#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tpn s TYR 2 N 0.00 0.14 -0.49 1.43 1.51 -1.26 -5.12 117.35 113.56 1tpn s TYR 2 Ca 0.00 -0.55 -0.15 0.00 -1.01 0.00 0.00 57.07 55.35 1tpn s TYR 2 Cb 0.00 -0.03 0.09 0.00 -0.11 0.00 0.00 41.96 41.92 1tpn s TYR 2 CO 0.00 -0.58 0.42 -0.65 -1.11 0.00 0.00 175.55 173.63 1tpn s GLN 3 N -3.87 2.96 0.00 -0.62 -0.21 -1.26 -4.88 119.66 111.79 1tpn s GLN 3 Ca 0.06 -1.47 0.19 0.00 0.02 0.00 0.00 55.36 54.16 1tpn s GLN 3 Cb 0.04 -4.17 0.32 0.00 1.00 0.00 0.00 33.01 30.20 1tpn s GLN 3 CO -0.10 -1.12 1.26 1.33 -2.12 0.00 0.00 175.29 174.54 1tpn n VAL 4 N 5.20 0.43 -3.85 1.09 0.24 -1.26 -4.48 118.33 115.70 1tpn n VAL 4 Ca -0.13 -0.71 -0.23 0.00 -2.04 0.00 0.00 64.34 61.23 1tpn n VAL 4 Cb 0.42 1.02 -0.05 0.00 -1.47 0.00 0.00 33.84 33.76 1tpn n VAL 4 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1tpn s ILE 5 N -1.36 2.45 -0.13 1.34 -4.36 -1.26 0.15 121.20 118.02 1tpn s ILE 5 Ca 0.30 -1.52 -0.04 0.00 -0.26 0.00 0.00 60.65 59.14 1tpn s ILE 5 Cb 0.18 -2.96 0.06 0.00 1.25 0.00 0.00 42.46 40.99 1tpn s ILE 5 CO 0.26 0.00 0.16 0.00 0.24 0.00 0.00 174.94 175.60 1tpn s ARG 7 N 2.27 3.79 -0.36 0.00 3.52 -1.26 -1.18 118.95 125.72 1tpn s ARG 7 Ca 0.04 0.26 -0.15 0.00 -0.13 0.00 0.00 55.73 55.75 1tpn s ARG 7 Cb -0.14 -3.78 -0.01 0.00 -1.56 0.00 0.00 34.95 29.47 1tpn s ARG 7 CO -0.08 -0.73 0.35 0.34 -0.81 0.00 0.00 175.30 174.38 1tpn s ASP 8 N 1.75 6.16 0.00 -2.12 -1.08 -0.97 -4.93 116.67 115.49 1tpn s ASP 8 Ca 0.28 -0.35 0.30 0.00 -0.52 0.00 0.00 52.55 52.25 1tpn s ASP 8 Cb -0.14 -2.19 1.50 0.00 -1.46 0.00 0.00 42.92 40.63 1tpn s ASP 8 CO 0.14 -0.36 2.01 -1.84 0.52 0.00 0.00 175.17 175.64 1tpn n GLU 9 N 5.36 1.01 0.07 4.34 0.28 -1.26 -0.01 120.64 130.42 1tpn n GLU 9 Ca -0.09 -0.27 0.13 0.00 -0.16 0.00 0.00 57.16 56.76 1tpn n GLU 9 Cb 0.49 -1.49 0.35 0.00 1.43 0.00 0.00 31.44 32.22 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 -0.76 0.21 0.00 3.44 3.00 -1.26 -4.14 118.16 118.65 1tpn n LYS 10 Ca 0.19 0.12 0.00 0.00 -0.00 0.00 0.00 58.31 58.63 1tpn n LYS 10 Cb 0.22 -1.69 0.00 0.00 0.00 0.00 0.00 35.03 33.56 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 -2.03 0.00 -2.71 3.15 5.66 -1.21 -5.03 114.28 112.11 1tpn n THR 11 Ca 0.05 -0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.99 1tpn n THR 11 Cb 0.41 