#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zmq s PHE 2 N 0.00 0.33 -0.08 0.00 0.40 -1.26 -5.04 117.98 112.33 1zmq s PHE 2 Ca 0.00 -0.33 0.05 0.00 -0.60 0.00 0.00 56.93 56.05 1zmq s PHE 2 Cb 0.00 -0.22 -0.00 0.00 0.51 0.00 0.00 43.02 43.31 1zmq s PHE 2 CO 0.00 -0.09 -0.24 0.99 0.70 0.00 0.00 175.22 176.58 1zmq s THR 3 N -0.88 2.08 0.11 0.64 2.01 -1.26 -4.99 115.64 113.34 1zmq s THR 3 Ca -0.08 -1.03 0.07 0.00 0.31 0.00 0.00 61.69 60.96 1zmq s THR 3 Cb -0.06 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.64 1zmq s THR 3 CO -0.00 0.56 -0.18 0.00 -0.69 0.00 0.00 174.62 174.31 1zmq s HIS 5 N -1.51 0.04 -0.60 0.00 3.76 0.39 -4.96 115.29 112.40 1zmq s HIS 5 Ca 0.07 -0.09 -0.23 0.00 -0.15 0.00 0.00 55.06 54.66 1zmq s HIS 5 Cb -0.08 -0.05 0.05 0.00 1.11 0.00 0.00 32.58 33.61 1zmq s HIS 5 CO 0.04 -0.17 0.95 0.00 -0.85 0.00 0.00 174.74 174.71 1zmq s ARG 7 N 4.00 1.80 0.42 0.00 0.52 -0.25 -4.84 118.95 120.58 1zmq s ARG 7 Ca 0.26 -1.17 0.08 0.00 -0.52 0.00 0.00 55.73 54.39 1zmq s ARG 7 Cb -0.15 -2.12 0.90 0.00 0.52 0.00 0.00 34.95 34.10 1zmq s ARG 7 CO 0.15 0.48 2.05 -0.09 0.02 0.00 0.00 175.30 177.91 1zmq h ARG 8 N 3.81 0.51 -3.10 3.54 2.43 -1.87 0.24 114.38 119.94 1zmq h ARG 8 Ca -0.50 -0.03 -0.19 0.00 -0.81 0.00 0.00 59.98 58.46 1zmq h ARG 8 Cb 1.17 -0.11 -0.28 0.00 -0.42 0.00 0.00 29.97 30.32 1zmq h ARG 8 CO 0.46 0.34 -0.47 0.45 -1.51 0.00 0.00 179.97 179.23 1zmq s SER 9 N -6.60 -0.25 0.51 -3.80 0.15 -1.26 -4.57 113.70 97.88 1zmq s SER 9 Ca -0.08 0.49 -0.21 0.00 0.70 0.00 0.00 55.95 56.85 1zmq s SER 9 Cb 0.18 0.42 -0.06 0.00 -1.71 0.00 0.00 66.02 64.85 1zmq s SER 9 CO 0.73 -0.13 1.14 0.00 1.20 0.00 0.00 173.24 176.18 1zmq s TYR 11 N -1.70 2.40 0.61 0.00 4.12 -1.26 -4.92 117.35 116.60 1zmq s TYR 11 Ca 0.69 1.57 0.33 0.00 0.02 0.00 0.00 57.07 59.68 1zmq s TYR 11 Cb -0.25 -3.31 1.92 0.00 -1.52 0.00 0.00 41.96 38.80 1zmq s TYR 11 CO 0.29 -2.04 2.25 0.66 0.02 0.00 0.00 175.55 176.73 1zmq h SER 12 N 0.07 0.00 0.33 2.29 4.64 -2.03 -0.82 113.55 118.04 1zmq h SER 12 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1zmq h SER 12 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1zmq h SER 12 CO 0.53 0.00 -0.13 0.35 -0.87 0.00 0.00 176.83 176.71 1zmq n THR 13 N -3.67 0.00 -4.01 2.95 -2.24 -1.26 -4.90 114.28 101.15 1zmq n THR 13 Ca -0.02 -0.07 -0.21 0.00 -2.27 0.00 0.00 64.05 61.47 1zmq n THR 13 Cb 0.13 -0.02 -0.03 0.00 -2.10 0.00 0.00 70.33 68.30 1zmq n THR 13 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1zmq s GLU 14 N -2.46 3.10 0.02 -0.78 2.02 -0.31 -4.81 118.70 115.48 1zmq s GLU 14 Ca 0.29 -0.96 -0.01 0.00 0.02 0.00 0.00 54.97 54.31 1zmq s GLU 14 Cb 0.20 -2.69 -0.04 0.00 0.10 0.00 0.00 34.13 31.70 1zmq s GLU 14 CO 0.48 0.38 0.15 0.71 0.02 0.00 0.00 175.26 176.99 1zmq s TYR 15 N -2.09 3.42 0.05 1.61 1.51 -0.18 -4.83 117.35 116.83 1zmq s TYR 15 Ca 0.34 0.25 -0.24 0.00 -1.01 0.00 0.00 57.07 56.42 1zmq s TYR 15 Cb -0.08 -1.76 -0.06 0.00 -0.11 0.00 0.00 41.96 39.95 1zmq s TYR 15 CO 0.27 0.59 0.72 0.45 -1.11 0.00 0.00 175.55 176.47 1zmq s SER 16 N -2.07 7.18 0.00 2.29 0.15 -1.26 -0.55 113.70 119.44 1zmq s SER 16 Ca 0.28 1.40 0.00 0.00 0.70 0.00 0.00 55.95 58.33 1zmq s SER 16 Cb -0.12 -2.45 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 1zmq