#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2sgp s ASP 7 N 0.00 4.56 -0.42 -1.34 -1.08 -1.26 -5.00 116.67 112.13 2sgp s ASP 7 Ca 0.00 -0.29 0.04 0.00 -0.52 0.00 0.00 52.55 51.78 2sgp s ASP 7 Cb 0.00 -1.78 0.48 0.00 -1.46 0.00 0.00 42.92 40.16 2sgp s ASP 7 CO 0.00 0.03 1.55 0.00 0.52 0.00 0.00 175.17 177.27 2sgp h SER 9 N 1.80 0.81 0.00 0.00 0.02 -1.97 -3.18 113.55 111.03 2sgp h SER 9 Ca 0.42 -0.65 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 2sgp h SER 9 Cb 1.39 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2sgp h SER 9 CO 0.95 1.34 0.00 -0.62 -1.14 0.00 0.00 176.83 177.35 2sgp n GLU 10 N -4.05 0.63 -3.27 3.45 1.02 -1.26 -4.79 120.64 112.37 2sgp n GLU 10 Ca -0.08 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 56.87 2sgp n GLU 10 Cb 0.71 -1.03 0.00 0.00 -0.02 0.00 0.00 31.44 31.10 2sgp n GLU 10 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2sgp s TYR 11 N -1.90 3.01 0.87 -0.32 1.51 -1.20 -4.53 117.35 114.79 2sgp s TYR 11 Ca 0.00 -0.24 -0.12 0.00 -1.01 0.00 0.00 57.07 55.70 2sgp s TYR 11 Cb 0.00 -2.16 0.12 0.00 -0.11 0.00 0.00 41.96 39.80 2sgp s TYR 11 CO 0.00 -0.19 1.13 -1.25 -1.11 0.00 0.00 175.55 174.12 2sgp s PRO 12 N -4.27 1.45 -0.06 -1.71 0.04 -1.26 -5.08 135.00 124.11 2sgp s PRO 12 Ca 0.49 0.39 0.05 0.00 0.04 0.00 0.00 61.00 61.97 2sgp s PRO 12 Cb -0.10 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.57 2sgp s PRO 12 CO 0.32 -2.00 -0.22 0.21 0.04 0.00 0.00 177.00 175.35 2sgp s LYS 13 N -5.25 2.34 0.31 4.56 2.47 -1.26 -5.04 119.74 117.87 2sgp s LYS 13 Ca 0.63 -0.79 0.26 0.00 -1.56 0.00 0.00 55.97 54.51 2sgp s LYS 13 Cb -0.15 -1.96 1.00 0.00 -1.46 0.00 0.00 37.83 35.27 2sgp s LYS 13 CO 0.53 0.29 1.77 -1.00 0.16 0.00 0.00 175.35 177.10 2sgp h PRO 14 N 6.26 0.00 -2.52 4.03 0.13 -2.01 -3.45 132.00 134.44 2sgp h PRO 14 Ca -0.30 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.76 2sgp h PRO 14 Cb 1.18 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.14 2sgp h PRO 14 CO 0.47 0.00 0.04 0.00 -0.23 0.00 0.00 178.00 178.29 2sgp s ALA 15 N -3.34 -1.41 -0.02 -0.56 0.00 -1.26 -5.16 121.76 110.02 2sgp s ALA 15 Ca 0.05 0.82 0.03 0.00 0.00 0.00 0.00 51.96 52.86 2sgp s ALA 15 Cb 0.10 0.19 -0.00 0.00 0.00 0.00 0.00 23.12 23.40 2sgp s ALA 15 CO 0.46 -0.41 -0.09 0.00 0.00 0.00 0.00 175.76 175.71 2sgp s THR 17 N 0.04 3.49 -0.33 0.00 -4.23 -1.26 -4.89 115.64 108.45 2sgp s THR 17 Ca -0.01 