#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tpn n TYR 2 N 0.00 -2.15 -3.10 1.43 4.02 -1.26 -4.84 117.16 111.26 1tpn n TYR 2 Ca 0.00 -0.14 -0.44 0.00 -0.01 0.00 0.00 57.90 57.30 1tpn n TYR 2 Cb 0.00 -1.48 0.00 0.00 -0.02 0.00 0.00 39.34 37.84 1tpn n TYR 2 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1tpn n GLN 3 N -3.18 3.52 -0.19 -0.72 6.02 -1.26 -4.67 117.38 116.90 1tpn n GLN 3 Ca 0.05 -4.15 0.08 0.00 -0.01 0.00 0.00 57.00 52.97 1tpn n GLN 3 Cb 0.53 -2.78 0.18 0.00 1.02 0.00 0.00 30.24 29.19 1tpn n GLN 3 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1tpn n VAL 4 N 3.48 0.76 -2.73 5.09 0.24 -1.26 -4.65 118.33 119.26 1tpn n VAL 4 Ca 0.31 -0.88 -0.19 0.00 -2.04 0.00 0.00 64.34 61.54 1tpn n VAL 4 Cb 0.40 0.70 0.09 0.00 -1.47 0.00 0.00 33.84 33.56 1tpn n VAL 4 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 1tpn n ILE 5 N 0.94 0.00 -3.52 1.34 -5.35 -1.26 -1.12 119.36 110.39 1tpn n ILE 5 Ca 0.15 -1.48 -0.11 0.00 -0.27 0.00 0.00 62.75 61.04 1tpn n ILE 5 Cb 0.48 -0.82 -0.10 0.00 -1.74 0.00 0.00 39.64 37.46 1tpn n ILE 5 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1tpn s ARG 7 N 2.52 4.07 -0.26 0.00 3.52 -1.26 -1.52 118.95 126.02 1tpn s ARG 7 Ca 0.06 0.59 -0.15 0.00 -0.13 0.00 0.00 55.73 56.10 1tpn s ARG 7 Cb -0.14 -3.67 -0.04 0.00 -1.56 0.00 0.00 34.95 29.54 1tpn s ARG 7 CO -0.13 -0.50 0.38 0.34 -0.81 0.00 0.00 175.30 174.57 1tpn s ASP 8 N 1.50 6.29 0.00 -2.12 2.15 -0.91 -4.93 116.67 118.64 1tpn s ASP 8 Ca 0.29 0.33 0.29 0.00 0.43 0.00 0.00 52.55 53.89 1tpn s ASP 8 Cb -0.15 -2.21 1.37 0.00 -0.30 0.00 0.00 42.92 41.63 1tpn s ASP 8 CO 0.09 -0.16 1.94 -1.84 -0.17 0.00 0.00 175.17 175.03 1tpn n GLU 9 N 5.16 0.91 0.06 4.34 0.28 -1.26 0.63 120.64 130.76 1tpn n GLU 9 Ca -0.08 -0.29 0.13 0.00 -0.16 0.00 0.00 57.16 56.75 1tpn n GLU 9 Cb 0.51 -1.49 0.35 0.00 1.43 0.00 0.00 31.44 32.23 1tpn n GLU 9 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1tpn n LYS 10 N -0.79 0.20 0.00 3.44 3.00 -1.26 -4.19 118.16 118.55 1tpn n LYS 10 Ca 0.17 0.11 0.00 0.00 -0.00 0.00 0.00 58.31 58.59 1tpn n LYS 10 Cb 0.25 -1.68 0.00 0.00 0.00 0.00 0.00 35.03 33.60 1tpn n LYS 10 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1tpn n THR 11 N -1.99 0.00 -3.50 3.15 5.66 -1.22 -5.01 114.28 111.37 1tpn n THR 11 Ca 0.05 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.84 1tpn n THR 11 Cb 0.41 0.87 0.08 0.00 -1.55 0.00 0.00 70.33 