s SER 16 CO 0.20 0.07 0.04 -1.22 1.20 0.00 0.00 173.24 173.52 1zmq n TYR 17 N 2.60 0.00 -2.41 3.44 4.02 -0.43 -5.01 117.16 119.37 1zmq n TYR 17 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.85 1zmq n TYR 17 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.82 1zmq n TYR 17 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1zmq n GLY 18 N 0.90 -0.54 3.39 2.72 0.00 -1.25 -4.98 105.19 105.43 1zmq n GLY 18 Ca 0.00 -0.84 -0.20 0.00 0.00 0.00 0.00 46.02 44.98 1zmq n GLY 18 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1zmq s THR 19 N -3.35 1.75 -0.17 2.61 -4.23 -1.26 -0.23 115.64 110.76 1zmq s THR 19 Ca 0.00 -2.19 0.01 0.00 -1.18 0.00 0.00 61.69 58.33 1zmq s THR 19 Cb 0.00 -2.24 0.02 0.00 1.34 0.00 0.00 72.50 71.62 1zmq s THR 19 CO 0.00 -0.45 -0.18 0.00 -0.54 0.00 0.00 174.62 173.45 1zmq s THR 21 N 1.36 1.76 -0.14 0.00 2.01 -1.26 -0.15 115.64 119.22 1zmq s THR 21 Ca 0.05 -0.83 -0.01 0.00 0.31 0.00 0.00 61.69 61.20 1zmq s THR 21 Cb -0.13 -1.54 0.04 0.00 0.01 0.00 0.00 72.50 70.88 1zmq s THR 21 CO -0.12 0.49 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.59 1zmq s VAL 22 N 0.53 0.81 0.00 3.82 1.01 -0.62 -5.01 120.40 120.94 1zmq s VAL 22 Ca -0.16 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 61.43 1zmq s VAL 22 Cb -0.17 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.18 1zmq s VAL 22 CO 0.06 0.12 0.00 0.23 0.00 0.00 0.00 175.10 175.51 1zmq n MET 23 N 4.98 0.00 -0.15 2.72 2.81 -1.26 -0.23 117.12 125.99 1zmq n MET 23 Ca -0.10 0.00 0.02 0.00 -1.81 0.00 0.00 57.70 55.81 1zmq n MET 23 Cb 0.48 0.00 0.09 0.00 -0.71 0.00 0.00 33.22 33.08 1zmq n MET 23 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1zmq n GLY 24 N 0.00 0.72 3.49 3.03 0.00 -1.26 -4.83 105.19 106.34 1zmq n GLY 24 Ca 0.00 -0.21 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 1zmq n GLY 24 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1zmq s ILE 25 N -1.61 3.87 -0.26 -0.61 1.01 0.68 -5.08 121.20 119.19 1zmq s ILE 25 Ca 0.12 -0.36 -0.00 0.00 0.00 0.00 0.00 60.65 60.41 1zmq s ILE 25 Cb 0.08 -2.70 0.04 0.00 0.01 0.00 0.00 42.46 39.89 1zmq s ILE 25 CO 0.06 0.49 -0.07 0.20 0.00 0.00 0.00 174.94 175.63 1zmq s ASN 26 N 0.39 4.41 0.38 3.58 0.01 -1.26 -1.59 114.94 120.86 1zmq s ASN 26 Ca -0.04 -1.08 0.08 0.00 -0.71 0.00 0.00 52.86 51.10 1zmq s ASN 26 Cb -0.14 -1.64 -0.02 0.00 0.41 0.00 0.00 41.25 39.86 1zmq s ASN 26 CO 0.03 -0.17 0.36 -1.00 -1.51 0.00 0.00 177.10 174.81 1zmq s HIS 27 N 1.25 2.81 0.06 2.20 3.76 0.79 -4.81 115.29 121.36 1zmq s HIS 27 Ca -0.03 -0.39 0.01 0.00 -0.15 0.00 0.00 55.06 54.49 1zmq s HIS 27 Cb -0.18 -2.02 -0.04 0.00 1.11 0.00 0.00 32.58 31.45 1zmq s HIS 27 CO -0.04 -0.00 0.16 1.03 -0.85 0.00 0.00 174.74 175.03 1zmq s ARG 28 N -4.09 3.24 -0.61 1.40 0.52 0.85 -0.35 118.95 119.91 1zmq s ARG 28 Ca 0.45 -0.51 -0.22 0.00 -0.52 0.00 0.00 55.73 54.93 1zmq s ARG 28 Cb -0.05 -2.94 0.07 0.00 0.52 0.00 0.00 34.95 32.55 1zmq s ARG 28 CO 0.28 0.60 0.89 0.12 0.02 0.00 0.00 175.30 177.21 1zmq s PHE 29 N -1.44 2.78 -0.15 -0.53 5.36 0.68 -1.10 117.98 123.58 1zmq s PHE 29 Ca 0.32 -0.51 -0.03 0.00 -0.96 0.00 0.00 56.93 55.75 1zmq s PHE 29 Cb -0.13 -4.14 -0.03 0.00 -0.34 0.00 0.00 43.02 38.39 1zmq s PHE 29 CO 0.24 -1.48 -0.04 0.00 -1.46 0.00 0.00 175.22 172.48