#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ysb s SER 2 N 0.00 0.90 -0.21 1.61 0.01 -1.26 -5.06 113.70 109.69 2ysb s SER 2 Ca 0.00 -0.25 -0.12 0.00 1.31 0.00 0.00 55.95 56.89 2ysb s SER 2 Cb 0.00 -0.06 -0.09 0.00 0.21 0.00 0.00 66.02 66.08 2ysb s SER 2 CO 0.00 0.02 -0.29 -0.24 0.41 0.00 0.00 173.24 173.13 2ysb n SER 3 N 2.50 1.65 -4.42 2.44 2.88 -1.26 -4.80 113.62 112.61 2ysb n SER 3 Ca -0.16 0.28 -0.45 0.00 -1.33 0.00 0.00 58.87 57.22 2ysb n SER 3 Cb 0.57 -0.67 -0.01 0.00 -0.75 0.00 0.00 64.21 63.34 2ysb n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ysb s GLY 4 N -5.29 2.47 0.20 0.46 0.00 -1.26 -5.02 107.32 98.88 2ysb s GLY 4 Ca -0.31 -3.28 -0.29 0.00 0.00 0.00 0.00 44.72 40.85 2ysb s GLY 4 CO 0.39 1.78 0.65 1.44 0.00 0.00 0.00 173.10 177.36 2ysb n SER 5 N 5.09 -0.69 0.01 1.64 7.64 -1.26 -4.92 113.62 121.12 2ysb n SER 5 Ca 0.27 1.14 -0.03 0.00 1.01 0.00 0.00 58.87 61.26 2ysb n SER 5 Cb 0.45 -1.01 -0.01 0.00 -1.01 0.00 0.00 64.21 62.62 2ysb n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2ysb n SER 6 N 1.84 0.94 -0.54 6.43 2.88 -1.26 -5.15 113.62 118.77 2ysb n SER 6 Ca 0.17 0.13 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 2ysb n SER 6 Cb 0.25 -0.32 0.00 0.00 -0.75 0.00 0.00 64.21 63.40 2ysb n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ysb n GLY 7 N 2.98 -3.39 0.44 0.46 0.00 -1.26 -4.87 105.19 99.55 2ysb n GLY 7 Ca -0.05 -1.08 0.07 0.00 0.00 0.00 0.00 46.02 44.97 2ysb n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ysb n GLU 8 N -1.40 1.66 -3.67 1.61 1.02 -1.26 -4.96 120.64 113.65 2ysb n GLU 8 Ca 0.00 -2.86 -0.27 0.00 -0.02 0.00 0.00 57.16 54.00 2ysb n GLU 8 Cb 0.08 -1.62 -0.05 0.00 -0.02 0.00 0.00 31.44 29.83 2ysb n GLU 8 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2ysb n ASP 9 N -1.19 -1.42 -4.26 1.62 2.03 -1.26 -4.79 116.55 107.28 2ysb n ASP 9 Ca 0.19 -0.66 -0.36 0.00 0.52 0.00 0.00 54.79 54.49 2ysb n ASP 9 Cb 0.73 -1.28 0.07 0.00 -0.72 0.00 0.00 41.12 39.92 2ysb n ASP 9 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2ysb n LEU 10 N -3.27 -2.49 -4.57 -2.67 4.77 -1.26 -4.73 117.00 102.78 2ysb n LEU 10 Ca 0.08 0.38 -0.28 0.00 -0.03 0.00 0.00 56.01 56.16 2ysb n LEU 10 Cb 0.42 -1.00 -0.06 0.00 -2.33 0.00 0.00 43.42 40.44 2ysb n LEU 10 CO 0.62 -4.52 1.46 -2.16 -1.33 0.00 0.00 177.39 171.46 2ysb s PRO 11 N -2.50 2.51 0.38 3.23 0.04 -1.26 -4.94 135.00 132.45 2ysb s PRO 11 Ca 0.53 -0.94 -0.23 0.00 0.04 0.00 0.00 61.00 60.39 2ysb s PRO 11 Cb -0.27 -5.20 -0.14 0.00 0.04 0.00 0.00 34.50 28.93 2ysb s PRO 11 