1.46 -0.01 0.00 -1.18 0.00 0.00 61.69 61.95 2sgp s THR 17 Cb -0.07 -3.91 0.18 0.00 1.34 0.00 0.00 72.50 70.04 2sgp s THR 17 CO 0.00 0.32 2.16 -0.81 -0.54 0.00 0.00 174.62 175.75 2sgp n PRO 18 N 1.05 1.90 -2.50 3.99 -0.04 -1.26 -4.93 135.00 133.21 2sgp n PRO 18 Ca -0.00 -1.67 -0.39 0.00 -0.04 0.00 0.00 63.50 61.39 2sgp n PRO 18 Cb 0.45 -1.70 -0.04 0.00 -0.04 0.00 0.00 33.50 32.17 2sgp n PRO 18 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2sgp s GLU 19 N -1.76 4.51 -0.45 0.54 1.03 -1.26 -4.98 118.70 116.34 2sgp s GLU 19 Ca 0.36 1.72 -0.19 0.00 0.03 0.00 0.00 54.97 56.88 2sgp s GLU 19 Cb 0.26 -3.02 0.03 0.00 -0.80 0.00 0.00 34.13 30.61 2sgp s GLU 19 CO -0.04 0.12 0.59 -0.47 -1.33 0.00 0.00 175.26 174.13 2sgp s TYR 20 N -1.29 3.09 -0.38 4.83 5.04 -1.26 -4.46 117.35 122.91 2sgp s TYR 20 Ca 0.48 -0.25 0.02 0.00 -2.44 0.00 0.00 57.07 54.88 2sgp s TYR 20 Cb -0.29 -3.27 0.15 0.00 0.35 0.00 0.00 41.96 38.90 2sgp s TYR 20 CO 0.37 -0.86 0.26 1.03 -1.34 0.00 0.00 175.55 175.01 2sgp s ARG 21 N 2.60 0.76 0.68 4.97 0.52 0.47 -5.02 118.95 123.93 2sgp s ARG 21 Ca 0.18 -1.69 -0.12 0.00 -0.52 0.00 0.00 55.73 53.57 2sgp s ARG 21 Cb -0.16 -1.44 0.01 0.00 0.52 0.00 0.00 34.95 33.87 2sgp s ARG 21 CO 0.16 -1.27 1.07 -1.25 0.02 0.00 0.00 175.30 174.03 2sgp s PRO 22 N 0.61 2.86 0.09 3.54 0.04 -1.20 -3.63 135.00 137.31 2sgp s PRO 22 Ca 0.24 1.12 0.03 0.00 0.04 0.00 0.00 61.00 62.42 2sgp s PRO 22 Cb -0.13 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 2sgp s PRO 22 CO -0.07 -1.17 -0.08 -0.51 0.04 0.00 0.00 177.00 175.21 2sgp s LEU 23 N -5.28 2.42 -0.17 -3.56 1.43 -0.82 -1.66 118.68 111.04 2sgp s LEU 23 Ca 0.61 -0.84 -0.01 0.00 -1.03 0.00 0.00 54.13 52.86 2sgp s LEU 23 Cb -0.16 -0.18 -0.01 0.00 0.03 0.00 0.00 46.19 45.87 2sgp s LEU 23 CO 0.49 -0.33 -0.11 0.00 0.23 0.00 0.00 176.35 176.63 2sgp s GLY 25 N 0.89 1.73 0.00 0.00 0.00 -0.92 -0.09 107.32 108.93 2sgp s GLY 25 Ca -0.03 -1.07 0.14 0.00 0.00 0.00 0.00 44.72 43.76 2sgp s GLY 25 CO -0.00 -0.74 1.42 -1.14 0.00 0.00 0.00 173.10 172.63 2sgp n SER 26 N -2.60 0.00 -1.79 1.64 3.41 0.16 -1.68 113.62 112.76 2sgp n SER 26 Ca 0.07 0.31 0.07 0.00 -0.26 0.00 0.00 58.87 59.06 2sgp n SER 26 Cb 0.60 -0.40 0.38 0.00 -0.26 0.00 0.00 64.21 64.52 2sgp n SER 26 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2sgp n ASP 27 N -1.40 5.40 0.00 4.04 5.75 -1.26 -4.89 116.55 124.19 2sgp n ASP 27 Ca 0.05 -2.84 0.00 0.00 -0.01 0.00 0.00 54.79 51.99 2sgp n ASP 27 Cb 0.14 -0.67 0.00 0.00 -1.03 0.00 0.00 41.12 39.56 2sgp n ASP 27 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2sgp n ASN 28 N 0.62 -5.24 -4.74 -1.12 3.02 -0.68 -4.95 115.26 102.17 2sgp n ASN 28 Ca 0.26 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.44 2sgp n ASN 28 Cb 1.12 -3.18 -0.07 0.00 -0.61 0.00 0.00 39.78 37.05 2sgp n ASN 28 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2sgp s LYS 29 N -1.76 4.21 -0.16 3.52 2.20 -1.26 -4.86 119.74 121.63 2sgp s LYS 29 Ca 0.00 0.24 -0.29 0.00 -0.36 0.00 0.00 55.97 55.56 2sgp s LYS 29 Cb 0.00 -3.40 -0.00 0.00 -1.51 0.00 0.00 37.83 32.92 2sgp s LYS 29 CO 0.00 0.29 1.08 0.99 -0.36 0.00 0.00 175.35 177.35 2sgp s THR 30 N 0.27 4.61 -0.14 3.43 2.01 -1.26 -2.16 115.64 122.40 2sgp s THR 30 Ca 0.20 1.92 -0.14 0.00 0.31 0.00 0.00 61.69 63.99 2sgp s THR 30 Cb -0.14 -4.24 -0.05 0.00 0.01 0.00 0.00 72.50 68.09 2sgp s THR 30 CO 0.07 -0.10 0.30 -0.31 -0.69 0.00 0.00 174.62 173.89 2sgp s TYR 31 N 2.78 3.49 0.52 4.92 1.51 -0.47 -4.97 117.35 125.13 2sgp s TYR 31 Ca 0.48 0.64 0.17 0.00 -1.01 0.00 0.00 57.07 57.35 2sgp s TYR 31 Cb -0.18 -2.32 1.27 0.00 -0.11 0.00 0.00 41.96 40.62 2sgp s TYR 31 CO 0.13 0.30 2.12 0.78 -1.11 0.00 0.00 175.55 177.76 2sgp h GLY 32 N 6.40 0.04 -2.35 0.71 0.00 -1.87 -2.18 103.07 103.82 2sgp h GLY 32 Ca -0.43 -0.01 0.15 0.00 0.00 0.00 0.00 47.33 47.04 2sgp h GLY 32 CO 0.73 0.01 0.44 0.54 0.00 0.00 0.00 176.54 178.26 2sgp s ASN 33 N -6.90 -0.21 0.33 0.19 2.20 -1.24 -0.40 114.94 108.92 2sgp s ASN 33 Ca -0.05 -0.41 0.04 0.00 -0.94 0.00 0.00 52.86 51.50 2sgp s ASN 33 Cb 0.18 0.53 0.65 0.00 -2.00 0.00 0.00 41.25 40.60 2sgp s ASN 33 CO 0.68 -0.96 1.92 0.50 -2.94 0.00 0.00 177.10 176.30 2sgp h LYS 34 N 2.00 0.85 -0.37 3.55 3.11 -1.88 0.31 116.57 124.14 2sgp h LYS 34 Ca -0.23 -0.05 -0.06 0.00 -2.81 0.00 0.00 60.65 57.49 2sgp h LYS 34 Cb 1.24 -0.19 -0.01 0.00 -1.00 0.00 0.00 32.23 32.26 2sgp h LYS 34 CO 0.26 0.56 -0.02 0.00 -2.81 0.00 0.00 179.45 177.44 2sgp h ASN 36 N 0.47 1.02 -0.13 0.00 2.35 -1.74 -1.96 115.58 115.60 2sgp h ASN 36 Ca 0.10 -0.33 -0.00 0.00 -0.55 0.00 0.00 56.30 55.51 2sgp h ASN 36 Cb 0.49 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 2sgp h ASN 36 CO 0.02 1.13 0.07 0.15 -1.65 0.00 0.00 177.43 177.15 2sgp h PHE 37 N 0.91 0.19 -0.10 1.19 3.57 -0.05 -2.85 116.94 119.79 2sgp h PHE 37 