0.16 0.02 0.00 -1.55 0.00 0.00 70.33 69.37 1tpn n THR 11 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 175.07 173.69 1tpn n GLN 12 N -0.10 -1.76 -4.34 1.09 7.27 0.99 -5.05 117.38 115.48 1tpn n GLN 12 Ca 0.00 0.19 -0.21 0.00 0.07 0.00 0.00 57.00 57.05 1tpn n GLN 12 Cb 0.00 -3.26 -0.16 0.00 2.41 0.00 0.00 30.24 29.23 1tpn n GLN 12 CO 0.00 0.00 0.00 1.41 0.07 0.00 0.00 177.06 178.54 1tpn s MET 13 N -5.21 1.04 0.05 3.69 1.75 -0.97 -4.97 119.30 114.67 1tpn s MET 13 Ca 0.12 -0.25 -0.10 0.00 -1.25 0.00 0.00 55.69 54.21 1tpn s MET 13 Cb -0.05 -0.95 -0.06 0.00 2.84 0.00 0.00 34.83 36.61 1tpn s MET 13 CO 0.16 0.03 0.37 0.42 -0.65 0.00 0.00 175.02 175.36 1tpn s ILE 14 N 0.52 5.13 0.40 10.11 1.01 -1.26 -2.28 121.20 134.82 1tpn s ILE 14 Ca -0.08 0.47 0.04 0.00 0.00 0.00 0.00 60.65 61.08 1tpn s ILE 14 Cb -0.12 -3.64 -0.05 0.00 0.01 0.00 0.00 42.46 38.66 1tpn s ILE 14 CO 0.01 0.36 0.04 -0.31 0.00 0.00 0.00 174.94 175.04 1tpn s TYR 15 N -1.32 2.08 0.32 3.97 1.51 -0.33 -4.92 117.35 118.68 1tpn s TYR 15 Ca 0.30 -0.92 -0.03 0.00 -1.01 0.00 0.00 57.07 55.41 1tpn s TYR 15 Cb -0.14 -1.47 0.07 0.00 -0.11 0.00 0.00 41.96 40.30 1tpn s TYR 15 CO 0.16 0.13 0.44 1.04 -1.11 0.00 0.00 175.55 176.22 1tpn n GLN 16 N -0.92 0.01 -2.59 -0.62 6.02 -1.26 -0.63 117.38 117.39 1tpn n GLN 16 Ca -0.07 -0.97 -0.35 0.00 -0.01 0.00 0.00 57.00 55.60 1tpn n GLN 16 Cb 0.67 -0.37 -0.04 0.00 1.02 0.00 0.00 30.24 31.51 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 -3.72 4.06 -1.22 -1.09 0.74 0.38 -3.09 119.66 115.72 1tpn s GLN 17 Ca 0.27 1.41 0.00 0.00 0.05 0.00 0.00 55.36 57.09 1tpn s GLN 17 Cb -0.01 -2.35 0.00 0.00 1.10 0.00 0.00 33.01 31.75 1tpn s GLN 17 CO 0.19 -0.21 0.00 0.72 -0.55 0.00 0.00 175.29 175.43 1tpn n HIS 18 N -0.43 -0.39 -3.29 1.67 8.25 0.60 -4.88 115.22 116.76 1tpn n HIS 18 Ca 0.07 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.15 1tpn n HIS 18 Cb 0.51 -2.39 -0.06 0.00 1.12 0.00 0.00 29.99 29.18 1tpn n HIS 18 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1tpn s GLN 19 N -2.92 4.34 -0.16 -0.41 2.00 -1.18 -4.76 119.66 116.57 1tpn s GLN 19 Ca 0.00 0.50 -0.11 0.00 -2.00 0.00 0.00 55.36 53.75 1tpn s GLN 19 Cb 0.00 -3.43 -0.05 0.00 0.80 0.00 0.00 33.01 30.33 1tpn s GLN 19 CO 0.00 0.16 0.21 -1.54 -0.50 0.00 0.00 175.29 173.62 1tpn s SER 20 N 0.60 6.36 -0.06 