CO 0.71 -3.83 0.49 1.28 0.04 0.00 0.00 177.00 175.68 2ysb n LEU 12 N 14.29 -0.58 -4.69 -3.56 4.77 -1.26 -4.93 117.00 121.03 2ysb n LEU 12 Ca 0.44 0.94 -0.29 0.00 -0.03 0.00 0.00 56.01 57.07 2ysb n LEU 12 Cb 0.47 -1.06 0.16 0.00 -2.33 0.00 0.00 43.42 40.66 2ysb n LEU 12 CO 0.66 -3.03 0.65 -2.16 -1.33 0.00 0.00 177.39 172.18 2ysb s PRO 13 N -1.39 0.71 -0.37 3.23 0.04 -1.26 -4.94 135.00 131.03 2ysb s PRO 13 Ca 0.62 0.62 -0.28 0.00 0.04 0.00 0.00 61.00 62.00 2ysb s PRO 13 Cb -0.66 -1.76 -0.01 0.00 0.04 0.00 0.00 34.50 32.11 2ysb s PRO 13 CO 0.59 -2.57 1.71 -1.25 0.04 0.00 0.00 177.00 175.53 2ysb s PRO 14 N -4.95 3.35 0.00 0.56 0.04 -1.26 -2.63 135.00 130.10 2ysb s PRO 14 Ca 0.65 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.95 2ysb s PRO 14 Cb -0.18 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.19 2ysb s PRO 14 CO 0.57 -1.84 0.00 0.41 0.04 0.00 0.00 177.00 176.18 2ysb n GLY 15 N 5.36 1.59 3.93 0.56 0.00 -1.26 -4.93 105.19 110.44 2ysb n GLY 15 Ca 0.21 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.98 2ysb n GLY 15 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2ysb s TRP 16 N -1.44 3.50 -0.22 1.61 0.52 -1.08 -2.21 118.94 119.63 2ysb s TRP 16 Ca 0.00 0.43 -0.10 0.00 0.02 0.00 0.00 56.10 56.45 2ysb s TRP 16 Cb 0.00 -1.95 0.08 0.00 -1.15 0.00 0.00 33.47 30.45 2ysb s TRP 16 CO 0.00 0.12 0.49 -1.54 0.02 0.00 0.00 176.95 176.04 2ysb s SER 17 N -3.84 -0.58 0.15 2.95 1.04 -0.42 -4.92 113.70 108.07 2ysb s SER 17 Ca 0.41 1.13 -0.11 0.00 0.48 0.00 0.00 55.95 57.87 2ysb s SER 17 Cb -0.10 1.31 -0.07 0.00 0.10 0.00 0.00 66.02 67.27 2ysb s SER 17 CO 0.35 -0.22 0.49 0.54 0.98 0.00 0.00 173.24 175.38 2ysb s VAL 18 N 2.11 4.98 -0.12 5.02 0.11 -1.26 -0.08 120.40 131.16 2ysb s VAL 18 Ca -0.06 0.53 -0.16 0.00 -2.93 0.00 0.00 61.98 59.36 2ysb s VAL 18 Cb -0.10 -3.66 0.04 0.00 -1.53 0.00 0.00 36.38 31.13 2ysb s VAL 18 CO -0.15 0.14 0.43 -1.81 -3.33 0.00 0.00 175.10 170.38 2ysb s ASP 19 N -2.00 -0.41 -0.18 3.54 1.01 -0.17 -4.97 116.67 113.49 2ysb s ASP 19 Ca 0.40 0.69 -0.15 0.00 0.71 0.00 0.00 52.55 54.20 2ysb s ASP 19 Cb -0.13 0.74 -0.04 0.00 1.01 0.00 0.00 42.92 44.49 2ysb s ASP 19 CO 0.20 -0.25 0.33 0.26 0.21 0.00 0.00 175.17 175.93 2ysb s TRP 20 N -0.22 3.42 0.79 4.23 0.51 -1.26 -1.68 118.94 124.73 2ysb s TRP 20 Ca -0.04 0.59 -0.12 0.00 -2.12 0.00 0.00 56.10 54.42 2ysb s TRP 20 Cb -0.03 -2.42 0.06 0.00 -0.81 0.00 0.00 33.47 30.27 2ysb s TRP 20 CO 0.02 0.12 1.14 0.95 -0.51 0.00 0.00 176.95 178.68 2ysb s THR 21 N 0.85 2.57 0.14 2.01 -4.23 0.03 -4.88 115.64 