#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k1i h ARG 2 N 0.00 1.09 -5.98 2.89 3.08 -2.02 -3.42 114.38 110.02 2k1i h ARG 2 Ca 0.00 -0.30 -0.57 0.00 0.07 0.00 0.00 59.98 59.18 2k1i h ARG 2 Cb 0.00 -0.12 -0.06 0.00 0.08 0.00 0.00 29.97 29.87 2k1i h ARG 2 CO 0.00 1.01 -0.02 0.99 -1.07 0.00 0.00 179.97 180.88 2k1i s THR 3 N -5.16 5.02 0.06 2.04 2.01 -1.26 -5.07 115.64 113.28 2k1i s THR 3 Ca -0.12 1.21 -0.09 0.00 0.31 0.00 0.00 61.69 63.01 2k1i s THR 3 Cb 0.14 -3.93 0.00 0.00 0.01 0.00 0.00 72.50 68.73 2k1i s THR 3 CO 0.85 0.35 0.18 0.00 -0.69 0.00 0.00 174.62 175.32 2k1i s HIS 5 N -3.06 1.15 -0.24 0.00 2.46 0.58 -4.97 115.29 111.22 2k1i s HIS 5 Ca -0.01 -1.33 0.02 0.00 0.47 0.00 0.00 55.06 54.21 2k1i s HIS 5 Cb 0.01 -0.40 0.05 0.00 -0.13 0.00 0.00 32.58 32.11 2k1i s HIS 5 CO -0.07 -0.82 -0.13 0.00 -2.47 0.00 0.00 174.74 171.25 2k1i s ARG 7 N 1.15 0.43 0.21 0.00 1.70 -0.61 -4.77 118.95 117.07 2k1i s ARG 7 Ca -0.05 0.34 -0.08 0.00 -0.47 0.00 0.00 55.73 55.47 2k1i s ARG 7 Cb -0.18 0.20 0.15 0.00 -0.57 0.00 0.00 34.95 34.55 2k1i s ARG 7 CO -0.07 -0.07 1.76 0.66 -1.08 0.00 0.00 175.30 176.50 2k1i h SER 8 N 5.33 1.11 -3.16 -2.89 4.64 -1.85 -0.80 113.55 115.93 2k1i h SER 8 Ca -0.27 -0.19 -0.67 0.00 -0.47 0.00 0.00 61.79 60.19 2k1i h SER 8 Cb 1.19 -0.29 -0.34 0.00 -0.31 0.00 0.00 62.40 62.65 2k1i h SER 8 CO 0.32 1.00 -0.86 -0.60 -0.87 0.00 0.00 176.83 175.82 2k1i s ARG 9 N -5.49 3.04 -0.13 4.77 3.52 -1.26 -4.73 118.95 118.67 2k1i s ARG 9 Ca -0.12 -0.83 -0.05 0.00 -0.13 0.00 0.00 55.73 54.59 2k1i s ARG 9 Cb 0.15 -2.51 -0.04 0.00 -1.56 0.00 0.00 34.95 31.00 2k1i s ARG 9 CO 0.84 -0.08 0.06 0.00 -0.81 0.00 0.00 175.30 175.31 2k1i s LEU 11 N -0.51 2.66 0.00 0.00 1.02 -1.26 -4.86 118.68 115.73 2k1i s LEU 11 Ca 0.10 1.11 0.00 0.00 0.02 0.00 0.00 54.13 55.36 2k1i s LEU 11 Cb -0.12 -3.75 0.00 0.00 0.02 0.00 0.00 46.19 42.34 2k1i s LEU 11 CO 0.02 -1.74 0.13 0.54 0.02 0.00 0.00 176.35 175.32 2k1i n ARG 12 N -3.26 0.18 -0.01 1.70 1.74 -1.26 -1.52 116.66 114.23 2k1i n ARG 12 Ca 0.07 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.15 2k1i n ARG 12 Cb 0.58 -1.22 -0.01 0.00 -1.02 0.00 0.00 32.46 30.79 2k1i n ARG 12 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2k1i n ARG 13 N 0.61 2.58 -3.72 5.56 1.74 -1.26 -5.06 116.66 117.11 2k1i n ARG 13 Ca 0.00 -0.01 -0.21 0.00 -0.77 0.00 0.00 57.85 56.86 2k1i n ARG 13 Cb 0.06 -1.05 -0.04 0.00 -1.02 0.00 0.00 32.46 30.42 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 -2.07 2.56 0.00 5.56 8.01 -0.58 -4.82 118.70 127.36 2k1i s GLU 14 Ca -0.01 -1.48 0.02 0.00 0.01 0.00 0.00 54.97 53.51 2k1i s GLU 14 Cb 0.01 -2.37 -0.01 0.00 -4.31 0.00 0.00 34.13 27.45 2k1i s GLU 14 CO 0.08 -0.07 -0.05 0.45 0.01 0.00 0.00 175.26 175.67 2k1i s SER 15 N -4.05 0.62 -0.14 -0.19 0.15 -0.48 -4.74 113.70 104.86 2k1i s SER 15 Ca 0.45 -0.17 -0.29 0.00 0.70 0.00 0.00 55.95 56.63 2k1i s SER 15 Cb -0.04 -0.05 -0.02 0.00 -1.71 0.00 0.00 66.02 64.21 2k1i s SER 15 CO 0.27 0.01 1.23 0.21 1.20 0.00 0.00 173.24 176.16 2k1i s ASN 16 N -0.37 6.99 0.00 5.45 3.04 -1.26 -1.22 114.94 127.57 2k1i s ASN 16 Ca -0.00 1.70 0.01 0.00 0.04 0.00 0.00 52.86 54.61 2k1i s ASN 16 Cb -0.03 -2.54 0.01 0.00 -1.54 0.00 0.00 41.25 37.14 2k1i s ASN 16 CO -0.00 -0.71 0.50 -1.54 -3.04 0.00 0.00 177.10 172.31 2k1i n SER 17 N 6.21 1.02 0.00 -4.21 3.41 -0.16 -4.97 113.62 114.91 2k1i n SER 17 Ca 0.13 -1.01 0.00 0.00 -0.26 0.00 0.00 58.87 57.73 2k1i n SER 17 Cb 0.45 0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 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 0.14 -0.96 3.16 5.00 0.00 -1.16 -4.99 105.19 106.38 2k1i n GLY 18 Ca 0.01 -0.93 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 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 0.93 0.08 1.61 1.04 -1.26 -0.44 113.70 111.66 2k1i s SER 19 Ca 0.00 -1.06 -0.10 0.00 0.48 0.00 0.00 55.95 55.27 2k1i s SER 19 Cb 0.00 0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.27 2k1i s SER 19 CO 0.00 -0.54 0.22 0.00 0.98 0.00 0.00 173.24 173.90 2k1i s ASN 21 N -2.60 4.06 -0.08 0.00 0.02 -1.26 -1.58 114.94 113.50 2k1i s ASN 21 Ca 0.01 -1.23 0.01 0.00 -1.02 0.00 0.00 52.86 50.63 2k1i s ASN 21 Cb 0.03 -1.38 0.02 0.00 0.02 0.00 0.00 41.25 39.94 2k1i s ASN 21 CO -0.09 -0.19 -0.07 -0.63 0.02 0.00 0.00 177.10 176.14 2k1i s ILE 22 N 1.25 0.86 -1.49 0.60 1.01 -0.97 -4.78 121.20 117.68 2k1i s ILE 22 Ca -0.06 -0.25 -0.06 0.00 0.00 0.00 0.00 60.65 60.28 2k1i s ILE 22 Cb -0.19 -0.86 0.02 0.00 0.01 0.00 0.00 42.46 41.44 2k1i s ILE 22 CO -0.06 0.32 0.67 -3.20 0.00 0.00 0.00 174.94 172.66 2k1i n ASN 23 N 4.46 -5.67 0.00 3.58 2.85 -1.26 -1.50 115.26 117.72 2k1i n ASN 23 Ca -0.17 -0.36 0.00 0.00 -0.11 0.00 0.00 54.58 53.94 2k1i n ASN 23 Cb 0.51 -4.58 0.00 0.00 1.24 0.00 0.00 39.78 36.95 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 -1.52 2.24 3.76 8.20 0.00 -1.26 -4.96 105.19 111.65 2k1i n GLY 24 Ca -0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 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 4.50 -0.34 1.61 0.52 -0.56 -4.99 118.95 119.68 2k1i s ARG 25 Ca 0.00 1.82 -0.19 0.00 -0.52 0.00 0.00 55.73 56.84 2k1i s ARG 25 Cb 0.00 -3.06 -0.00 0.00 0.52 0.00 0.00 34.95 32.41 2k1i s ARG 25 CO 0.00 0.08 0.57 0.42 0.02 0.00 0.00 175.30 176.39 2k1i s ILE 26 N -1.24 4.96 0.11 1.52 -1.09 -1.26 -2.28 121.20 121.92 2k1i s ILE 26 Ca 0.48 0.51 0.07 0.00 -2.23 0.00 0.00 60.65 59.47 2k1i s ILE 26 Cb -0.32 -4.01 -0.04 0.00 -1.58 0.00 0.00 42.46 36.52 2k1i s ILE 26 CO 0.41 -0.24 -0.10 -0.36 -1.23 0.00 0.00 174.94 173.42 2k1i s PHE 27 N 2.54 2.72 -0.22 3.97 0.08 -0.61 -4.49 117.98 121.97 2k1i s PHE 27 Ca 0.22 -0.17 -0.12 0.00 0.12 0.00 0.00 56.93 56.98 2k1i s PHE 27 Cb -0.15 -1.42 -0.05 0.00 -0.57 0.00 0.00 43.02 40.84 2k1i s PHE 27 CO 0.14 0.43 0.24 0.45 -0.10 0.00 0.00 175.22 176.37 2k1i s SER 28 N -2.25 6.24 -0.60 1.36 0.15 -0.31 -0.63 113.70 117.66 2k1i s SER 28 Ca 0.21 0.27 -0.26 0.00 0.70 0.00 0.00 55.95 56.87 2k1i s SER 28 Cb -0.11 -2.15 -0.03 0.00 -1.71 0.00 0.00 66.02 62.03 2k1i s SER 28 CO 0.14 0.04 1.92 -0.22 1.20 0.00 0.00 173.24 176.31 2k1i s LEU 29 N 1.03 3.30 -0.17 3.45 2.96 0.42 -1.57 118.68 128.10 2k1i s LEU 29 Ca 0.12 0.40 -0.10 0.00 -0.22 0.00 0.00 54.13 54.33 2k1i s LEU 29 Cb -0.14 -2.53 -0.05 0.00 0.50 0.00 0.00 46.19 43.98 2k1i s LEU 29 CO 0.05 -2.44 0.15 0.00 -1.32 0.00 0.00 176.35 172.79