#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 1.92 -0.06 0.00 0.40 -1.26 -5.08 117.98 113.90 1zmq s PHE 2 Ca 0.00 -0.40 0.05 0.00 -0.60 0.00 0.00 56.93 55.98 1zmq s PHE 2 Cb 0.00 -1.08 -0.00 0.00 0.51 0.00 0.00 43.02 42.45 1zmq s PHE 2 CO 0.00 0.20 -0.20 0.99 0.70 0.00 0.00 175.22 176.91 1zmq s THR 3 N -1.04 1.70 0.10 0.64 2.01 -0.97 -4.98 115.64 113.10 1zmq s THR 3 Ca 0.08 -0.85 0.08 0.00 0.31 0.00 0.00 61.69 61.31 1zmq s THR 3 Cb -0.10 -1.46 -0.03 0.00 0.01 0.00 0.00 72.50 70.92 1zmq s THR 3 CO 0.04 0.48 -0.20 0.00 -0.69 0.00 0.00 174.62 174.25 1zmq s HIS 5 N -1.16 0.60 -0.15 0.00 3.76 0.71 -4.93 115.29 114.12 1zmq s HIS 5 Ca 0.06 -0.23 -0.28 0.00 -0.15 0.00 0.00 55.06 54.46 1zmq s HIS 5 Cb -0.10 -0.37 -0.01 0.00 1.11 0.00 0.00 32.58 33.21 1zmq s HIS 5 CO 0.04 -0.03 0.94 0.00 -0.85 0.00 0.00 174.74 174.84 1zmq s ARG 7 N 2.21 0.44 0.33 0.00 0.52 0.09 -4.95 118.95 117.60 1zmq s ARG 7 Ca 0.44 -0.48 0.08 0.00 -0.52 0.00 0.00 55.73 55.25 1zmq s ARG 7 Cb -0.17 0.18 0.59 0.00 0.52 0.00 0.00 34.95 36.07 1zmq s ARG 7 CO 0.14 -0.10 1.78 0.00 0.02 0.00 0.00 175.30 177.14 1zmq h ARG 8 N 4.33 0.19 -3.61 3.54 3.08 -1.91 0.29 114.38 120.30 1zmq h ARG 8 Ca -0.31 -0.07 -0.34 0.00 0.07 0.00 0.00 59.98 59.32 1zmq h ARG 8 Cb 1.20 -0.01 -0.35 0.00 0.08 0.00 0.00 29.97 30.89 1zmq h ARG 8 CO 0.41 0.51 -0.74 -1.12 -1.07 0.00 0.00 179.97 177.96 1zmq s SER 9 N -6.89 0.46 0.58 7.04 0.01 -1.26 -4.52 113.70 109.13 1zmq s SER 9 Ca -0.04 0.00 -0.19 0.00 1.31 0.00 0.00 55.95 57.03 1zmq s SER 9 Cb 0.14 -0.18 -0.04 0.00 0.21 0.00 0.00 66.02 66.15 1zmq s SER 9 CO 0.75 -0.13 1.18 0.00 0.41 0.00 0.00 173.24 175.45 1zmq s TYR 11 N -1.67 2.41 0.57 0.00 2.02 -1.26 -4.93 117.35 114.49 1zmq s TYR 11 Ca 0.76 1.56 0.25 0.00 -0.37 0.00 0.00 57.07 59.27 1zmq s TYR 11 Cb -0.28 -3.10 1.62 0.00 -0.40 0.00 0.00 41.96 39.80 1zmq s TYR 11 CO 0.32 -2.00 2.21 0.66 -1.57 0.00 0.00 175.55 175.17 1zmq h SER 12 N -1.28 0.00 0.06 2.29 4.64 -2.04 -1.46 113.55 115.76 1zmq h SER 12 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1zmq h SER 12 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1zmq h SER 12 CO 0.50 0.00 -0.03 0.35 -0.87 0.00 0.00 176.83 176.78 1zmq n THR 13 N -4.10 0.00 -4.13 2.95 -2.24 -1.26 -4.91 114.28 100.59 1zmq n THR 13 Ca -0.03 -0.15 -0.25 0.00 -2.27 0.00 0.00 64.05 61.35 1zmq n THR 13 Cb 0.10 0.15 -0.06 0.00 -2.10 0.00 0.00 70.33 68.42 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 -2.10 2.75 -0.14 -0.78 2.02 -0.55 -4.81 118.70 115.09 1zmq s GLU 14 Ca 0.38 -0.99 -0.05 0.00 0.02 0.00 0.00 54.97 54.34 1zmq s GLU 14 Cb 0.21 -2.53 -0.04 0.00 0.10 0.00 0.00 34.13 31.87 1zmq s GLU 14 CO 0.38 0.46 0.02 -0.47 0.02 0.00 0.00 175.26 175.67 1zmq s TYR 15 N -1.85 3.19 -0.54 1.61 5.04 0.44 -4.78 117.35 120.46 1zmq s TYR 15 Ca 0.30 0.06 -0.28 0.00 -2.44 0.00 0.00 57.07 54.72 1zmq s TYR 15 Cb -0.09 -1.94 0.03 0.00 0.35 0.00 0.00 41.96 40.31 1zmq s TYR 15 CO 0.22 0.26 1.12 0.45 -1.34 0.00 0.00 175.55 176.26 1zmq s SER 16 N -0.16 6.48 -0.62 4.32 0.15 -1.26 -0.98 113.70 121.63 1zmq s SER 16 Ca 0.06 0.13 0.04 0.00 0.70 0.00 0.00 55.95 56.88 1zmq s SER 16 Cb -0.12 -2.53 0.35 0.00 -1.71 0.00 0.00 66.02 62.01 1zmq s SER 16 CO 0.02 -1.35 1.08 0.00 1.20 0.00 0.00 173.24 174.19 1zmq n TYR 17 N 8.04 3.84 -0.05 3.44 4.19 0.99 -4.98 117.16 132.63 1zmq n TYR 17 Ca 0.08 -3.72 0.00 0.00 3.31 0.00 0.00 57.90 57.57 1zmq n TYR 17 Cb 0.49 -0.54 0.00 0.00 0.49 0.00 0.00 39.34 39.78 1zmq n TYR 17 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1zmq n GLY 18 N -0.26 -3.93 3.90 2.98 0.00 -1.26 -4.64 105.19 101.99 1zmq n GLY 18 Ca 0.34 -2.03 -0.34 0.00 0.00 0.00 0.00 46.02 43.99 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 -0.92 5.36 -0.10 2.61 -4.23 -1.26 -0.81 115.64 116.29 1zmq s THR 19 Ca 0.00 -0.02 0.03 0.00 -1.18 0.00 0.00 61.69 60.51 1zmq s THR 19 Cb 0.00 -3.56 0.01 0.00 1.34 0.00 0.00 72.50 70.28 1zmq s THR 19 CO 0.00 0.31 -0.18 0.00 -0.54 0.00 0.00 174.62 174.20 1zmq s THR 21 N 0.65 5.18 -0.24 0.00 2.01 -1.26 0.50 115.64 122.48 1zmq s THR 21 Ca -0.13 0.08 -0.03 0.00 0.31 0.00 0.00 61.69 61.92 1zmq s THR 21 Cb -0.16 -3.80 0.01 0.00 0.01 0.00 0.00 72.50 68.56 1zmq s THR 21 CO 0.04 -0.06 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.18 1zmq s VAL 22 N 2.00 3.15 -1.51 3.82 1.01 0.29 -4.62 120.40 124.54 1zmq s VAL 22 Ca 0.12 -0.79 -0.13 0.00 0.00 0.00 0.00 61.98 61.17 1zmq s VAL 22 Cb -0.16 -2.53 0.09 0.00 0.00 0.00 0.00 36.38 33.78 1zmq s VAL 22 CO 0.11 0.28 0.83 0.23 0.00 0.00 0.00 175.10 176.56 1zmq n MET 23 N 4.74 -4.69 -0.91 2.72 2.81 -1.26 -0.49 117.12 120.04 1zmq n MET 23 Ca -0.17 0.56 0.00 0.00 -1.81 0.00 0.00 57.70 56.28 1zmq n MET 23 Cb 0.49 -5.39 0.00 0.00 -0.71 0.00 0.00 33.22 27.61 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 -1.53 0.89 3.49 3.03 0.00 -1.26 -5.02 105.19 104.80 1zmq n GLY 24 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 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 -3.55 3.83 -0.09 -0.61 1.01 0.35 -5.06 121.20 117.09 1zmq s ILE 25 Ca 0.00 -0.38 -0.29 0.00 0.00 0.00 0.00 60.65 59.98 1zmq s ILE 25 Cb 0.00 -2.67 -0.07 0.00 0.01 0.00 0.00 42.46 39.73 1zmq s ILE 25 CO 0.00 0.50 2.03 0.21 0.00 0.00 0.00 174.94 177.67 1zmq s ASN 26 N 0.35 6.06 0.41 3.58 3.84 -1.26 -0.54 114.94 127.37 1zmq s ASN 26 Ca -0.05 2.26 0.05 0.00 0.21 0.00 0.00 52.86 55.34 1zmq s ASN 26 Cb -0.14 -2.52 -0.06 0.00 -0.55 0.00 0.00 41.25 37.97 1zmq s ASN 26 CO 0.03 -1.42 0.02 -1.00 -2.79 0.00 0.00 177.10 171.94 1zmq s HIS 27 N 6.02 2.29 0.19 0.43 3.76 0.18 -4.92 115.29 123.24 1zmq s HIS 27 Ca 0.91 -0.79 -0.11 0.00 -0.15 0.00 0.00 55.06 54.92 1zmq s HIS 27 Cb -0.37 -1.64 -0.07 0.00 1.11 0.00 0.00 32.58 31.61 1zmq s HIS 27 CO 0.38 0.31 0.54 1.03 -0.85 0.00 0.00 174.74 176.14 1zmq s ARG 28 N -3.77 3.85 -0.53 1.40 1.81 0.10 -0.56 118.95 121.25 1zmq s ARG 28 Ca 0.30 0.33 -0.18 0.00 -1.72 0.00 0.00 55.73 54.46 1zmq s ARG 28 Cb 0.08 -2.77 0.08 0.00 -0.45 0.00 0.00 34.95 31.90 1zmq s ARG 28 CO 0.15 0.39 0.61 0.12 -0.68 0.00 0.00 175.30 175.88 1zmq s PHE 29 N -1.67 3.07 -0.27 -0.53 5.36 0.01 -0.73 117.98 123.22 1zmq s PHE 29 Ca 0.43 -0.77 -0.08 0.00 -0.96 0.00 0.00 56.93 55.55 1zmq s PHE 29 Cb -0.13 -3.64 -0.02 0.00 -0.34 0.00 0.00 43.02 38.89 1zmq s PHE 29 CO 0.20 -1.08 0.10 0.00 -1.46 0.00 0.00 175.22 172.99