112.13 2ysb s THR 21 Ca 0.17 0.19 -0.31 0.00 -1.18 0.00 0.00 61.69 60.56 2ysb s THR 21 Cb -0.14 -3.14 -0.07 0.00 1.34 0.00 0.00 72.50 70.50 2ysb s THR 21 CO 0.06 -0.24 1.56 0.24 -0.54 0.00 0.00 174.62 175.69 2ysb h MET 22 N -0.98 -0.37 -0.95 3.99 2.86 -1.98 0.75 114.93 118.25 2ysb h MET 22 Ca -0.46 0.03 0.28 0.00 -2.06 0.00 0.00 59.70 57.48 2ysb h MET 22 Cb 1.30 0.08 -0.15 0.00 0.06 0.00 0.00 31.60 32.90 2ysb h MET 22 CO 0.64 -0.25 0.41 0.00 1.06 0.00 0.00 176.91 178.77 2ysb h ARG 23 N -0.39 0.27 0.00 1.72 2.47 -2.05 -3.44 114.38 112.96 2ysb h ARG 23 Ca 0.10 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 2ysb h ARG 23 Cb 0.60 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.86 2ysb h ARG 23 CO -0.58 0.18 0.00 0.41 0.56 0.00 0.00 179.97 180.54 2ysb n GLY 24 N -1.33 1.87 3.85 0.04 0.00 0.26 -5.14 105.19 104.74 2ysb n GLY 24 Ca 0.27 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.93 2ysb n GLY 24 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ysb s ARG 25 N 0.00 3.36 -0.28 1.61 0.52 -1.25 -4.84 118.95 118.08 2ysb s ARG 25 Ca 0.00 -0.20 -0.15 0.00 -0.52 0.00 0.00 55.73 54.86 2ysb s ARG 25 Cb 0.00 -3.11 -0.03 0.00 0.52 0.00 0.00 34.95 32.32 2ysb s ARG 25 CO 0.00 0.75 0.37 0.21 0.02 0.00 0.00 175.30 176.65 2ysb s LYS 26 N -1.14 3.97 0.04 3.54 2.20 -1.26 -0.79 119.74 126.30 2ysb s LYS 26 Ca 0.16 -0.02 0.07 0.00 -0.36 0.00 0.00 55.97 55.82 2ysb s LYS 26 Cb -0.12 -3.67 -0.02 0.00 -1.51 0.00 0.00 37.83 32.50 2ysb s LYS 26 CO 0.06 -0.30 -0.19 1.52 -0.36 0.00 0.00 175.35 176.08 2ysb s TYR 27 N 2.06 1.64 -0.17 4.03 1.13 -0.68 -4.86 117.35 120.51 2ysb s TYR 27 Ca 0.14 -0.37 -0.08 0.00 -1.41 0.00 0.00 57.07 55.36 2ysb s TYR 27 Cb -0.16 -0.98 -0.04 0.00 -1.10 0.00 0.00 41.96 39.68 2ysb s TYR 27 CO 0.10 0.07 0.09 0.71 -2.51 0.00 0.00 175.55 174.02 2ysb s TYR 28 N -0.80 3.36 -0.12 -3.49 2.02 -0.88 -1.00 117.35 116.43 2ysb s TYR 28 Ca 0.06 0.25 -0.04 0.00 -0.37 0.00 0.00 57.07 56.97 2ysb s TYR 28 Cb -0.08 -2.04 -0.04 0.00 -0.40 0.00 0.00 41.96 39.39 2ysb s TYR 28 CO 0.02 0.34 0.04 0.42 -1.57 0.00 0.00 175.55 174.80 2ysb s ILE 29 N -0.04 4.66 -0.39 2.71 1.01 0.89 -1.00 121.20 129.04 2ysb s ILE 29 Ca 0.08 -0.10 -0.09 0.00 0.00 0.00 0.00 60.65 60.54 2ysb s ILE 29 Cb -0.12 -3.01 0.06 0.00 0.01 0.00 0.00 42.46 39.40 2ysb s ILE 29 CO 0.00 0.57 0.21 -0.62 0.00 0.00 0.00 174.94 175.11 2ysb s ASP 30 N -0.60 5.57 0.35 3.58 -1.08 0.20 -1.30 116.67 123.39 2ysb s ASP 30 Ca 0.11 -1.32 0.19 0.00 -0.52 0.00 0.00 52.55 51.00 2ysb s ASP 30 Cb -0.12 -1.96 0.30 0.00 -1.46 0.00 