70.14 1tpn n THR 11 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1tpn n GLN 12 N 0.00 -7.31 -4.60 1.09 3.00 0.21 -4.99 117.38 104.78 1tpn n GLN 12 Ca 0.00 0.80 -0.28 0.00 -0.01 0.00 0.00 57.00 57.51 1tpn n GLN 12 Cb 0.14 -5.74 -0.17 0.00 0.00 0.00 0.00 30.24 24.47 1tpn n GLN 12 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.06 178.47 1tpn s MET 13 N -6.01 2.26 0.45 -1.09 1.75 -0.95 -4.91 119.30 110.79 1tpn s MET 13 Ca 0.41 -0.59 -0.03 0.00 -1.25 0.00 0.00 55.69 54.24 1tpn s MET 13 Cb -0.18 -1.87 -0.03 0.00 2.84 0.00 0.00 34.83 35.59 1tpn s MET 13 CO 0.70 -0.01 0.72 0.42 -0.65 0.00 0.00 175.02 176.20 1tpn s ILE 14 N 0.83 4.82 0.13 10.11 1.01 -1.26 -2.14 121.20 134.70 1tpn s ILE 14 Ca -0.10 -0.05 0.03 0.00 0.00 0.00 0.00 60.65 60.52 1tpn s ILE 14 Cb -0.16 -3.81 -0.01 0.00 0.01 0.00 0.00 42.46 38.49 1tpn s ILE 14 CO 0.01 -0.71 0.12 -1.22 0.00 0.00 0.00 174.94 173.15 1tpn n TYR 15 N -2.13 -0.38 -2.53 3.97 4.01 -0.57 -4.93 117.16 114.60 1tpn n TYR 15 Ca -0.01 -1.11 0.00 0.00 -0.16 0.00 0.00 57.90 56.62 1tpn n TYR 15 Cb 0.56 0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.72 1tpn n TYR 15 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1tpn n GLN 16 N -0.25 1.43 -2.87 -0.72 6.02 -1.26 -1.91 117.38 117.82 1tpn n GLN 16 Ca 0.03 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.69 1tpn n GLN 16 Cb 0.24 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.43 1tpn n GLN 16 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 1tpn s GLN 17 N -0.76 4.20 -0.54 -1.09 0.74 -0.28 -3.61 119.66 118.32 1tpn s GLN 17 Ca 0.00 1.05 0.00 0.00 0.05 0.00 0.00 55.36 56.46 1tpn s GLN 17 Cb 0.00 -2.23 0.00 0.00 1.10 0.00 0.00 33.01 31.88 1tpn s GLN 17 CO 0.00 0.01 0.00 1.58 -0.55 0.00 0.00 175.29 176.33 1tpn n HIS 18 N -0.57 -1.01 -3.38 1.67 -0.00 -0.31 -4.85 115.22 106.76 1tpn n HIS 18 Ca 0.06 0.00 -0.38 0.00 0.46 0.00 0.00 57.72 57.86 1tpn n HIS 18 Cb 0.54 -1.68 -0.07 0.00 -0.12 0.00 0.00 29.99 28.66 1tpn n HIS 18 CO 0.00 0.00 0.00 -1.14 0.46 0.00 0.00 176.34 175.66 1tpn s GLN 19 N -3.15 4.18 -0.10 1.57 0.74 -1.24 -4.78 119.66 116.88 1tpn s GLN 19 Ca 0.00 0.22 -0.16 0.00 0.05 0.00 0.00 55.36 55.46 1tpn s GLN 19 Cb 0.00 -3.54 -0.05 0.00 1.10 0.00 0.00 33.01 30.53 1tpn s GLN 19 CO 0.00 -0.05 0.41 -1.54 -0.55 0.00 0.00 175.29 173.57 1tpn s SER 20 N 1.05 6.65 -0.10 6.67 1.04 -1.26 -2.65 113.70 125.09 1tpn s SER 20 Ca 0.19 0.77 -0.03 