#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k1i s ARG 2 N 0.00 4.04 -0.14 2.89 1.81 -1.26 -5.04 118.95 121.25 2k1i s ARG 2 Ca 0.00 1.70 0.02 0.00 -1.72 0.00 0.00 55.73 55.73 2k1i s ARG 2 Cb 0.00 -2.58 0.00 0.00 -0.45 0.00 0.00 34.95 31.93 2k1i s ARG 2 CO 0.00 -0.30 -0.19 0.99 -0.68 0.00 0.00 175.30 175.12 2k1i s THR 3 N -1.53 2.34 0.19 0.02 2.01 -1.26 -5.11 115.64 112.30 2k1i s THR 3 Ca 0.59 -0.89 -0.17 0.00 0.31 0.00 0.00 61.69 61.53 2k1i s THR 3 Cb -0.27 -1.96 0.03 0.00 0.01 0.00 0.00 72.50 70.31 2k1i s THR 3 CO 0.34 0.54 0.50 0.00 -0.69 0.00 0.00 174.62 175.30 2k1i s HIS 5 N -3.88 0.29 -0.27 0.00 2.46 0.34 -4.99 115.29 109.24 2k1i s HIS 5 Ca 0.09 -0.71 0.02 0.00 0.47 0.00 0.00 55.06 54.94 2k1i s HIS 5 Cb -0.00 0.37 0.06 0.00 -0.13 0.00 0.00 32.58 32.88 2k1i s HIS 5 CO -0.03 -1.16 -0.08 0.00 -2.47 0.00 0.00 174.74 171.00 2k1i s ARG 7 N 1.11 0.53 0.27 0.00 1.70 -0.52 -4.76 118.95 117.27 2k1i s ARG 7 Ca -0.07 0.42 -0.01 0.00 -0.47 0.00 0.00 55.73 55.60 2k1i s ARG 7 Cb -0.20 0.25 0.36 0.00 -0.57 0.00 0.00 34.95 34.79 2k1i s ARG 7 CO -0.05 -0.09 1.77 0.66 -1.08 0.00 0.00 175.30 176.51 2k1i h SER 8 N 5.14 0.73 -3.24 -2.89 4.64 -1.84 -1.12 113.55 114.97 2k1i h SER 8 Ca -0.27 -0.17 -0.64 0.00 -0.47 0.00 0.00 61.79 60.23 2k1i h SER 8 Cb 1.18 -0.19 -0.34 0.00 -0.31 0.00 0.00 62.40 62.73 2k1i h SER 8 CO 0.28 0.80 -0.86 -0.60 -0.87 0.00 0.00 176.83 175.59 2k1i s ARG 9 N -4.97 2.72 -0.08 4.77 3.52 -1.26 -4.75 118.95 118.90 2k1i s ARG 9 Ca -0.09 -0.75 -0.02 0.00 -0.13 0.00 0.00 55.73 54.74 2k1i s ARG 9 Cb 0.15 -2.22 -0.03 0.00 -1.56 0.00 0.00 34.95 31.28 2k1i s ARG 9 CO 0.81 -0.02 0.02 0.00 -0.81 0.00 0.00 175.30 175.29 2k1i s LEU 11 N -0.95 2.98 0.00 0.00 2.01 -1.26 -4.90 118.68 116.56 2k1i s LEU 11 Ca 0.14 -0.14 0.00 0.00 0.01 0.00 0.00 54.13 54.14 2k1i s LEU 11 Cb -0.11 -2.30 0.00 0.00 0.01 0.00 0.00 46.19 43.78 2k1i s LEU 11 CO 0.03 -1.79 0.17 0.54 1.01 0.00 0.00 176.35 176.31 2k1i n ARG 12 N -2.85 0.23 -0.01 1.70 1.74 -1.26 -1.75 116.66 114.45 2k1i n ARG 12 Ca 0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 2k1i n ARG 12 Cb 0.60 -1.26 -0.04 0.00 -1.02 0.00 0.00 32.46 30.74 2k1i n ARG 12 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2k1i n ARG 13 N 0.66 1.71 -4.68 5.56 3.00 -1.26 -5.06 116.66 116.60 2k1i n ARG 13 Ca 0.00 -0.02 -0.31 0.00 -0.00 0.00 0.00 57.85 57.52 2k1i n ARG 13 Cb 0.09 -1.12 -0.09 0.00 0.00 0.00 0.00 32.46 31.34 2k1i n ARG 13 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 2k1i s GLU 14 N -2.24 2.11 0.02 -0.14 0.41 -0.72 -4.81 118.70 113.34 2k1i s GLU 14 Ca -0.02 -2.27 0.01 0.00 -0.41 0.00 0.00 54.97 52.28 2k1i s GLU 14 Cb 0.02 -1.59 -0.02 0.00 -1.78 0.00 0.00 34.13 30.76 2k1i s GLU 14 CO 0.21 -0.24 -0.05 0.45 -0.49 0.00 0.00 175.26 175.14 2k1i s SER 15 N -3.82 0.56 -0.31 -0.19 0.15 0.61 -4.75 113.70 105.95 2k1i s SER 15 Ca 0.18 -0.36 -0.29 0.00 0.70 0.00 0.00 55.95 56.19 2k1i s SER 15 Cb 0.05 0.02 -0.01 0.00 -1.71 0.00 0.00 66.02 64.36 2k1i s SER 15 CO 0.10 -0.13 1.61 0.21 1.20 0.00 0.00 173.24 176.23 2k1i s ASN 16 N -1.00 6.22 -0.02 5.45 3.84 -1.26 -1.44 114.94 126.73 2k1i s ASN 16 Ca -0.07 1.29 0.22 0.00 0.21 0.00 0.00 52.86 54.51 2k1i s ASN 16 Cb -0.07 -2.53 -0.32 0.00 -0.55 0.00 0.00 41.25 