#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rly s ALA 2 N 0.00 3.48 -0.07 4.61 0.00 -1.26 -5.08 121.76 123.45 2rly s ALA 2 Ca 0.00 -1.21 -0.30 0.00 0.00 0.00 0.00 51.96 50.46 2rly s ALA 2 Cb 0.00 -1.30 -0.03 0.00 0.00 0.00 0.00 23.12 21.79 2rly s ALA 2 CO 0.00 0.55 1.20 0.95 0.00 0.00 0.00 175.76 178.46 2rly s THR 3 N -1.66 4.26 -0.86 0.00 -4.23 -1.26 -4.96 115.64 106.93 2rly s THR 3 Ca 0.30 1.58 -0.25 0.00 -1.18 0.00 0.00 61.69 62.14 2rly s THR 3 Cb -0.10 -4.02 0.02 0.00 1.34 0.00 0.00 72.50 69.74 2rly s THR 3 CO 0.22 -0.02 1.49 0.00 -0.54 0.00 0.00 174.62 175.77 2rly s ALA 4 N 2.36 2.55 -0.85 3.99 0.00 -1.26 -4.92 121.76 123.62 2rly s ALA 4 Ca 0.56 -1.66 -0.25 0.00 0.00 0.00 0.00 51.96 50.60 2rly s ALA 4 Cb -0.24 -4.41 0.04 0.00 0.00 0.00 0.00 23.12 18.51 2rly s ALA 4 CO 0.21 -3.66 1.37 0.54 0.00 0.00 0.00 175.76 174.22 2rly s VAL 5 N 6.29 3.79 0.00 0.00 0.11 -1.24 -4.73 120.40 124.62 2rly s VAL 5 Ca 0.47 -0.08 0.00 0.00 -2.93 0.00 0.00 61.98 59.44 2rly s VAL 5 Cb -0.05 -4.93 0.00 0.00 -1.53 0.00 0.00 36.38 29.86 2rly s VAL 5 CO 0.04 -1.85 0.00 -1.20 -3.33 0.00 0.00 175.10 168.76 2rly n SER 6 N 9.35 0.00 -4.64 3.54 7.64 -1.26 -4.97 113.62 123.29 2rly n SER 6 Ca 0.16 -0.93 -0.43 0.00 1.01 0.00 0.00 58.87 58.68 2rly n SER 6 Cb 0.50 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.68 2rly n SER 6 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2rly s GLU 7 N -2.73 4.05 -0.30 1.43 0.41 -1.26 -4.96 118.70 115.34 2rly s GLU 7 Ca 0.00 1.10 0.02 0.00 -0.41 0.00 0.00 54.97 55.69 2rly s GLU 7 Cb 0.00 -3.75 0.09 0.00 -1.78 0.00 0.00 34.13 28.68 2rly s GLU 7 CO 0.00 -0.92 0.02 -1.58 -0.49 0.00 0.00 175.26 172.28 2rly s TRP 8 N 3.73 3.06 0.33 1.61 0.23 -1.26 -2.27 118.94 124.38 2rly s TRP 8 Ca 0.47 -2.44 0.04 0.00 -2.03 0.00 0.00 56.10 52.14 2rly s TRP 8 Cb -0.13 -2.31 -0.02 0.00 0.03 0.00 0.00 33.47 31.05 2rly s TRP 8 CO 0.16 -0.89 0.48 0.99 0.96 0.00 0.00 176.95 178.65 2rly s THR 9 N 1.15 4.58 -0.19 2.01 2.01 -1.20 -4.93 115.64 119.07 2rly s THR 9 Ca 0.05 -0.83 -0.03 0.00 0.31 0.00 0.00 61.69 61.18 2rly s THR 9 Cb -0.19 -3.63 -0.01 0.00 0.01 0.00 0.00 72.50 68.68 2rly s THR 9 CO -0.10 -0.30 -0.06 -1.83 -0.69 0.00 0.00 174.62 171.64 2rly s GLU 10 N -4.20 3.45 -0.19 4.92 -1.05 -1.26 -3.16 118.70 117.21 2rly s GLU 10 Ca 0.41 -0.61 -0.01 0.00 -0.15 0.00 0.00 54.97 54.61 2rly s GLU 10 Cb -0.09 -2.92 0.05 