0.00 0.48 0.00 0.00 55.95 57.36 1tpn s SER 20 Cb -0.15 -2.25 0.05 0.00 0.10 0.00 0.00 66.02 63.77 1tpn s SER 20 CO 0.08 0.10 0.12 -1.66 0.98 0.00 0.00 173.24 172.86 1tpn s TRP 21 N 0.21 -0.03 0.34 5.02 -2.14 -0.43 -4.99 118.94 116.91 1tpn s TRP 21 Ca 0.23 0.24 -0.26 0.00 2.66 0.00 0.00 56.10 58.97 1tpn s TRP 21 Cb -0.15 -0.44 -0.10 0.00 -3.10 0.00 0.00 33.47 29.68 1tpn s TRP 21 CO 0.09 -0.34 0.97 -0.51 -2.66 0.00 0.00 176.95 174.50 1tpn s LEU 22 N 2.22 4.31 0.09 -4.66 2.01 -1.26 -2.81 118.68 118.58 1tpn s LEU 22 Ca 0.04 1.90 0.06 0.00 0.01 0.00 0.00 54.13 56.14 1tpn s LEU 22 Cb -0.13 -4.03 -0.04 0.00 0.01 0.00 0.00 46.19 42.00 1tpn s LEU 22 CO -0.06 -0.16 -0.09 -0.13 1.01 0.00 0.00 176.35 176.92 1tpn s ARG 23 N -2.11 2.20 1.22 1.70 3.00 0.85 -4.96 118.95 120.85 1tpn s ARG 23 Ca 0.51 -0.98 -0.17 0.00 0.00 0.00 0.00 55.73 55.10 1tpn s ARG 23 Cb -0.20 -2.34 0.25 0.00 0.00 0.00 0.00 34.95 32.67 1tpn s ARG 23 CO 0.25 0.52 0.63 -2.30 0.00 0.00 0.00 175.30 174.41 1tpn n PRO 24 N 0.84 -2.77 -2.50 3.54 -0.01 -1.26 -1.86 135.00 130.99 1tpn n PRO 24 Ca -0.14 -0.80 -0.30 0.00 -0.01 0.00 0.00 63.50 62.26 1tpn n PRO 24 Cb 0.52 -1.92 -0.01 0.00 -0.01 0.00 0.00 33.50 32.08 1tpn n PRO 24 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 175.50 175.63 1tpn s VAL 25 N -2.26 4.78 -0.00 -1.45 -7.23 -1.24 -4.15 120.40 108.84 1tpn s VAL 25 Ca 0.62 0.61 -0.07 0.00 -1.81 0.00 0.00 61.98 61.33 1tpn s VAL 25 Cb -0.17 -3.81 -0.04 0.00 0.56 0.00 0.00 36.38 32.92 1tpn s VAL 25 CO 0.61 -0.80 0.66 -0.07 -0.31 0.00 0.00 175.10 175.19 1tpn h LEU 26 N 0.50 -0.21 0.00 1.32 4.07 -1.94 -3.45 115.31 115.59 1tpn h LEU 26 Ca -0.46 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.50 1tpn h LEU 26 Cb 1.19 0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.99 1tpn h LEU 26 CO 0.62 -0.08 0.00 0.54 -1.08 0.00 0.00 178.44 178.45 1tpn n ARG 27 N -3.08 2.87 0.00 1.13 1.74 -1.26 -5.06 116.66 112.99 1tpn n ARG 27 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 1tpn n ARG 27 Cb 0.10 -0.24 0.00 0.00 -1.02 0.00 0.00 32.46 31.30 1tpn n ARG 27 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1tpn n SER 28 N 0.00 0.00 -0.14 0.55 7.64 -1.26 -5.03 113.62 115.38 1tpn n SER 28 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1tpn n SER 28 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1tpn n SER 28 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1tpn n ASN 29 