Ca 0.14 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.59 2sgp h PHE 37 Cb 0.66 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 2sgp h PHE 37 CO 0.04 0.22 -0.15 0.00 -2.23 0.00 0.00 178.31 176.20 2sgp h ASN 39 N 0.16 0.00 0.27 0.00 2.35 -1.14 -2.69 115.58 114.52 2sgp h ASN 39 Ca 0.03 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.54 2sgp h ASN 39 Cb 0.37 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.74 2sgp h ASN 39 CO 0.02 0.40 -1.01 0.00 -1.65 0.00 0.00 177.43 175.20 2sgp h ALA 40 N 1.60 0.27 -0.81 -0.83 0.00 -1.34 0.13 119.26 118.28 2sgp h ALA 40 Ca -0.00 -0.72 -0.05 0.00 0.00 0.00 0.00 54.91 54.14 2sgp h ALA 40 Cb 0.98 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 2sgp h ALA 40 CO 0.05 0.79 0.33 0.28 0.00 0.00 0.00 179.25 180.70 2sgp h VAL 41 N 0.26 1.26 -0.21 0.00 2.07 -1.40 -0.09 116.25 118.15 2sgp h VAL 41 Ca -0.10 -0.82 -0.06 0.00 0.82 0.00 0.00 66.70 66.54 2sgp h VAL 41 Cb 1.65 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 2sgp h VAL 41 CO 0.18 0.34 -0.10 0.58 0.02 0.00 0.00 177.57 178.59 2sgp h VAL 42 N 1.17 1.31 -0.73 2.57 2.07 -1.38 0.12 116.25 121.38 2sgp h VAL 42 Ca 0.27 -1.16 0.10 0.00 0.82 0.00 0.00 66.70 66.72 2sgp h VAL 42 Cb 0.21 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 31.57 2sgp h VAL 42 CO -0.02 0.35 0.48 -0.08 0.02 0.00 0.00 177.57 178.32 2sgp h GLU 43 N 0.13 0.61 -0.05 1.57 4.81 -0.43 0.58 114.58 121.79 2sgp h GLU 43 Ca 0.05 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2sgp h GLU 43 Cb 0.59 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.83 2sgp h GLU 43 CO 0.03 0.40 0.00 -1.13 -0.73 0.00 0.00 179.01 177.58 2sgp n SER 44 N -4.49 0.29 -3.10 1.04 3.41 -0.07 -4.87 113.62 105.83 2sgp n SER 44 Ca 0.12 -1.86 -0.23 0.00 -0.26 0.00 0.00 58.87 56.64 2sgp n SER 44 Cb 0.34 -0.03 0.04 0.00 -0.26 0.00 0.00 64.21 64.30 2sgp n SER 44 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2sgp n ASN 45 N -0.41 -6.17 0.00 4.04 5.15 0.20 -2.00 115.26 116.07 2sgp n ASN 45 Ca 0.05 -0.32 0.00 0.00 -0.60 0.00 0.00 54.58 53.71 2sgp n ASN 45 Cb 0.06 -4.97 0.00 0.00 -0.53 0.00 0.00 39.78 34.34 2sgp n ASN 45 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2sgp n GLY 46 N -1.59 0.76 0.11 8.20 0.00 0.40 -4.91 105.19 108.15 2sgp n GLY 46 Ca -0.10 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.89 2sgp n GLY 46 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2sgp