57.88 57.74 1bal h LEU 19 Cb 0.66 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.66 1bal h LEU 19 CO 0.08 1.08 0.00 0.18 -0.34 0.00 0.00 178.44 179.44 1bal n LEU 20 N -4.53 0.23 -0.08 2.25 4.77 -1.26 -1.27 117.00 117.12 1bal n LEU 20 Ca -0.11 0.57 0.11 0.00 -0.03 0.00 0.00 56.01 56.55 1bal n LEU 20 Cb 0.54 -0.56 0.06 0.00 -2.33 0.00 0.00 43.42 41.13 1bal n LEU 20 CO 0.36 -0.46 0.23 0.00 -1.33 0.00 0.00 177.39 176.18 1bal n ALA 21 N -1.60 4.07 -0.06 -1.18 0.00 -1.23 -2.22 120.51 118.29 1bal n ALA 21 Ca 0.02 -0.50 -0.22 0.00 0.00 0.00 0.00 53.44 52.74 1bal n ALA 21 Cb 0.13 -0.92 -0.13 0.00 0.00 0.00 0.00 19.45 18.53 1bal n ALA 21 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1bal n GLU 22 N -1.25 0.68 0.01 0.00 2.13 -0.39 -4.40 120.64 117.42 1bal n GLU 22 Ca 0.06 0.30 0.11 0.00 0.66 0.00 0.00 57.16 58.29 1bal n GLU 22 Cb 0.35 -1.66 -0.08 0.00 0.27 0.00 0.00 31.44 30.32 1bal n GLU 22 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1bal n HIS 23 N -3.71 0.09 -2.76 4.31 -0.00 -1.11 -5.05 115.22 106.99 1bal n HIS 23 Ca -0.37 0.03 -0.02 0.00 -0.00 0.00 0.00 57.72 57.36 1bal n HIS 23 Cb 0.94 -0.30 -0.01 0.00 -0.00 0.00 0.00 29.99 30.62 1bal n HIS 23 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 1bal n ASN 24 N -1.88 -5.65 -3.59 0.41 4.13 -0.94 -5.02 115.26 102.71 1bal n ASN 24 Ca 0.01 1.28 -0.24 0.00 1.68 0.00 0.00 54.58 57.30 1bal n ASN 24 Cb 0.44 -4.70 -0.16 0.00 -1.54 0.00 0.00 39.78 33.81 1bal n ASN 24 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1bal s LEU 25 N -1.20 0.26 -0.65 3.41 1.43 -1.24 -5.06 118.68 115.63 1bal s LEU 25 Ca -0.08 -0.52 -0.26 0.00 -1.03 0.00 0.00 54.13 52.24 1bal s LEU 25 Cb 0.01 -0.13 -0.12 0.00 0.03 0.00 0.00 46.19 45.97 1bal s LEU 25 CO 0.66 -0.34 2.45 0.47 0.23 0.00 0.00 176.35 179.81 1bal n ASP 26 N 5.29 1.73 0.00 2.29 8.00 -1.26 -4.70 116.55 127.89 1bal n ASP 26 Ca -0.07 -0.63 0.02 0.00 0.71 0.00 0.00 54.79 54.82 1bal n ASP 26 Cb 0.49 -1.46 0.11 0.00 -0.02 0.00 0.00 41.12 40.24 1bal n ASP 26 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bal n ALA 27 N 15.27 1.64 -0.35 2.24 0.00 -1.26 -2.93 120.51 135.12 1bal n ALA 27 Ca 0.45 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.99 1bal n ALA 27 Cb 0.43 -1.06 0.31 0.00 0.00 0.00 0.00 19.45 19.13 1bal n ALA 27 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1bal h SER 28 N 0.00 0.80 1.64 0.00 0.87 -2.00 0.42 113.55 115.28 1bal h SER 28 Ca 0.00 0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 60.61 1bal h SER 28 Cb 0.00 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 1bal h SER 28 CO 0.00 0.30 -0.20 0.00 -0.53 0.00 0.00 176.83 176.40 1bal h ALA 29 N 1.63 0.88 -2.30 6.23 0.00 -1.93 -3.42 119.26 120.35 1bal h ALA 29 Ca 0.57 -0.19 -0.66 0.00 0.00 0.00 0.00 54.91 54.64 1bal h ALA 29 Cb 0.85 -0.03 -0.16 