6.67 1.04 -1.26 -2.08 113.70 124.96 1tpn s SER 20 Ca 0.27 0.42 -0.03 0.00 0.48 0.00 0.00 55.95 57.10 1tpn s SER 20 Cb -0.15 -2.13 0.04 0.00 0.10 0.00 0.00 66.02 63.87 1tpn s SER 20 CO 0.11 0.20 0.12 -1.66 0.98 0.00 0.00 173.24 172.99 1tpn s TRP 21 N 0.08 -0.09 0.72 5.02 -2.14 0.37 -4.99 118.94 117.92 1tpn s TRP 21 Ca 0.13 0.45 -0.11 0.00 2.66 0.00 0.00 56.10 59.22 1tpn s TRP 21 Cb -0.12 -0.30 0.03 0.00 -3.10 0.00 0.00 33.47 29.97 1tpn s TRP 21 CO 0.02 -0.22 1.10 -0.51 -2.66 0.00 0.00 176.95 174.69 1tpn s LEU 22 N 1.99 2.83 0.08 -4.66 2.01 -1.26 -2.83 118.68 116.84 1tpn s LEU 22 Ca 0.01 1.13 0.03 0.00 0.01 0.00 0.00 54.13 55.30 1tpn s LEU 22 Cb -0.12 -3.88 -0.03 0.00 0.01 0.00 0.00 46.19 42.16 1tpn s LEU 22 CO -0.05 -1.46 -0.08 -0.13 1.01 0.00 0.00 176.35 175.64 1tpn s ARG 23 N -5.35 0.74 1.07 1.70 0.52 0.14 -4.93 118.95 112.84 1tpn s ARG 23 Ca 0.59 -1.09 -0.12 0.00 -0.52 0.00 0.00 55.73 54.58 1tpn s ARG 23 Cb -0.11 -0.35 0.21 0.00 0.52 0.00 0.00 34.95 35.21 1tpn s ARG 23 CO 0.52 0.04 0.92 -0.35 0.02 0.00 0.00 175.30 176.45 1tpn n PRO 24 N 0.65 -1.56 -2.55 3.54 -0.04 -1.26 -2.48 135.00 131.30 1tpn n PRO 24 Ca -0.17 -0.41 -0.24 0.00 -0.04 0.00 0.00 63.50 62.64 1tpn n PRO 24 Cb 0.58 -2.17 0.11 0.00 -0.04 0.00 0.00 33.50 31.98 1tpn n PRO 24 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1tpn s VAL 25 N -2.47 2.12 0.00 0.52 -7.23 -1.26 -4.29 120.40 107.79 1tpn s VAL 25 Ca 0.66 -0.56 0.00 0.00 -1.81 0.00 0.00 61.98 60.27 1tpn s VAL 25 Cb -0.23 -2.56 0.00 0.00 0.56 0.00 0.00 36.38 34.15 1tpn s VAL 25 CO 0.63 0.00 0.03 0.00 -0.31 0.00 0.00 175.10 175.45 1tpn n LEU 26 N -2.90 0.50 0.00 1.32 -0.00 -1.26 -4.91 117.00 109.75 1tpn n LEU 26 Ca 0.15 0.43 0.00 0.00 -0.00 0.00 0.00 56.01 56.59 1tpn n LEU 26 Cb 0.61 -0.41 0.00 0.00 -0.00 0.00 0.00 43.42 43.61 1tpn n LEU 26 CO 0.42 -0.41 0.00 0.54 -0.00 0.00 0.00 177.39 177.94 1tpn n ARG 27 N -1.74 1.99 0.00 1.47 1.74 -1.26 -5.07 116.66 113.80 1tpn n ARG 27 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1tpn n ARG 27 Cb 0.00 -0.17 0.00 0.00 -1.02 0.00 0.00 32.46 31.27 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 -0.37 0.55 7.64 -1.26 -5.03 113.62 115.16 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 0.59 -3.01 0.00 0.00 175.04 172.62 1tpn n ASN 29 N 0.00 0.00 -4.77 6.43 3.02 -1.26 -5.04 