0.00 -0.44 0.00 0.00 34.13 30.73 2rly s GLU 10 CO 0.32 -0.01 -0.01 0.71 0.95 0.00 0.00 175.26 177.22 2rly s TYR 11 N 0.99 1.50 -0.46 4.83 2.02 -0.36 -4.99 117.35 120.88 2rly s TYR 11 Ca 0.00 -1.10 -0.24 0.00 -0.37 0.00 0.00 57.07 55.35 2rly s TYR 11 Cb -0.15 -1.22 0.03 0.00 -0.40 0.00 0.00 41.96 40.23 2rly s TYR 11 CO 0.00 -0.64 0.86 0.21 -1.57 0.00 0.00 175.55 174.42 2rly s LYS 12 N 1.70 3.46 0.67 -0.62 2.47 -1.26 -2.08 119.74 124.08 2rly s LYS 12 Ca -0.02 0.00 -0.03 0.00 -1.56 0.00 0.00 55.97 54.37 2rly s LYS 12 Cb -0.17 -3.94 0.08 0.00 -1.46 0.00 0.00 37.83 32.34 2rly s LYS 12 CO -0.07 -1.20 0.95 0.95 0.16 0.00 0.00 175.35 176.13 2rly s THR 13 N 3.56 2.35 -0.58 3.43 -4.23 -1.02 -4.95 115.64 114.21 2rly s THR 13 Ca 0.33 -0.48 0.16 0.00 -1.18 0.00 0.00 61.69 60.52 2rly s THR 13 Cb -0.11 -2.86 0.16 0.00 1.34 0.00 0.00 72.50 71.02 2rly s THR 13 CO 0.24 0.00 1.49 0.00 -0.54 0.00 0.00 174.62 175.81 2rly n ALA 14 N -2.75 1.29 0.67 3.99 0.00 -1.26 -0.97 120.51 121.47 2rly n ALA 14 Ca 0.11 0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.76 2rly n ALA 14 Cb 0.60 -1.25 0.44 0.00 0.00 0.00 0.00 19.45 19.25 2rly n ALA 14 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2rly n ASP 15 N -1.96 0.67 -0.13 0.00 8.00 -1.26 -4.90 116.55 116.98 2rly n ASP 15 Ca 0.01 0.57 0.00 0.00 0.71 0.00 0.00 54.79 56.08 2rly n ASP 15 Cb 0.10 -0.75 0.00 0.00 -0.02 0.00 0.00 41.12 40.45 2rly n ASP 15 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2rly n GLY 16 N 1.23 0.53 3.24 0.44 0.00 -0.14 -5.06 105.19 105.43 2rly n GLY 16 Ca 0.06 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.93 2rly n GLY 16 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2rly s LYS 17 N -4.24 2.76 -0.63 1.61 2.47 -1.25 -4.96 119.74 115.50 2rly s LYS 17 Ca 0.00 -0.89 -0.22 0.00 -1.56 0.00 0.00 55.97 53.30 2rly s LYS 17 Cb 0.00 -2.21 0.07 0.00 -1.46 0.00 0.00 37.83 34.23 2rly s LYS 17 CO 0.00 0.28 0.90 0.99 0.16 0.00 0.00 175.35 177.69 2rly s THR 18 N 0.07 4.43 0.19 3.43 2.01 -1.26 -2.42 115.64 122.10 2rly s THR 18 Ca -0.11 -0.37 0.01 0.00 0.31 0.00 0.00 61.69 61.54 2rly s THR 18 Cb -0.16 -4.61 -0.04 0.00 0.01 0.00 0.00 72.50 67.70 2rly s THR 18 CO 0.06 -1.32 0.35 -0.72 -0.69 0.00 0.00 174.62 172.30 2rly s TYR 19 N 3.77 3.48 -0.11 4.92 -0.85 -0.88 -4.77 117.35 122.92 2rly s TYR 19 Ca 0.21 0.22 -0.02 0.00 -0.52 0.00 0.00 57.07 56.97 2rly s TYR 