N 0.00 0.00 -4.85 6.43 2.85 -1.26 -5.00 115.26 113.42 1tpn n ASN 29 Ca 0.00 -1.12 -0.32 0.00 -0.11 0.00 0.00 54.58 53.03 1tpn n ASN 29 Cb 0.00 -0.02 -0.06 0.00 1.24 0.00 0.00 39.78 40.94 1tpn n ASN 29 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 1tpn s ARG 30 N 0.00 3.96 -0.14 1.20 0.52 -1.26 -4.51 118.95 118.72 1tpn s ARG 30 Ca 0.00 0.60 -0.07 0.00 -0.52 0.00 0.00 55.73 55.75 1tpn s ARG 30 Cb 0.00 -2.46 -0.04 0.00 0.52 0.00 0.00 34.95 32.97 1tpn s ARG 30 CO 0.00 0.17 0.09 0.14 0.02 0.00 0.00 175.30 175.72 1tpn s VAL 31 N -1.98 5.07 -0.30 3.52 -7.23 -1.26 -3.68 120.40 114.55 1tpn s VAL 31 Ca 0.53 0.05 -0.21 0.00 -1.81 0.00 0.00 61.98 60.54 1tpn s VAL 31 Cb -0.10 -3.23 -0.01 0.00 0.56 0.00 0.00 36.38 33.60 1tpn s VAL 31 CO 0.18 0.55 0.68 -1.61 -0.31 0.00 0.00 175.10 174.60 1tpn s GLU 32 N -0.44 3.94 -0.44 4.82 2.02 -0.78 -3.50 118.70 124.31 1tpn s GLU 32 Ca 0.11 0.41 -0.19 0.00 0.02 0.00 0.00 54.97 55.32 1tpn s GLU 32 Cb -0.12 -3.72 0.03 0.00 0.10 0.00 0.00 34.13 30.42 1tpn s GLU 32 CO 0.02 -0.60 0.56 -0.47 0.02 0.00 0.00 175.26 174.79 1tpn s TYR 33 N 2.71 3.10 -0.21 1.61 6.14 -0.24 -0.10 117.35 130.37 1tpn s TYR 33 Ca 0.28 -0.26 0.01 0.00 0.64 0.00 0.00 57.07 57.74 1tpn s TYR 33 Cb -0.15 -3.21 0.04 0.00 0.42 0.00 0.00 41.96 39.07 1tpn s TYR 33 CO 0.12 -0.83 -0.13 0.00 0.64 0.00 0.00 175.55 175.34 1tpn s TRP 35 N 1.30 1.60 -0.29 0.00 -2.14 0.27 -1.32 118.94 118.36 1tpn s TRP 35 Ca -0.01 -0.49 -0.25 0.00 2.66 0.00 0.00 56.10 58.01 1tpn s TRP 35 Cb -0.16 -0.84 0.00 0.00 -3.10 0.00 0.00 33.47 29.38 1tpn s TRP 35 CO -0.09 0.21 0.88 0.00 -2.66 0.00 0.00 176.95 175.29 1tpn n ASN 37 N 6.33 0.68 0.00 0.00 2.85 -1.26 -1.16 115.26 122.70 1tpn n ASN 37 Ca 0.07 0.05 0.00 0.00 -0.11 0.00 0.00 54.58 54.58 1tpn n ASN 37 Cb 0.48 0.31 0.00 0.00 1.24 0.00 0.00 39.78 41.81 1tpn n ASN 37 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1tpn n SER 38 N -2.08 0.00 0.00 1.20 3.41 -1.26 -4.87 113.62 110.03 1tpn n SER 38 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 1tpn n SER 38 Cb 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 1tpn n SER 38 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tpn n GLY 39 N -0.48 -0.02 0.00 5.00 0.00 -1.26 -4.64 105.19 103.79 1tpn n GLY 39 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1tpn n GLY 39 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1tpn n ARG 40 N 0.00 1.73 -2.75 1.61 1.85 -1.26 -4.78 116.66 113.06 1tpn n ARG 40 Ca 0.00 -1.16 -0.01 0.00 -1.00 0.00 0.00 57.85 55.68 1tpn n ARG 40 Cb 0.00 -0.97 -0.01 0.00 -1.05 0.00 0.00 32.46 30.43 1tpn n ARG 40 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1tpn n ALA 41 N -0.33 -3.33 -2.32 2.89 0.00 -1.26 -4.96 120.51 111.19 1tpn n ALA 41 Ca 0.00 0.84 -0.34 0.00 0.00 0.00 0.00 53.44 53.93 1tpn n ALA 41 Cb 0.19 -1.71 -0.06 0.00 0.00 0.00 0.00 19.45 17.87 1tpn n ALA 41 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1tpn s GLN 42 N -1.34 3.98 0.20 0.00 -0.44 0.44 -4.86 119.66 117.64 1tpn s GLN 42 Ca -0.06 0.51 -0.12 0.00 -2.50 0.00 0.00 55.36 53.19 1tpn s GLN 42 Cb 0.00 -2.82 0.00 0.00 -1.64 0.00 0.00 33.01 28.55 1tpn s GLN 42 CO 0.69 0.41 0.41 0.00 0.50 0.00 0.00 175.29 177.30 1tpn s HIS 44 N -3.95 0.26 -0.13 0.00 -3.43 0.63 -4.99 115.29 103.67 1tpn s HIS 44 Ca 0.16 -0.69 -0.00 0.00 -0.80 0.00 0.00 55.06 53.73 1tpn s HIS 44 Cb 0.01 0.42 0.03 0.00 -1.43 0.00 0.00 32.58 31.60 1tpn s HIS 44 CO 0.02 -1.19 -0.10 0.45 -2.00 0.00 0.00 174.74 171.92 1tpn s SER 45 N -3.03 2.47 -0.17 7.38 0.15 -1.26 -1.08 113.70 118.16 1tpn s SER 45 Ca 0.19 -0.42 -0.01 0.00 0.70 0.00 0.00 55.95 56.41 1tpn s SER 45 Cb -0.03 -0.99 0.05 0.00 -1.71 0.00 0.00 66.02 63.34 1tpn s SER 45 CO 0.10 -0.10 -0.03 -0.69 1.20 0.00 0.00 173.24 173.73 1tpn s VAL 46 N 1.61 0.93 1.40 4.45 1.01 -1.23 -5.02 120.40 123.55 1tpn s VAL 46 Ca 0.04 -0.58 -0.21 0.00 0.00 0.00 0.00 61.98 61.24 1tpn s VAL 46 Cb -0.13 -1.18 0.36 0.00 0.00 0.00 0.00 36.38 35.43 1tpn s VAL 46 CO -0.09 0.05 0.93 -2.16 0.00 0.00 0.00 175.10 173.83 1tpn s PRO 47 N 1.70 -2.74 0.36 2.72 0.05 -1.26 -4.00 135.00 131.83 1tpn s PRO 47 Ca 0.00 0.34 0.23 0.00 0.05 0.00 0.00 61.00 61.62 1tpn s PRO 47 Cb -0.16 -1.38 0.23 0.00 0.05 0.00 0.00 34.50 33.24 1tpn s PRO 47 CO -0.07 -4.80 1.42 -0.24 0.05 0.00 0.00 177.00 173.36 1tpn h VAL 48 N -3.37 0.00 -3.58 -0.36 3.04 -1.96 -3.41 116.25 106.62 1tpn h VAL 48 Ca -0.48 -1.00 -0.78 0.00 -1.01 0.00 0.00 66.70 63.43 1tpn h VAL 48 Cb 1.35 1.84 -0.25 0.00 -2.01 0.00 0.00 31.29 32.21 1tpn h VAL 48 CO 0.33 0.00 0.10 -0.75 -1.01 0.00 0.00 177.57 176.24 1tpn s LYS 49 N -3.26 3.49 0.00 4.17 2.20 -1.26 -5.18 119.74 119.89 1tpn s LYS 49 Ca 0.05 -2.26 0.00 0.00 -0.36 0.00 0.00 55.97 53.40 1tpn s LYS 49 Cb 0.06 -4.44 0.00 0.00 -1.51 0.00 0.00 37.83 31.95 1tpn s LYS 49 CO 0.71 -1.34 0.12 0.45 -0.36 0.00 0.00 175.35 174.94