#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 2.97 -0.30 1.43 2.02 -1.26 -5.07 117.35 117.14 1tpn s TYR 2 Ca 0.00 -0.13 -0.16 0.00 -0.37 0.00 0.00 57.07 56.41 1tpn s TYR 2 Cb 0.00 -2.39 -0.02 0.00 -0.40 0.00 0.00 41.96 39.14 1tpn s TYR 2 CO 0.00 -0.45 0.43 -0.65 -1.57 0.00 0.00 175.55 173.30 1tpn s GLN 3 N -4.47 3.86 0.00 -0.62 -0.21 -1.26 -4.87 119.66 112.09 1tpn s GLN 3 Ca 0.52 -0.04 0.00 0.00 0.02 0.00 0.00 55.36 55.86 1tpn s GLN 3 Cb -0.10 -3.72 0.00 0.00 1.00 0.00 0.00 33.01 30.20 1tpn s GLN 3 CO 0.35 -0.41 0.03 1.33 -2.12 0.00 0.00 175.29 174.47 1tpn n VAL 4 N 5.22 0.00 -3.05 1.09 0.24 -1.25 -4.43 118.33 116.14 1tpn n VAL 4 Ca -0.07 -0.40 -0.20 0.00 -2.04 0.00 0.00 64.34 61.63 1tpn n VAL 4 Cb 0.50 1.02 0.07 0.00 -1.47 0.00 0.00 33.84 33.96 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 -0.73 1.99 -0.20 1.34 -4.36 -1.26 0.01 121.20 118.00 1tpn s ILE 5 Ca 0.00 -1.01 -0.04 0.00 -0.26 0.00 0.00 60.65 59.35 1tpn s ILE 5 Cb 0.00 -2.00 0.09 0.00 1.25 0.00 0.00 42.46 41.80 1tpn s ILE 5 CO 0.00 0.00 0.24 0.00 0.24 0.00 0.00 174.94 175.42 1tpn s ARG 7 N 2.35 3.47 -0.29 0.00 3.52 -1.26 -0.63 118.95 126.11 1tpn s ARG 7 Ca 0.07 -0.07 -0.13 0.00 -0.13 0.00 0.00 55.73 55.47 1tpn s ARG 7 Cb -0.15 -3.91 -0.04 0.00 -1.56 0.00 0.00 34.95 29.29 1tpn s ARG 7 CO -0.12 -1.01 0.27 0.34 -0.81 0.00 0.00 175.30 173.97 1tpn s ASP 8 N 2.02 6.11 0.00 -2.12 -1.08 -1.01 -4.95 116.67 115.65 1tpn s ASP 8 Ca 0.28 -0.00 0.28 0.00 -0.52 0.00 0.00 52.55 52.59 1tpn s ASP 8 Cb -0.13 -2.16 1.12 0.00 -1.46 0.00 0.00 42.92 40.29 1tpn s ASP 8 CO 0.20 -0.14 1.78 -1.84 0.52 0.00 0.00 175.17 175.69 1tpn n GLU 9 N 5.18 1.33 0.09 4.34 0.28 -1.26 -0.32 120.64 130.27 1tpn n GLU 9 Ca -0.12 -0.68 0.13 0.00 -0.16 0.00 0.00 57.16 56.33 1tpn n GLU 9 Cb 0.51 -1.49 0.31 0.00 1.43 0.00 0.00 31.44 32.21 1tpn n GLU 9 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1tpn n LYS 10 N -0.24 0.27 0.00 3.44 4.01 -1.26 -4.01 118.16 120.37 1tpn n LYS 10 Ca 0.18 0.17 0.00 0.00 -0.51 0.00 0.00 58.31 58.14 1tpn n LYS 10 Cb 0.32 -1.76 0.00 0.00 -0.51 0.00 0.00 35.03 33.08 1tpn n LYS 10 CO 0.00 0.00 0.00 -2.37 -1.11 0.00 0.00 177.40 173.92 1tpn n THR 11 N -2.21 0.00 -3.05 -0.18 5.66 -1.24 -5.03 114.28 108.24 1tpn n THR 11 Ca 0.05 -0.05 -0.13 0.00 -3.05 0.00 0.00 64.05 60.87 1tpn n THR 11 Cb 0.43 0.55 0.05 0.00 -1.55 0.00 0.00 70.33 69.81 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 -0.26 -4.36 -4.45 1.09 6.02 0.56 -5.02 117.38 110.95 1tpn n GLN 12 Ca 0.00 0.47 -0.25 0.00 -0.01 0.00 0.00 57.00 57.22 1tpn n GLN 12 Cb 0.00 -4.42 -0.17 0.00 1.02 0.00 0.00 30.24 26.67 1tpn n GLN 12 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1tpn s MET 13 N -5.52 1.61 -0.03 -1.09 1.75 -0.87 -4.97 119.30 110.19 1tpn s MET 13 Ca 0.25 -0.37 -0.16 0.00 -1.25 0.00 0.00 55.69 54.17 1tpn s MET 13 Cb -0.11 -1.39 -0.05 0.00 2.84 0.00 