0.00 0.00 0.00 0.00 17.79 18.45 1bal h ALA 29 CO -0.37 0.26 0.02 0.42 0.00 0.00 0.00 179.25 179.58 1bal s ILE 30 N -3.20 4.93 0.99 0.00 -1.09 0.15 -5.05 121.20 117.93 1bal s ILE 30 Ca 0.05 0.15 -0.12 0.00 -2.23 0.00 0.00 60.65 58.50 1bal s ILE 30 Cb 0.07 -4.10 0.19 0.00 -1.58 0.00 0.00 42.46 37.04 1bal s ILE 30 CO 0.68 -0.43 1.08 -1.59 -1.23 0.00 0.00 174.94 173.46 1bal s LYS 31 N 2.58 0.45 -0.49 2.79 -2.85 -1.26 -4.88 119.74 116.08 1bal s LYS 31 Ca 0.20 0.93 0.06 0.00 -1.00 0.00 0.00 55.97 56.16 1bal s LYS 31 Cb -0.15 -1.71 0.19 0.00 -2.06 0.00 0.00 37.83 34.10 1bal s LYS 31 CO 0.16 -2.83 0.65 0.41 0.10 0.00 0.00 175.35 173.84 1bal n GLY 32 N -0.28 0.16 2.36 0.59 0.00 -1.26 -4.86 105.19 101.89 1bal n GLY 32 Ca 0.06 -0.01 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 1bal n GLY 32 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bal n THR 33 N 2.78 3.26 -0.34 2.61 -2.24 -1.26 -3.89 114.28 115.19 1bal n THR 33 Ca 0.20 -2.79 0.00 0.00 -2.27 0.00 0.00 64.05 59.19 1bal n THR 33 Cb 0.55 -1.40 0.00 0.00 -2.10 0.00 0.00 70.33 67.38 1bal n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bal n GLY 34 N 0.23 -1.32 3.64 3.38 0.00 -1.05 -4.74 105.19 105.32 1bal n GLY 34 Ca 0.46 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 1bal n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bal s VAL 35 N -0.40 3.28 -0.15 1.61 1.01 -1.26 -1.07 120.40 123.42 1bal s VAL 35 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.30 1bal s VAL 35 Cb 0.00 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 33.11 1bal s VAL 35 CO 0.00 -0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.62 1bal n GLY 36 N 4.81 0.43 1.17 4.51 0.00 -1.26 -2.86 105.19 112.00 1bal n GLY 36 Ca 0.22 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1bal n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bal n GLY 37 N -1.61 0.93 3.75 -0.02 0.00 -0.24 -5.05 105.19 102.96 1bal n GLY 37 Ca -0.01 -0.53 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 1bal n GLY 37 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bal s ARG 38 N -3.50 4.25 -0.39 1.61 3.52 -1.13 -4.67 118.95 118.63 1bal s ARG 38 Ca 0.00 0.46 -0.29 0.00 -0.13 0.00 0.00 55.73 55.77 1bal s ARG 38 Cb 0.00 -3.38 0.01 0.00 -1.56 0.00 0.00 34.95 30.02 1bal s ARG 38 CO 0.00 0.30 1.45 -1.17 -0.81 0.00 0.00 175.30 175.07 1bal s LEU 39 N 0.17 3.60 0.00 -0.88 2.96 -1.26 -2.54 118.68 120.72 1bal s LEU 39 Ca 0.26 0.91 -0.07 0.00 -0.22 0.00 0.00 54.13 55.00 1bal s LEU 39 Cb -0.16 -3.54 0.14 0.00 0.50 0.00 0.00 46.19 43.13 1bal s LEU 39 CO 0.11 -1.44 0.86 0.35 -1.32 0.00 0.00 176.35 174.91 1bal n THR 40 N 7.06 0.00 -0.02 3.68 -2.24 -1.26 -5.01 114.28 116.48 1bal n THR 40 Ca 0.17 -0.89 -0.11 0.00 -2.27 0.00 0.00 64.05 60.95 1bal n THR 40 Cb 0.48 -1.39 -0.14 0.00 -2.10 0.00 0.00 70.33 67.18 1bal