0.00 42.92 39.68 2ysb s ASP 30 CO 0.02 -0.46 1.56 0.45 0.52 0.00 0.00 175.17 177.26 2ysb h HIS 31 N 8.36 0.00 -0.04 -5.34 3.86 -1.73 1.84 115.15 122.09 2ysb h HIS 31 Ca -0.23 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 58.77 2ysb h HIS 31 Cb 1.09 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.56 2ysb h HIS 31 CO 0.60 0.33 -0.84 -0.91 0.86 0.00 0.00 177.93 177.97 2ysb h ASN 32 N 0.00 0.53 0.00 2.45 2.35 -1.92 -3.33 115.58 115.66 2ysb h ASN 32 Ca -0.00 -0.39 0.00 0.00 -0.55 0.00 0.00 56.30 55.36 2ysb h ASN 32 Cb 1.17 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.38 2ysb h ASN 32 CO 0.04 1.16 -1.17 0.35 -1.65 0.00 0.00 177.43 176.17 2ysb n THR 33 N -3.79 0.00 -2.88 2.81 -2.24 -1.22 -5.02 114.28 101.94 2ysb n THR 33 Ca -0.06 -0.25 -0.10 0.00 -2.27 0.00 0.00 64.05 61.37 2ysb n THR 33 Cb 0.78 0.49 0.04 0.00 -2.10 0.00 0.00 70.33 69.54 2ysb n THR 33 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2ysb n ASN 34 N -1.67 -2.93 -3.98 3.42 3.02 0.62 -5.05 115.26 108.69 2ysb n ASN 34 Ca -0.01 -0.31 -0.09 0.00 -0.03 0.00 0.00 54.58 54.15 2ysb n ASN 34 Cb 0.24 -2.90 -0.10 0.00 -0.61 0.00 0.00 39.78 36.41 2ysb n ASN 34 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2ysb s THR 35 N -3.18 0.15 0.18 3.41 -4.23 -0.73 -4.94 115.64 106.30 2ysb s THR 35 Ca 0.12 -1.22 0.06 0.00 -1.18 0.00 0.00 61.69 59.47 2ysb s THR 35 Cb -0.05 -0.88 -0.04 0.00 1.34 0.00 0.00 72.50 72.87 2ysb s THR 35 CO 0.38 -0.67 0.14 0.42 -0.54 0.00 0.00 174.62 174.35 2ysb s THR 36 N -2.63 4.42 -0.09 3.99 -4.23 -1.26 0.59 115.64 116.42 2ysb s THR 36 Ca -0.05 -1.18 -0.04 0.00 -1.18 0.00 0.00 61.69 59.24 2ysb s THR 36 Cb -0.01 -3.28 0.05 0.00 1.34 0.00 0.00 72.50 70.60 2ysb s THR 36 CO -0.05 -0.16 0.20 -1.00 -0.54 0.00 0.00 174.62 173.07 2ysb s HIS 37 N -1.83 -0.26 0.24 3.99 3.76 -0.17 -4.98 115.29 116.05 2ysb s HIS 37 Ca 0.31 0.69 -0.06 0.00 -0.15 0.00 0.00 55.06 55.85 2ysb s HIS 37 Cb -0.10 -0.10 0.25 0.00 1.11 0.00 0.00 32.58 33.75 2ysb s HIS 37 CO 0.23 -0.25 1.88 -1.49 -0.85 0.00 0.00 174.74 174.26 2ysb h TRP 38 N 7.78 1.23 -1.97 1.40 -0.00 -1.89 -2.35 115.95 120.15 2ysb h TRP 38 Ca -0.28 -0.01 -0.45 0.00 -0.00 0.00 0.00 58.89 58.15 2ysb h TRP 38 Cb 1.13 -0.40 -0.00 0.00 -0.00 0.00 0.00 29.16 29.89 2ysb h TRP 38 CO 0.40 0.83 -0.38 -1.12 -0.00 0.00 0.00 178.44 178.17 2ysb s SER 39 N -6.22 6.12 0.37 -3.49 0.01 -1.26 -4.69 113.70 104.53 2ysb s SER 39 Ca -0.13 -0.07 -0.28 0.00 1.31 0.00 0.00 55.95 56.78 2ysb s SER 39 Cb 0.17 -1.50 -0.10 0.00 0.21 0.00 0.00 66.02 64.80 2ysb s SER 39 