37.78 2k1i s ASN 16 CO -0.00 -1.45 0.53 -1.20 -2.79 0.00 0.00 177.10 172.20 2k1i n SER 17 N 9.13 0.11 0.00 -4.21 7.64 0.10 -4.97 113.62 121.42 2k1i n SER 17 Ca 0.19 -0.06 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2k1i n SER 17 Cb 0.46 1.86 0.00 0.00 -1.01 0.00 0.00 64.21 65.53 2k1i n SER 17 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2k1i n GLY 18 N 1.28 -1.70 3.92 0.23 0.00 -1.09 -4.98 105.19 102.83 2k1i n GLY 18 Ca -0.03 -1.18 -0.27 0.00 0.00 0.00 0.00 46.02 44.54 2k1i n GLY 18 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2k1i s SER 19 N -2.88 4.71 -0.29 1.61 1.04 -1.26 0.34 113.70 116.97 2k1i s SER 19 Ca 0.00 0.62 -0.01 0.00 0.48 0.00 0.00 55.95 57.05 2k1i s SER 19 Cb 0.00 -1.22 0.19 0.00 0.10 0.00 0.00 66.02 65.10 2k1i s SER 19 CO 0.00 -1.72 0.73 0.00 0.98 0.00 0.00 173.24 173.24 2k1i s ASN 21 N 2.87 6.13 -0.05 0.00 2.47 -1.26 0.42 114.94 125.52 2k1i s ASN 21 Ca 0.15 -0.95 0.02 0.00 0.42 0.00 0.00 52.86 52.50 2k1i s ASN 21 Cb -0.09 -2.18 0.02 0.00 -1.45 0.00 0.00 41.25 37.55 2k1i s ASN 21 CO -0.23 -0.51 -0.08 -0.63 -3.72 0.00 0.00 177.10 171.93 2k1i s ILE 22 N 1.75 0.81 -1.49 -5.21 1.01 -0.98 -4.79 121.20 112.30 2k1i s ILE 22 Ca 0.06 -0.29 -0.07 0.00 0.00 0.00 0.00 60.65 60.35 2k1i s ILE 22 Cb -0.20 -0.78 0.02 0.00 0.01 0.00 0.00 42.46 41.51 2k1i s ILE 22 CO 0.10 0.28 0.77 -3.20 0.00 0.00 0.00 174.94 172.89 2k1i n ASN 23 N 3.93 -5.94 0.00 3.58 2.85 -1.26 -1.53 115.26 116.90 2k1i n ASN 23 Ca -0.24 -0.39 0.00 0.00 -0.11 0.00 0.00 54.58 53.84 2k1i n ASN 23 Cb 0.51 -4.76 0.00 0.00 1.24 0.00 0.00 39.78 36.77 2k1i n ASN 23 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2k1i n GLY 24 N -1.63 2.23 3.77 8.20 0.00 -1.26 -4.96 105.19 111.53 2k1i n GLY 24 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 2k1i n GLY 24 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k1i s ARG 25 N 0.00 4.43 -1.02 1.61 1.81 -0.58 -4.96 118.95 120.24 2k1i s ARG 25 Ca 0.00 1.82 -0.17 0.00 -1.72 0.00 0.00 55.73 55.66 2k1i s ARG 25 Cb 0.00 -2.99 0.14 0.00 -0.45 0.00 0.00 34.95 31.66 2k1i s ARG 25 CO 0.00 0.02 1.23 0.42 -0.68 0.00 0.00 175.30 176.28 2k1i s ILE 26 N -1.28 4.82 0.19 1.52 -1.09 -1.26 -2.33 121.20 121.78 2k1i s ILE 26 Ca 0.49 -1.91 -0.00 0.00 -2.23 0.00 0.00 60.65 57.00 2k1i s ILE 26 Cb -0.31 -4.82 -0.04 0.00 -1.58 0.00 0.00 42.46 35.70 2k1i s ILE 26 CO 0.40 -1.55 0.37 -0.36 -1.23 0.00 0.00 174.94 172.58 2k1i s PHE 27 N 2.35 3.48 -0.12 3.97 0.08 0.17 -4.48 117.98 123.43 2k1i s PHE 27 Ca 0.36 0.29 -0.03 0.00 0.12 0.00 0.00 56.93 57.67 2k1i s PHE 27 Cb -0.04 -1.81 -0.03 0.00 -0.57 0.00 0.00 43.02 40.56 2k1i s PHE 27 CO -0.06 0.40 0.01 0.45 -0.10 0.00 0.00 175.22 175.91 2k1i s SER 28 N -3.21 5.25 -0.71 1.36 0.15 -0.42 0.13 113.70 116.25 2k1i s SER 28 Ca 0.38 0.09 -0.27 0.00 0.70 0.00 0.00 55.95 56.85 2k1i s SER 28 Cb -0.11 -1.64 0.01 0.00 -1.71 0.00 0.00 66.02 62.57 2k1i s SER 28 CO 0.29 0.30 1.52 -0.22 1.20 0.00 0.00 173.24 176.33 2k1i s LEU 29 N -0.43 3.22 -0.09 3.45 2.96 0.15 -1.44 118.68 126.51 2k1i s LEU 29 Ca 0.08 -0.21 -0.09 0.00 -0.22 0.00 0.00 54.13 53.69 2k1i s LEU 29 Cb -0.12 -2.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.98 2k1i s LEU 29 CO 0.02 -2.05 0.20 0.00 -1.32 0.00 0.00 176.35 173.21