n THR 40 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1bal n ARG 41 N -2.73 0.66 0.00 -0.78 0.63 -1.26 -3.80 116.66 109.37 1bal n ARG 41 Ca 0.12 0.27 0.00 0.00 -0.92 0.00 0.00 57.85 57.32 1bal n ARG 41 Cb 0.42 -1.76 0.00 0.00 0.45 0.00 0.00 32.46 31.57 1bal n ARG 41 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1bal n GLU 42 N -3.11 0.00 -0.12 -0.14 4.71 -1.26 -0.35 120.64 120.36 1bal n GLU 42 Ca -0.21 0.28 -0.26 0.00 -0.01 0.00 0.00 57.16 56.96 1bal n GLU 42 Cb 1.06 -1.54 -0.10 0.00 -1.01 0.00 0.00 31.44 29.85 1bal n GLU 42 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1bal n ASP 43 N -1.26 1.92 0.24 1.62 9.92 -1.25 -4.36 116.55 123.39 1bal n ASP 43 Ca 0.00 0.37 0.14 0.00 -0.53 0.00 0.00 54.79 54.77 1bal n ASP 43 Cb 0.04 -0.86 0.46 0.00 -0.64 0.00 0.00 41.12 40.12 1bal n ASP 43 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 1bal h VAL 44 N -1.00 0.15 -0.61 2.53 2.07 -1.48 -3.21 116.25 114.71 1bal h VAL 44 Ca -0.55 -0.86 0.12 0.00 0.82 0.00 0.00 66.70 66.24 1bal h VAL 44 Cb 1.47 1.74 -0.09 0.00 -1.52 0.00 0.00 31.29 32.89 1bal h VAL 44 CO -0.33 0.07 0.08 -0.08 0.02 0.00 0.00 177.57 177.33 1bal h GLU 45 N 0.00 0.19 -1.95 1.57 4.22 -0.89 0.77 114.58 118.49 1bal h GLU 45 Ca -0.00 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.43 1bal h GLU 45 Cb 0.74 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1bal h GLU 45 CO 0.01 0.13 0.00 1.17 -2.18 0.00 0.00 179.01 178.14 1bal n LYS 46 N -5.19 0.82 0.00 1.92 4.81 -1.21 -3.03 118.16 116.28 1bal n LYS 46 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 1bal n LYS 46 Cb 0.34 -1.09 0.00 0.00 0.02 0.00 0.00 35.03 34.30 1bal n LYS 46 CO 0.00 0.00 0.00 1.58 1.17 0.00 0.00 177.40 180.15 1bal n HIS 47 N 1.52 0.00 0.00 5.64 -0.00 0.24 -5.00 115.22 117.62 1bal n HIS 47 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1bal n HIS 47 Cb 0.41 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.28 1bal n HIS 47 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 1bal n LEU 48 N -1.03 0.79 -3.65 0.27 4.77 -1.06 -5.08 117.00 112.02 1bal n LEU 48 Ca 0.00 0.15 -0.01 0.00 -0.03 0.00 0.00 56.01 56.12 1bal n LEU 48 Cb 0.00 -0.27 -0.07 0.00 -2.33 0.00 0.00 43.42 40.76 1bal n LEU 48 CO 0.00 -0.27 1.03 0.00 -1.33 0.00 0.00 177.39 176.82 1bal s ALA 49 N -3.67 -2.39 1.17 -1.18 0.00 -1.24 -5.14 121.76 109.32 1bal s ALA 49 Ca 0.00 1.85 -0.09 0.00 0.00 0.00 0.00 51.96 53.72 1bal s ALA 49 Cb 0.00 -1.83 0.14 0.00 0.00 0.00 0.00 23.12 21.43 1bal s ALA 49 CO 0.00 -0.21 0.32 1.63 0.00 0.00 0.00 175.76 177.50 1bal n LYS 50 N 2.38 -3.00 0.00 0.00 5.02 -1.26 -4.99 118.16 116.32 1bal n LYS 50 Ca -0.14 -0.54 0.00 0.00 -2.02 0.00 0.00 58.31 55.62 1bal n LYS 50 Cb 0.57 -0.69 0.00 0.00 -0.02 0.00 0.00 35.03 34.89 1bal n LYS 50 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88