#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 4.37 -0.09 2.89 3.52 -1.26 -5.03 118.95 123.36 2k1i s ARG 2 Ca 0.00 2.18 0.04 0.00 -0.13 0.00 0.00 55.73 57.82 2k1i s ARG 2 Cb 0.00 -3.09 -0.00 0.00 -1.56 0.00 0.00 34.95 30.29 2k1i s ARG 2 CO 0.00 -0.18 -0.23 0.99 -0.81 0.00 0.00 175.30 175.07 2k1i s THR 3 N -0.94 2.00 0.20 4.11 2.01 -1.26 -5.13 115.64 116.63 2k1i s THR 3 Ca 0.50 -0.99 -0.09 0.00 0.31 0.00 0.00 61.69 61.42 2k1i s THR 3 Cb -0.39 -1.72 -0.01 0.00 0.01 0.00 0.00 72.50 70.39 2k1i s THR 3 CO 0.50 0.55 0.32 0.00 -0.69 0.00 0.00 174.62 175.30 2k1i s HIS 5 N -4.02 0.28 -0.10 0.00 2.46 -0.33 -5.01 115.29 108.57 2k1i s HIS 5 Ca 0.23 -0.64 0.03 0.00 0.47 0.00 0.00 55.06 55.15 2k1i s HIS 5 Cb 0.03 0.22 -0.00 0.00 -0.13 0.00 0.00 32.58 32.69 2k1i s HIS 5 CO 0.05 -0.97 -0.22 0.00 -2.47 0.00 0.00 174.74 171.13 2k1i s ARG 7 N 0.28 0.79 0.16 0.00 1.70 -0.58 -4.89 118.95 116.41 2k1i s ARG 7 Ca -0.16 0.01 -0.14 0.00 -0.47 0.00 0.00 55.73 54.97 2k1i s ARG 7 Cb -0.17 0.36 0.05 0.00 -0.57 0.00 0.00 34.95 34.62 2k1i s ARG 7 CO 0.08 -0.22 1.79 0.77 -1.08 0.00 0.00 175.30 176.63 2k1i h SER 8 N 3.67 0.62 -3.82 -2.89 0.02 -1.86 -1.37 113.55 107.93 2k1i h SER 8 Ca -0.29 -0.07 -0.64 0.00 -0.84 0.00 0.00 61.79 59.95 2k1i h SER 8 Cb 1.16 -0.16 -0.32 0.00 0.14 0.00 0.00 62.40 63.23 2k1i h SER 8 CO 0.38 0.52 -0.87 -0.13 -1.14 0.00 0.00 176.83 175.59 2k1i s ARG 9 N -5.92 2.37 -0.08 3.45 0.52 -1.26 -4.65 118.95 113.38 2k1i s ARG 9 Ca -0.13 -0.79 0.00 0.00 -0.52 0.00 0.00 55.73 54.30 2k1i s ARG 9 Cb 0.12 -1.97 -0.03 0.00 0.52 0.00 0.00 34.95 33.59 2k1i s ARG 9 CO 0.75 0.28 -0.07 0.00 0.02 0.00 0.00 175.30 176.29 2k1i s LEU 11 N -0.71 3.22 0.00 0.00 2.01 -1.26 -4.91 118.68 117.03 2k1i s LEU 11 Ca 0.11 0.01 0.00 0.00 0.01 0.00 0.00 54.13 54.26 2k1i s LEU 11 Cb -0.11 -2.85 0.00 0.00 0.01 0.00 0.00 46.19 43.23 2k1i s LEU 11 CO 0.02 -1.21 0.16 -2.11 1.01 0.00 0.00 176.35 174.22 2k1i n ARG 12 N -2.41 0.20 -0.01 1.70 1.85 -1.26 -1.70 116.66 115.04 2k1i n ARG 12 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.93 2k1i n ARG 12 Cb 0.60 -1.27 -0.02 0.00 -1.05 0.00 0.00 32.46 30.71 2k1i n ARG 12 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2k1i n ARG 13 N 0.69 1.83 -4.15 2.89 1.74 -1.26 -5.06 116.66 113.33 2k1i n ARG 13 Ca 0.00 -0.01 -0.24 0.00 -0.77 0.00 0.00 57.85 56.83 2k1i n ARG 13 Cb 0.08 -1.07 -0.07 0.00 -1.02 0.00 0.00 32.46 30.38 2k1i n ARG 13 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2k1i s GLU 14 N -2.13 2.27 -0.02 5.56 8.01 -0.69 -4.83 118.70 126.89 2k1i s GLU 14 Ca -0.01 -1.66 0.03 0.00 0.01 0.00 0.00 54.97 53.35 2k1i s GLU 14 Cb 0.01 -2.08 -0.01 0.00 -4.31 0.00 0.00 34.13 27.75 2k1i s GLU 14 CO 0.11 0.06 -0.11 0.45 0.01 0.00 0.00 175.26 175.78 2k1i s SER 15 N -3.83 1.34 -0.43 -0.19 0.15 -0.46 -4.75 113.70 105.53 2k1i s SER 15 Ca 0.38 -0.21 -0.29 0.00 0.70 0.00 0.00 55.95 56.53 2k1i s SER 15 Cb -0.01 -0.22 0.02 0.00 -1.71 0.00 0.00 66.02 64.10 2k1i s SER 15 CO 0.22 0.12 1.25 0.21 1.20 0.00 0.00 173.24 176.24 2k1i s ASN 16 N -0.13 6.53 0.00 5.45 3.84 -1.26 -1.27 114.94 128.11 2k1i s ASN 16 Ca 0.02 0.69 0.20 0.00 0.21 0.00 0.00 52.86 53.97 2k1i s ASN 16 Cb -0.06 -2.54 0.01 0.00 -0.55 0.00 0.00 41.25 38.10 2k1i s ASN 16 CO -0.00 -1.30 0.99 -1.54 -2.79 0.00 0.00 177.10 172.47 2k1i n SER 17 N 8.17 1.93 0.00 -4.21 3.41 0.25 -5.00 113.62 118.16 2k1i n SER 17 Ca 0.14 -1.46 0.00 0.00 -0.26 0.00 0.00 58.87 57.29 2k1i n SER 17 Cb 0.48 0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.86 2k1i n SER 17 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2k1i n GLY 18 N 1.28 -0.60 3.13 5.00 0.00 -1.20 -5.00 105.19 107.81 2k1i n GLY 18 Ca 0.08 -0.64 -0.09 0.00 0.00 0.00 0.00 46.02 45.37 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 -4.00 0.72 0.10 1.61 1.04 -1.26 -1.27 113.70 110.64 2k1i s SER 19 Ca 0.00 -1.03 -0.11 0.00 0.48 0.00 0.00 55.95 55.28 2k1i s SER 19 Cb 0.00 0.17 0.01 0.00 0.10 0.00 0.00 66.02 66.30 2k1i s SER 19 CO 0.00 -0.57 0.27 0.00 0.98 0.00 0.00 173.24 173.92 2k1i s ASN 21 N -2.81 4.21 -0.06 0.00 4.22 -1.26 -0.40 114.94 118.85 2k1i s ASN 21 Ca 0.04 -1.31 0.02 0.00 -2.14 0.00 0.00 52.86 49.47 2k1i s ASN 21 Cb 0.04 -1.40 0.01 0.00 1.28 0.00 0.00 41.25 41.18 2k1i s ASN 21 CO -0.11 -0.21 -0.11 -0.63 -2.04 0.00 0.00 177.10 174.00 2k1i s ILE 22 N 1.22 0.99 -1.48 0.54 1.01 -0.96 -4.77 121.20 117.74 2k1i s ILE 22 Ca -0.08 -0.40 -0.05 0.00 0.00 0.00 0.00 60.65 60.12 2k1i s ILE 22 Cb -0.20 -0.92 0.02 0.00 0.01 0.00 0.00 42.46 41.38 2k1i s ILE 22 CO -0.05 0.32 0.49 0.59 0.00 0.00 0.00 174.94 176.28 2k1i n ASN 23 N 3.79 -5.39 0.00 3.58 5.03 -1.26 -1.52 115.26 119.49 2k1i n ASN 23 Ca -0.23 -0.26 0.00 0.00 0.87 0.00 0.00 54.58 54.96 2k1i n ASN 23 Cb 0.52 -4.40 0.00 0.00 -1.02 0.00 0.00 39.78 34.88 2k1i n ASN 23 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2k1i n GLY 24 N -1.35 2.04 3.78 7.41 0.00 -1.26 -4.95 105.19 110.85 2k1i n GLY 24 Ca -0.10 0.00 -0.36 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 3.84 -0.49 1.61 1.81 -0.57 -4.97 118.95 120.17 2k1i s ARG 25 Ca 0.00 1.53 -0.25 0.00 -1.72 0.00 0.00 55.73 55.29 2k1i s ARG 25 Cb 0.00 -2.28 0.03 0.00 -0.45 0.00 0.00 34.95 32.25 2k1i s ARG 25 CO 0.00 -0.43 0.94 0.42 -0.68 0.00 0.00 175.30 175.55 2k1i s ILE 26 N -1.76 4.43 -0.13 1.52 -1.09 -1.26 -2.27 121.20 120.63 2k1i s ILE 26 Ca 0.64 0.61 -0.07 0.00 -2.23 0.00 0.00 60.65 59.60 2k1i s ILE 26 Cb -0.22 -4.48 -0.04 0.00 -1.58 0.00 0.00 42.46 36.14 2k1i s ILE 26 CO 0.26 -0.94 0.14 -0.36 -1.23 0.00 0.00 174.94 172.80 2k1i s PHE 27 N 3.87 3.56 0.00 3.97 0.40 0.47 -4.64 117.98 125.60 2k1i s PHE 27 Ca 0.35 0.49 -0.18 0.00 -0.60 0.00 0.00 56.93 56.99 2k1i s PHE 27 Cb -0.11 -1.98 -0.06 0.00 0.51 0.00 0.00 43.02 41.39 2k1i s PHE 27 CO 0.24 0.65 0.51 -1.12 0.70 0.00 0.00 175.22 176.20 2k1i s SER 28 N -0.77 6.90 -0.69 1.36 0.01 -0.52 0.11 113.70 120.11 2k1i s SER 28 Ca 0.14 1.07 -0.27 0.00 1.31 0.00 0.00 55.95 58.20 2k1i s SER 28 Cb -0.12 -2.32 0.02 0.00 0.21 0.00 0.00 66.02 63.82 2k1i s SER 28 CO 0.03 0.20 1.38 -0.22 0.41 0.00 0.00 173.24 175.04 2k1i s LEU 29 N -0.59 3.23 -0.25 2.44 2.96 -0.39 -1.52 118.68 124.55 2k1i s LEU 29 Ca 0.27 -0.20 -0.08 0.00 -0.22 0.00 0.00 54.13 53.90 2k1i s LEU 29 Cb -0.18 -2.66 -0.03 0.00 0.50 0.00 0.00 46.19 43.82 2k1i s LEU 29 CO 0.15 -1.88 0.09 0.00 -1.32 0.00 0.00 176.35 173.40