CO 0.82 -0.28 1.39 -2.28 0.41 0.00 0.00 173.24 173.31 2ysb s HIS 40 N -2.10 2.77 0.21 2.43 2.46 -1.26 -4.82 115.29 114.98 2ysb s HIS 40 Ca 0.40 1.30 0.25 0.00 0.47 0.00 0.00 55.06 57.48 2ysb s HIS 40 Cb -0.09 -3.85 1.06 0.00 -0.13 0.00 0.00 32.58 29.57 2ysb s HIS 40 CO 0.30 -2.47 1.89 -1.00 -2.47 0.00 0.00 174.74 170.99 2ysb h PRO 41 N 3.03 0.00 0.04 2.88 0.13 -1.97 -2.74 132.00 133.36 2ysb h PRO 41 Ca -0.50 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.36 2ysb h PRO 41 Cb 1.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 2ysb h PRO 41 CO 0.64 0.20 -1.44 -0.07 -0.23 0.00 0.00 178.00 177.10 2ysb h LEU 42 N 0.00 0.13 -0.26 1.56 3.38 -1.95 -3.29 115.31 114.88 2ysb h LEU 42 Ca -0.00 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.70 2ysb h LEU 42 Cb 0.64 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2ysb h LEU 42 CO 0.03 1.16 -0.14 -0.33 0.09 0.00 0.00 178.44 179.25 2ysb h GLU 43 N 0.02 0.56 -0.12 1.13 5.08 -1.91 -3.23 114.58 116.10 2ysb h GLU 43 Ca -0.19 -0.25 0.03 0.00 -1.00 0.00 0.00 59.36 57.96 2ysb h GLU 43 Cb 1.94 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 31.14 2ysb h GLU 43 CO 0.12 0.81 -0.09 0.66 -1.00 0.00 0.00 179.01 179.51 2ysb h SER 44 N 0.29 -0.30 0.00 1.42 4.64 -1.63 -3.47 113.55 114.50 2ysb h SER 44 Ca 0.06 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2ysb h SER 44 Cb 0.65 0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 2ysb h SER 44 CO 0.04 -0.13 0.00 0.61 -0.87 0.00 0.00 176.83 176.48 2ysb n GLY 45 N -1.24 0.24 3.68 -0.77 0.00 -1.22 -5.14 105.19 100.74 2ysb n GLY 45 Ca -0.03 0.10 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 2ysb n GLY 45 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ysb s PRO 46 N 0.00 0.43 0.02 1.61 0.04 -1.24 -4.90 135.00 130.96 2ysb s PRO 46 Ca 0.00 0.53 -0.37 0.00 0.04 0.00 0.00 61.00 61.21 2ysb s PRO 46 Cb 0.00 -1.74 -0.16 0.00 0.04 0.00 0.00 34.50 32.65 2ysb s PRO 46 CO 0.00 -2.73 1.49 0.43 0.04 0.00 0.00 177.00 176.23 2ysb n SER 47 N -4.18 2.15 0.09 6.66 7.64 -1.26 -4.90 113.62 119.82 2ysb n SER 47 Ca 0.05 1.10 -0.12 0.00 1.01 0.00 0.00 58.87 60.91 2ysb n SER 47 Cb 0.57 -1.24 -0.08 0.00 -1.01 0.00 0.00 64.21 62.46 2ysb n SER 47 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2ysb h SER 48 N 5.58 -0.23 0.00 6.43 0.87 -2.05 -3.55 113.55 120.60 2ysb h SER 48 Ca -0.47 -0.30 0.00 0.00 -1.23 0.00 0.00 61.79 59.79 2ysb h SER 48 Cb 1.31 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.33 2ysb h SER 48 CO 0.84 0.25 0.00 0.61 -0.53 0.00 0.00 176.83 178.00