0.00 34.83 36.11 1tpn s MET 13 CO 0.41 -0.03 0.42 0.42 -0.65 0.00 0.00 175.02 175.60 1tpn s ILE 14 N 0.84 5.06 0.30 10.11 1.01 -1.26 -2.40 121.20 134.86 1tpn s ILE 14 Ca -0.11 0.87 0.10 0.00 0.00 0.00 0.00 60.65 61.50 1tpn s ILE 14 Cb -0.15 -3.74 -0.05 0.00 0.01 0.00 0.00 42.46 38.53 1tpn s ILE 14 CO 0.02 0.51 -0.06 -0.31 0.00 0.00 0.00 174.94 175.10 1tpn s TYR 15 N -0.63 2.52 0.19 3.97 2.02 0.19 -4.89 117.35 120.72 1tpn s TYR 15 Ca 0.24 -0.33 -0.02 0.00 -0.37 0.00 0.00 57.07 56.59 1tpn s TYR 15 Cb -0.16 -1.23 0.04 0.00 -0.40 0.00 0.00 41.96 40.21 1tpn s TYR 15 CO 0.12 0.60 0.27 1.04 -1.57 0.00 0.00 175.55 176.01 1tpn n GLN 16 N -0.83 -0.00 -2.54 -0.62 6.02 -1.26 0.38 117.38 118.53 1tpn n GLN 16 Ca -0.05 -0.51 -0.40 0.00 -0.01 0.00 0.00 57.00 56.03 1tpn n GLN 16 Cb 0.60 -0.24 -0.05 0.00 1.02 0.00 0.00 30.24 31.58 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 -3.39 4.63 -1.81 -1.09 0.74 0.10 -3.10 119.66 115.74 1tpn s GLN 17 Ca 0.16 1.71 0.00 0.00 0.05 0.00 0.00 55.36 57.28 1tpn s GLN 17 Cb -0.01 -3.14 0.00 0.00 1.10 0.00 0.00 33.01 30.97 1tpn s GLN 17 CO 0.11 0.24 0.00 0.72 -0.55 0.00 0.00 175.29 175.81 1tpn n HIS 18 N 1.12 -0.42 -3.55 1.67 8.25 0.89 -4.93 115.22 118.24 1tpn n HIS 18 Ca -0.01 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.09 1tpn n HIS 18 Cb 0.46 -3.27 -0.08 0.00 1.12 0.00 0.00 29.99 28.22 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 -3.95 4.19 -0.04 -0.41 2.00 -1.18 -4.81 119.66 115.46 1tpn s GLN 19 Ca 0.00 -0.00 -0.14 0.00 -2.00 0.00 0.00 55.36 53.22 1tpn s GLN 19 Cb 0.00 -3.47 -0.05 0.00 0.80 0.00 0.00 33.01 30.28 1tpn s GLN 19 CO 0.00 0.14 0.38 -1.54 -0.50 0.00 0.00 175.29 173.77 1tpn s SER 20 N 0.71 6.72 -0.14 6.67 1.04 -1.26 -2.33 113.70 125.11 1tpn s SER 20 Ca 0.14 0.85 -0.04 0.00 0.48 0.00 0.00 55.95 57.38 1tpn s SER 20 Cb -0.13 -2.23 0.07 0.00 0.10 0.00 0.00 66.02 63.83 1tpn s SER 20 CO 0.04 0.27 0.22 -1.66 0.98 0.00 0.00 173.24 173.10 1tpn s TRP 21 N -0.72 -0.32 0.55 5.02 -2.14 0.25 -4.98 118.94 116.61 1tpn s TRP 21 Ca 0.22 0.64 -0.16 0.00 2.66 0.00 0.00 56.10 59.47 1tpn s TRP 21 Cb -0.16 -0.20 -0.06 0.00 -3.10 0.00 0.00 33.47 29.96 1tpn s TRP 21 CO 0.11 -0.41 1.02 -0.51 -2.66 0.00 0.00 176.95 174.50 1tpn s LEU 22 N 2.36 3.55 0.14 -4.66 2.01 -1.26 -2.46 118.68 118.35 1tpn s LEU 22 Ca 0.04 1.66 0.05 0.00 0.01 0.00 0.00 54.13 55.88 1tpn s LEU 22 Cb -0.13 -4.52 -0.04 0.00 0.01 0.00 0.00 46.19 41.51 1tpn s LEU 22 CO -0.09 -0.84 -0.11 -0.13 1.01 0.00 0.00 176.35 176.19 1tpn s ARG 23 N -4.15 1.05 1.19 1.70 0.52 0.36 -4.93 118.95 114.69 1tpn s ARG 23 Ca 0.60 -1.37 -0.17 0.00 -0.52 0.00 0.00 55.73 54.27 1tpn s ARG 23 Cb -0.12 -0.72 0.22 0.00 0.52 0.00 0.00 34.95 34.85 1tpn s ARG 23 CO 0.35 0.11 0.48 -2.30 0.02 0.00 0.00 175.30 173.96 1tpn n PRO 24 N 0.06 -2.64 -2.17 3.54 -0.01 -1.26 -2.28 135.00 130.24 1tpn n PRO 24 Ca -0.12 -0.77 -0.27 0.00 -0.01 0.00 0.00 63.50 62.33 1tpn n PRO 24 Cb 0.59 -1.81 0.06 0.00 -0.01 0.00 0.00 33.50 32.33 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 -2.22 2.85 -0.01 -1.45 -7.23 -1.24 -3.97 120.40 107.13 1tpn s VAL 25 Ca 0.58 -0.03 -0.01 0.00 -1.81 0.00 0.00 61.98 60.70 1tpn s VAL 25 Cb -0.14 -3.22 -0.01 0.00 0.56 0.00 0.00 36.38 33.57 1tpn s VAL 25 CO 0.58 -0.24 0.19 -0.07 -0.31 0.00 0.00 175.10 175.25 1tpn h LEU 26 N -0.54 -0.04 0.00 1.32 3.38 -1.95 -3.46 115.31 114.02 1tpn h LEU 26 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1tpn h LEU 26 Cb 1.29 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1tpn h LEU 26 CO 0.62 0.05 0.00 -2.11 0.09 0.00 0.00 178.44 177.09 1tpn n ARG 27 N -2.58 1.86 0.00 1.13 1.85 -1.26 -5.07 116.66 112.59 1tpn n ARG 27 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.84 1tpn n ARG 27 Cb 0.02 -0.15 0.00 0.00 -1.05 0.00 0.00 32.46 31.27 1tpn n ARG 27 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1tpn n SER 28 N 0.00 0.00 -0.40 2.89 7.64 -1.26 -5.03 113.62 117.45 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 -4.92 6.43 3.02 -1.26 -5.01 115.26 113.52 1tpn n ASN 29 Ca 0.00 -1.37 -0.27 0.00 -0.03 0.00 0.00 54.58 52.91 1tpn n ASN 29 Cb 0.00 -0.07 -0.01 0.00 -0.61 0.00 0.00 39.78 39.08 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 3.56 -0.05 3.52 1.70 -1.26 -4.63 118.95 121.79 1tpn s ARG 30 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 55.73 55.25 1tpn s ARG 30 Cb 0.00 -2.52 -0.03 0.00 -0.57 0.00 0.00 34.95 31.82 1tpn s ARG 30 CO 0.00 0.00 0.01 0.14 -1.08 0.00 0.00 175.30 174.38 1tpn s VAL 31 N -2.45 4.33 -0.19 4.99 -7.23 -1.26 -3.72 120.40 114.87 1tpn s VAL 31 Ca 0.44 -0.36 -0.13 0.00 -1.81 0.00 0.00 61.98 60.12 1tpn s VAL 31 Cb -0.10 -2.87 -0.05 0.00 0.56 0.00 0.00 36.38 33.92 1tpn s VAL 31 CO 0.38 0.51 0.27 -1.61 -0.31 0.00 0.00 175.10 174.34 1tpn s GLU 32 N -1.18 4.20 -0.27 4.82 0.41 -0.96 -3.44 118.70 122.28 1tpn s GLU 32 Ca 0.16 0.01 -0.10 0.00 -0.41 0.00 0.00 54.97 54.64 1tpn s GLU 32 Cb -0.11 -3.47 -0.04 0.00 -1.78 0.00 0.00 34.13 28.73 1tpn s GLU 32 CO 0.06 0.16 0.15 -0.47 -0.49 0.00 0.00 175.26 174.66 1tpn s TYR 33 N 0.73 3.18 -0.12 1.61 6.14 -0.09 -0.49 117.35 128.31 1tpn s TYR 33 Ca 0.14 -0.06 -0.01 0.00 0.64 0.00 0.00 57.07 57.78 1tpn s TYR 33 Cb -0.13 -2.32 0.03 0.00 0.42 0.00 0.00 41.96 39.96 1tpn s TYR 33 CO 0.04 -0.21 -0.03 0.00 0.64 0.00 0.00 175.55 175.98 1tpn s TRP 35 N 1.79 1.31 -0.33 0.00 -2.14 0.21 -0.58 118.94 119.20 1tpn s TRP 35 Ca 0.03 -0.42 -0.28 0.00 2.66 0.00 0.00 56.10 58.09 1tpn s TRP 35 Cb -0.14 -0.74 0.02 0.00 -3.10 0.00 0.00 33.47 29.51 1tpn s TRP 35 CO -0.07 0.07 1.04 0.00 -2.66 0.00 0.00 176.95 175.33 1tpn h ASN 37 N 8.18 0.00 0.00 0.00 -1.24 -1.91 0.25 115.58 120.86 1tpn h ASN 37 Ca -0.21 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.79 1tpn h ASN 37 Cb 