h THR 47 N 0.00 1.48 -3.45 2.61 2.02 -1.56 -3.45 112.91 110.56 2sgp h THR 47 Ca 0.00 -2.66 -0.54 0.00 0.77 0.00 0.00 66.41 63.98 2sgp h THR 47 Cb 0.00 2.46 -0.03 0.00 -1.74 0.00 0.00 68.15 68.84 2sgp h THR 47 CO 0.00 0.74 0.13 -0.22 0.37 0.00 0.00 175.52 176.54 2sgp s LEU 48 N -7.07 4.55 0.42 2.58 2.96 -1.26 -5.05 118.68 115.81 2sgp s LEU 48 Ca 0.00 1.52 0.03 0.00 -0.22 0.00 0.00 54.13 55.47 2sgp s LEU 48 Cb 0.11 -3.20 -0.02 0.00 0.50 0.00 0.00 46.19 43.58 2sgp s LEU 48 CO 0.78 0.19 0.11 0.42 -1.32 0.00 0.00 176.35 176.52 2sgp s THR 49 N -0.92 0.72 -0.25 3.68 -4.23 -1.26 -4.83 115.64 108.55 2sgp s THR 49 Ca 0.35 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.68 2sgp s THR 49 Cb -0.22 -2.35 -0.03 0.00 1.34 0.00 0.00 72.50 71.24 2sgp s THR 49 CO 0.24 0.00 0.52 -0.22 -0.54 0.00 0.00 174.62 174.62 2sgp s LEU 50 N -3.64 4.07 -0.14 4.79 2.96 -1.26 0.39 118.68 125.85 2sgp s LEU 50 Ca 0.22 0.56 -0.20 0.00 -0.22 0.00 0.00 54.13 54.48 2sgp s LEU 50 Cb 0.03 -2.67 -0.24 0.00 0.50 0.00 0.00 46.19 43.80 2sgp s LEU 50 CO 0.13 -0.26 0.50 0.28 -1.32 0.00 0.00 176.35 175.67 2sgp h SER 51 N 7.88 0.19 -4.91 3.68 0.02 -0.73 -3.46 113.55 116.22 2sgp h SER 51 Ca -0.30 -0.78 0.31 0.00 -0.84 0.00 0.00 61.79 60.18 2sgp h SER 51 Cb 1.14 -0.06 -0.16 0.00 0.14 0.00 0.00 62.40 63.46 2sgp h SER 51 CO 0.72 1.45 0.88 -1.38 -1.14 0.00 0.00 176.83 177.36 2sgp s HIS 52 N -2.39 -0.06 0.43 3.45 0.00 -1.07 -5.02 115.29 110.63 2sgp s HIS 52 Ca -0.22 0.01 -0.21 0.00 -3.00 0.00 0.00 55.06 51.64 2sgp s HIS 52 Cb 0.03 0.52 -0.11 0.00 -4.00 0.00 0.00 32.58 29.03 2sgp s HIS 52 CO 0.70 -0.16 0.95 -0.06 -1.00 0.00 0.00 174.74 175.16 2sgp s PHE 53 N -2.29 3.32 0.00 0.38 0.40 -1.26 -0.30 117.98 118.22 2sgp s PHE 53 Ca 0.12 1.60 0.00 0.00 -0.60 0.00 0.00 56.93 58.05 2sgp s PHE 53 Cb 0.02 -2.84 0.00 0.00 0.51 0.00 0.00 43.02 40.71 2sgp s PHE 53 CO -0.04 -0.12 0.00 0.41 0.70 0.00 0.00 175.22 176.17 2sgp n GLY 54 N -0.68 0.81 3.80 4.36 0.00 -0.67 -4.75 105.19 108.07 2sgp n GLY 54 Ca 0.07 -2.15 -0.33 0.00 0.00 0.00 0.00 46.02 43.61 2sgp n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2sgp s LYS 55 N -1.22 3.50 0.00 1.61 1.02 -1.26 -1.75 119.74 121.64 2sgp s LYS 55 Ca 0.00 1.26 0.23 0.00 0.02 0.00 0.00 55.97 57.49 2sgp s LYS 55 Cb 0.00 -2.06 1.39 0.00 -0.52 0.00 0.00 37.83 36.64 2sgp s LYS 55 CO 0.00 -0.67 1.76 0.00 -0.92 0.00 0.00 175.35 175.52