115.26 113.64 1tpn n ASN 29 Ca 0.00 -1.33 -0.39 0.00 -0.03 0.00 0.00 54.58 52.83 1tpn n ASN 29 Cb 0.00 -0.07 -0.06 0.00 -0.61 0.00 0.00 39.78 39.05 1tpn n ASN 29 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1tpn s ARG 30 N 0.00 4.43 -0.04 3.52 1.04 -1.26 -4.13 118.95 122.51 1tpn s ARG 30 Ca 0.00 0.98 -0.02 0.00 -1.04 0.00 0.00 55.73 55.65 1tpn s ARG 30 Cb 0.00 -3.31 -0.04 0.00 -2.04 0.00 0.00 34.95 29.56 1tpn s ARG 30 CO 0.00 0.44 0.09 0.14 -0.04 0.00 0.00 175.30 175.93 1tpn s VAL 31 N -0.58 4.87 -0.20 4.99 -7.23 -1.26 -3.98 120.40 117.01 1tpn s VAL 31 Ca 0.35 -0.24 -0.13 0.00 -1.81 0.00 0.00 61.98 60.15 1tpn s VAL 31 Cb -0.21 -3.18 -0.04 0.00 0.56 0.00 0.00 36.38 33.51 1tpn s VAL 31 CO 0.22 0.45 0.29 -1.61 -0.31 0.00 0.00 175.10 174.13 1tpn s GLU 32 N -1.46 4.17 -0.18 4.82 2.02 -1.03 -3.18 118.70 123.85 1tpn s GLU 32 Ca 0.20 0.01 -0.01 0.00 0.02 0.00 0.00 54.97 55.19 1tpn s GLU 32 Cb -0.12 -3.50 -0.00 0.00 0.10 0.00 0.00 34.13 30.61 1tpn s GLU 32 CO 0.10 0.08 -0.12 -0.47 0.02 0.00 0.00 175.26 174.87 1tpn s TYR 33 N 0.97 2.85 0.00 1.61 5.04 -1.03 0.28 117.35 127.08 1tpn s TYR 33 Ca 0.14 -1.05 -0.02 0.00 -2.44 0.00 0.00 57.07 53.71 1tpn s TYR 33 Cb -0.14 -1.97 -0.01 0.00 0.35 0.00 0.00 41.96 40.20 1tpn s TYR 33 CO 0.05 -0.52 0.03 0.00 -1.34 0.00 0.00 175.55 173.77 1tpn s TRP 35 N -0.96 0.18 -0.37 0.00 -2.14 0.90 -0.48 118.94 116.07 1tpn s TRP 35 Ca -0.11 -0.49 -0.28 0.00 2.66 0.00 0.00 56.10 57.89 1tpn s TRP 35 Cb -0.06 -0.12 0.02 0.00 -3.10 0.00 0.00 33.47 30.20 1tpn s TRP 35 CO -0.00 -0.40 1.02 0.00 -2.66 0.00 0.00 176.95 174.91 1tpn h ASN 37 N 8.49 0.00 0.00 0.00 -0.73 -1.91 0.17 115.58 121.61 1tpn h ASN 37 Ca -0.22 -0.04 0.00 0.00 1.87 0.00 0.00 56.30 57.91 1tpn h ASN 37 Cb 1.07 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.66 1tpn h ASN 37 CO 1.03 0.02 0.00 -1.20 -0.37 0.00 0.00 177.43 176.91 1tpn n SER 38 N -2.64 0.00 0.00 1.15 7.64 -1.26 -4.81 113.62 113.70 1tpn n SER 38 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 1tpn n SER 38 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1tpn n SER 38 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tpn n GLY 39 N -0.04 -0.21 0.04 0.23 0.00 -1.26 -4.61 105.19 99.33 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 -0.72 -2.59 1.61 1.85 -1.26 -4.85 116.66 110.70 