1.06 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.11 1tpn h ASN 37 CO 1.02 0.01 0.00 -1.20 -1.29 0.00 0.00 177.43 175.97 1tpn n SER 38 N -2.81 0.00 0.00 1.15 7.64 -1.26 -4.77 113.62 113.56 1tpn n SER 38 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1tpn n SER 38 Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 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 -0.11 -0.05 0.01 0.23 0.00 -1.26 -3.97 105.19 100.03 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 2.93 -2.91 1.61 1.85 -1.26 -4.89 116.66 113.98 1tpn n ARG 40 Ca 0.00 -1.54 -0.01 0.00 -1.00 0.00 0.00 57.85 55.29 1tpn n ARG 40 Cb 0.00 -1.02 -0.01 0.00 -1.05 0.00 0.00 32.46 30.38 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 -0.53 -2.54 -2.29 2.89 0.00 -1.26 -4.93 120.51 111.84 1tpn n ALA 41 Ca 0.01 0.66 -0.34 0.00 0.00 0.00 0.00 53.44 53.77 1tpn n ALA 41 Cb 0.27 -1.56 -0.06 0.00 0.00 0.00 0.00 19.45 18.10 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 -0.88 3.98 0.15 0.00 -0.44 0.32 -4.86 119.66 117.94 1tpn s GLN 42 Ca -0.06 0.53 -0.13 0.00 -2.50 0.00 0.00 55.36 53.19 1tpn s GLN 42 Cb 0.00 -2.78 0.01 0.00 -1.64 0.00 0.00 33.01 28.61 1tpn s GLN 42 CO 0.38 0.38 0.37 0.00 0.50 0.00 0.00 175.29 176.91 1tpn n HIS 44 N -0.23 -1.77 -3.73 0.00 1.44 0.66 -4.99 115.22 106.60 1tpn n HIS 44 Ca -0.12 -2.07 -0.21 0.00 -2.01 0.00 0.00 57.72 53.31 1tpn n HIS 44 Cb 0.63 0.67 -0.18 0.00 0.12 0.00 0.00 29.99 31.23 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 -3.04 1.30 -0.59 4.39 0.15 -1.26 -0.91 113.70 113.74 1tpn s SER 45 Ca 0.23 -0.00 -0.01 0.00 0.70 0.00 0.00 55.95 56.87 1tpn s SER 45 Cb -0.02 -0.28 0.15 0.00 -1.71 0.00 0.00 66.02 64.15 1tpn s SER 45 CO 0.17 -0.21 0.38 0.68 1.20 0.00 0.00 173.24 175.45 1tpn s VAL 46 N 2.00 3.40 1.41 4.45 -7.23 -1.22 -5.01 120.40 118.20 1tpn s VAL 46 Ca 0.04 -3.00 -0.22 0.00 -1.81 0.00 0.00 61.98 56.99 1tpn s VAL 46 Cb -0.12 -3.25 0.36 0.00 0.56 0.00 0.00 36.38 33.92 1tpn s VAL 46 CO -0.04 -0.85 0.87 -2.65 -0.31 0.00 0.00 175.10 172.13 1tpn n PRO 47 N 3.45 -4.31 -3.21 4.82 -0.02 -1.26 -4.26 135.00 130.21 1tpn n PRO 47 Ca 0.07 -1.27 -0.26 0.00 -2.02 0.00 0.00 63.50 60.02 1tpn n PRO 47 Cb 0.37 -1.95 -0.06 0.00 -0.02 0.00 0.00 33.50 31.83 1tpn n PRO 47 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1tpn n VAL 48 N -5.63 1.88 -1.53 -1.45 0.31 -1.26 -4.92 118.33 105.73 1tpn n VAL 48 Ca 0.11 -5.10 -0.27 0.00 -0.01 0.00 0.00 64.34 59.08 1tpn n VAL 48 Cb 0.58 -1.66 -0.12 0.00 -0.91 0.00 0.00 33.84 31.74 1tpn n VAL 48 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1tpn n LYS 49 N 0.51 0.42 0.00 5.55 4.76 -1.26 -5.08 118.16 123.06 1tpn n LYS 49 Ca 0.28 -0.26 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 1tpn n LYS 49 Cb 0.45 -2.51 0.00 0.00 -1.84 0.00 0.00 35.03 31.12 1tpn n LYS 49 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48