19 Cb -0.17 -1.76 -0.03 0.00 0.38 0.00 0.00 41.96 40.38 2rly s TYR 19 CO 0.11 0.43 -0.03 0.71 -1.52 0.00 0.00 175.55 175.25 2rly s TYR 20 N -1.84 3.06 -0.16 -3.49 1.51 0.18 -1.22 117.35 115.38 2rly s TYR 20 Ca 0.37 -0.01 0.01 0.00 -1.01 0.00 0.00 57.07 56.42 2rly s TYR 20 Cb -0.11 -1.83 0.01 0.00 -0.11 0.00 0.00 41.96 39.92 2rly s TYR 20 CO 0.29 0.26 -0.17 -0.47 -1.11 0.00 0.00 175.55 174.35 2rly s TYR 21 N -0.43 2.77 -0.46 2.71 5.04 -1.19 -0.02 117.35 125.77 2rly s TYR 21 Ca 0.07 -1.29 -0.27 0.00 -2.44 0.00 0.00 57.07 53.14 2rly s TYR 21 Cb -0.12 -1.90 0.03 0.00 0.35 0.00 0.00 41.96 40.32 2rly s TYR 21 CO 0.02 -0.62 1.03 -0.80 -1.34 0.00 0.00 175.55 173.85 2rly s ASN 22 N 1.02 6.58 0.01 4.32 0.02 0.22 -3.23 114.94 123.89 2rly s ASN 22 Ca -0.02 0.33 0.20 0.00 -1.02 0.00 0.00 52.86 52.35 2rly s ASN 22 Cb -0.15 -2.50 0.83 0.00 0.02 0.00 0.00 41.25 39.46 2rly s ASN 22 CO -0.05 -1.14 1.63 -3.20 0.02 0.00 0.00 177.10 174.36 2rly n ASN 23 N 7.48 0.02 0.00 -1.22 2.85 -0.96 -0.67 115.26 122.76 2rly n ASN 23 Ca 0.09 0.50 0.00 0.00 -0.11 0.00 0.00 54.58 55.07 2rly n ASN 23 Cb 0.49 -0.51 0.00 0.00 1.24 0.00 0.00 39.78 41.00 2rly n ASN 23 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 2rly n ARG 24 N -1.52 0.00 -0.94 1.20 0.63 -1.26 -3.38 116.66 111.38 2rly n ARG 24 Ca 0.05 0.14 0.03 0.00 -0.92 0.00 0.00 57.85 57.15 2rly n ARG 24 Cb 0.23 -0.77 0.38 0.00 0.45 0.00 0.00 32.46 32.75 2rly n ARG 24 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2rly n THR 25 N -0.41 2.84 -3.45 5.15 -2.24 -1.26 -4.87 114.28 110.04 2rly n THR 25 Ca 0.00 -1.49 -0.18 0.00 -2.27 0.00 0.00 64.05 60.11 2rly n THR 25 Cb 0.00 -0.31 0.08 0.00 -2.10 0.00 0.00 70.33 68.00 2rly n THR 25 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2rly n LEU 26 N 0.37 -4.14 -4.94 3.22 0.00 -1.14 -5.02 117.00 105.34 2rly n LEU 26 Ca 0.32 -0.68 -0.20 0.00 0.00 0.00 0.00 56.01 55.45 2rly n LEU 26 Cb 1.27 -3.05 -0.02 0.00 0.00 0.00 0.00 43.42 41.61 2rly n LEU 26 CO 0.36 0.34 -0.03 -0.70 0.00 0.00 0.00 177.39 177.36 2rly s GLU 27 N -5.30 3.12 0.18 1.96 2.56 0.15 -4.94 118.70 116.43 2rly s GLU 27 Ca 0.09 -0.99 0.09 0.00 0.00 0.00 0.00 54.97 54.16 2rly s GLU 27 Cb -0.01 -2.74 -0.04 0.00 2.00 0.00 0.00 34.13 33.33 2rly s GLU 27 CO 0.75 0.23 -0.09 -1.54 -0.56 0.00 0.00 175.26 174.04 2rly s SER 28 N -4.04 4.26 -0.16 -1.70 1.04 -1.26 0.72 113.70 112.56 2rly s SER 