1tpn n ARG 40 Ca 0.00 -0.59 -0.05 0.00 -1.00 0.00 0.00 57.85 56.20 1tpn n ARG 40 Cb 0.00 -1.02 -0.05 0.00 -1.05 0.00 0.00 32.46 30.35 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 0.03 -3.72 -2.56 2.89 0.00 -1.26 -4.89 120.51 111.00 1tpn n ALA 41 Ca 0.01 2.31 -0.42 0.00 0.00 0.00 0.00 53.44 55.34 1tpn n ALA 41 Cb 0.03 -4.52 -0.06 0.00 0.00 0.00 0.00 19.45 14.90 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 -0.75 3.56 0.09 0.00 -0.44 0.29 -4.89 119.66 117.52 1tpn s GLN 42 Ca -0.27 0.01 0.09 0.00 -2.50 0.00 0.00 55.36 52.70 1tpn s GLN 42 Cb 0.02 -3.87 -0.04 0.00 -1.64 0.00 0.00 33.01 27.49 1tpn s GLN 42 CO 0.79 -0.91 -0.23 0.00 0.50 0.00 0.00 175.29 175.44 1tpn n HIS 44 N 1.19 -0.54 -3.68 0.00 1.44 -0.40 -4.99 115.22 108.24 1tpn n HIS 44 Ca -0.17 -0.02 -0.13 0.00 -2.01 0.00 0.00 57.72 55.39 1tpn n HIS 44 Cb 0.53 0.01 -0.13 0.00 0.12 0.00 0.00 29.99 30.51 1tpn n HIS 44 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1tpn s SER 45 N -1.02 0.12 -0.27 4.39 0.15 -1.26 -2.46 113.70 113.35 1tpn s SER 45 Ca 0.00 0.63 0.02 0.00 0.70 0.00 0.00 55.95 57.31 1tpn s SER 45 Cb -0.00 0.70 0.07 0.00 -1.71 0.00 0.00 66.02 65.08 1tpn s SER 45 CO 0.00 -0.22 -0.06 -0.69 1.20 0.00 0.00 173.24 173.48 1tpn s VAL 46 N 2.14 1.92 1.29 4.45 1.01 -1.19 -4.98 120.40 125.04 1tpn s VAL 46 Ca -0.02 -1.61 -0.16 0.00 0.00 0.00 0.00 61.98 60.19 1tpn s VAL 46 Cb -0.11 -2.16 0.33 0.00 0.00 0.00 0.00 36.38 34.43 1tpn s VAL 46 CO -0.09 -0.18 0.98 -2.16 0.00 0.00 0.00 175.10 173.65 1tpn s PRO 47 N 1.19 -1.88 0.00 2.72 0.05 -1.26 -3.97 135.00 131.84 1tpn s PRO 47 Ca -0.04 0.61 0.00 0.00 0.05 0.00 0.00 61.00 61.62 1tpn s PRO 47 Cb -0.19 -1.46 0.00 0.00 0.05 0.00 0.00 34.50 32.90 1tpn s PRO 47 CO -0.07 -4.30 0.87 1.55 0.05 0.00 0.00 177.00 175.11 1tpn n VAL 48 N -5.29 1.53 -2.24 -0.36 3.14 -1.26 -4.44 118.33 109.41 1tpn n VAL 48 Ca 0.05 0.43 -0.41 0.00 -2.96 0.00 0.00 64.34 61.46 1tpn n VAL 48 Cb 0.56 -1.43 -0.03 0.00 -1.06 0.00 0.00 33.84 31.88 1tpn n VAL 48 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 1tpn s LYS 49 N -2.75 3.06 0.00 1.45 2.20 -1.26 -5.15 119.74 117.29 1tpn s LYS 49 Ca 0.00 0.55 0.00 0.00 -0.36 0.00 0.00 55.97 56.16 1tpn s LYS 49 Cb 0.00 -4.23 0.00 0.00 -1.51 0.00 0.00 37.83 32.09 1tpn s LYS 49 CO 0.00 -2.23 0.00 0.45 -0.36 0.00 0.00 175.35 173.21