28 Ca 0.39 -0.58 -0.04 0.00 0.48 0.00 0.00 55.95 56.21 2rly s SER 28 Cb -0.08 -0.72 0.07 0.00 0.10 0.00 0.00 66.02 65.39 2rly s SER 28 CO 0.29 0.10 0.18 0.42 0.98 0.00 0.00 173.24 175.21 2rly s THR 29 N -1.70 -0.26 -0.00 2.02 -4.23 0.97 -4.81 115.64 107.63 2rly s THR 29 Ca 0.25 0.02 -0.24 0.00 -1.18 0.00 0.00 61.69 60.53 2rly s THR 29 Cb -0.09 -0.54 -0.18 0.00 1.34 0.00 0.00 72.50 73.03 2rly s THR 29 CO 0.15 -0.11 1.29 -0.50 -0.54 0.00 0.00 174.62 174.91 2rly h TRP 30 N 8.35 0.16 -4.06 3.99 4.06 -1.94 0.52 115.95 127.02 2rly h TRP 30 Ca -0.15 -0.05 -0.02 0.00 2.06 0.00 0.00 58.89 60.73 2rly h TRP 30 Cb 1.14 -0.03 -0.00 0.00 -1.00 0.00 0.00 29.16 29.27 2rly h TRP 30 CO 0.23 0.59 -0.01 -0.85 -3.56 0.00 0.00 178.44 174.84 2rly n GLU 31 N -4.74 1.23 -1.67 0.49 0.28 -1.26 -4.04 120.64 110.93 2rly n GLU 31 Ca -0.08 -0.10 -0.46 0.00 -0.16 0.00 0.00 57.16 56.36 2rly n GLU 31 Cb 0.29 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.12 2rly n GLU 31 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2rly n LYS 32 N -0.79 2.10 -1.50 3.44 5.02 -1.26 -4.63 118.16 120.55 2rly n LYS 32 Ca 0.00 0.76 -0.36 0.00 -2.02 0.00 0.00 58.31 56.69 2rly n LYS 32 Cb 0.02 -2.52 0.09 0.00 -0.02 0.00 0.00 35.03 32.59 2rly n LYS 32 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2rly n PRO 33 N 3.47 0.76 0.23 1.97 -0.04 -1.26 -4.92 135.00 135.21 2rly n PRO 33 Ca 0.17 0.32 0.07 0.00 -0.04 0.00 0.00 63.50 64.02 2rly n PRO 33 Cb 0.28 -2.42 0.56 0.00 -0.04 0.00 0.00 33.50 31.89 2rly n PRO 33 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2rly h GLN 34 N 0.03 0.00 -0.73 0.54 5.75 -1.99 -2.66 115.11 116.05 2rly h GLN 34 Ca -0.49 0.00 -0.23 0.00 -0.15 0.00 0.00 58.65 57.78 2rly h GLN 34 Cb 1.33 0.00 -0.14 0.00 1.07 0.00 0.00 27.48 29.74 2rly h GLN 34 CO 0.50 0.17 0.28 0.39 -2.65 0.00 0.00 178.83 177.52 2rly n GLU 35 N -4.13 3.52 -2.50 1.69 -0.58 -1.26 -4.92 120.64 112.46 2rly n GLU 35 Ca -0.02 -3.09 -0.43 0.00 -0.42 0.00 0.00 57.16 53.20 2rly n GLU 35 Cb 0.25 -2.19 -0.02 0.00 -0.57 0.00 0.00 31.44 28.90 2rly n GLU 35 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2rly s LEU 36 N -3.03 3.80 0.00 -4.62 1.98 -1.01 -3.69 118.68 112.11 2rly s LEU 36 Ca 0.55 0.96 0.00 0.00 -2.89 0.00 0.00 54.13 52.74 2rly s LEU 36 Cb 0.44 -3.54 0.00 0.00 0.66 0.00 0.00 46.19 43.75 2rly s LEU 36 CO 0.13 -1.12 0.00 1.17 -1.89 0.00 0.00 176.35 174.64