#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lup s GLN 3 N -0.79 1.64 -1.28 0.00 1.11 -1.26 -4.72 119.66 114.37 1lup s GLN 3 Ca -0.22 1.63 -0.11 0.00 0.01 0.00 0.00 55.36 56.67 1lup s GLN 3 Cb 0.01 -1.79 -0.06 0.00 -1.01 0.00 0.00 33.01 30.16 1lup s GLN 3 CO 0.67 -2.18 2.45 1.63 0.01 0.00 0.00 175.29 177.87 1lup n LYS 4 N -3.46 2.80 -1.34 2.91 4.01 -1.26 -4.68 118.16 117.14 1lup n LYS 4 Ca 0.12 -1.99 0.16 0.00 -0.51 0.00 0.00 58.31 56.09 1lup n LYS 4 Cb 0.51 -2.79 -0.07 0.00 -0.51 0.00 0.00 35.03 32.17 1lup n LYS 4 CO 0.00 0.00 0.00 1.87 -1.11 0.00 0.00 177.40 178.16 1lup n TRP 5 N 4.66 -3.36 -2.92 2.13 -0.00 -1.26 -4.78 117.44 111.91 1lup n TRP 5 Ca 0.60 1.82 -0.20 0.00 -0.00 0.00 0.00 57.50 59.72 1lup n TRP 5 Cb 0.25 -3.05 0.01 0.00 -0.00 0.00 0.00 31.31 28.51 1lup n TRP 5 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 177.69 177.57 1lup n MET 6 N -4.12 -3.39 -3.79 5.87 1.56 0.23 -4.84 117.12 108.64 1lup n MET 6 Ca -0.06 0.70 -0.35 0.00 -0.27 0.00 0.00 57.70 57.71 1lup n MET 6 Cb 0.63 -5.42 -0.05 0.00 2.15 0.00 0.00 33.22 30.52 1lup n MET 6 CO 0.00 0.00 0.00 -0.46 -0.73 0.00 0.00 175.97 174.78 1lup s TRP 7 N -2.94 3.58 0.66 1.12 -0.11 -1.26 -4.55 118.94 115.44 1lup s TRP 7 Ca 0.23 0.55 -0.17 0.00 1.22 0.00 0.00 56.10 57.93 1lup s TRP 7 Cb -0.11 -1.97 -0.05 0.00 -1.50 0.00 0.00 33.47 29.84 1lup s TRP 7 CO 0.28 0.64 0.65 -2.37 -4.62 0.00 0.00 176.95 171.53 1lup n THR 8 N 1.26 2.37 -4.22 5.86 5.66 -1.26 0.40 114.28 124.35 1lup n THR 8 Ca -0.13 -0.44 -0.34 0.00 -3.05 0.00 0.00 64.05 60.09 1lup n THR 8 Cb 0.53 -0.83 -0.08 0.00 -1.55 0.00 0.00 70.33 68.40 1lup n THR 8 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1lup n ASP 10 N 1.58 0.00 -0.19 0.00 -0.08 -1.26 -4.91 116.55 111.70 1lup n ASP 10 Ca -0.16 -0.75 0.21 0.00 -1.51 0.00 0.00 54.79 52.59 1lup n ASP 10 Cb 0.53 0.00 0.58 0.00 2.34 0.00 0.00 41.12 44.57 1lup n ASP 10 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1lup h GLU 11 N 0.00 0.26 -2.56 -0.67 4.81 -2.06 -3.33 114.58 111.03 1lup h GLU 11 Ca 0.00 -0.02 -0.46 0.00 -0.13 0.00 0.00 59.36 58.75 1lup h GLU 11 Cb 0.00 -0.06 -0.38 0.00 0.63 0.00 0.00 28.75 28.94 1lup h GLU 11 CO 0.00 0.17 -0.73 -1.83 -0.73 0.00 0.00 179.01 175.89 1lup s GLU 12 N -5.28 0.25 -0.21 1.92 -1.05 -1.26 -5.12 118.70 107.96 1lup s GLU 12 Ca -0.07 -0.44 -0.22 0.00 -0.15 0.00 0.00 54.97 54.10 1lup s GLU 12 Cb 0.22 -0.99 -0.02 0.00 -0.44 0.00 0.00 34.13 32.89 1lup s GLU 12 CO 0.77 -1.03 0.68 0.50 0.95 0.00 0.00 175.26 177.13 1lup s ARG 13 N 2.14 4.20 0.26 -4.83 3.52 -1.25 -4.95 118.95 118.04 1lup s ARG 13 Ca 0.10 0.69 -0.02 0.00 -0.13 0.00 0.00 55.73 56.37 1lup s ARG 13 Cb -0.16 -3.60 0.48 0.00 -1.56 0.00 0.00 34.95 30.11 1lup s ARG 13 CO -0.34 -0.31 1.81 0.87 -0.81 0.00 0.00 175.30 176.53 1lup h LYS 14 N 7.55 0.82 -5.04 5.12 6.56 -1.97 -3.44 116.57 126.16 1lup h LYS 14 Ca -0.30 -0.05 -0.55 0.00 -1.06 0.00 0.00 60.65 58.70 1lup h LYS 14 Cb 1.13 -0.18 0.11 0.00 -0.57 0.00 0.00 32.23 32.71 1lup h LYS 14 CO 0.79 0.54 -0.57 0.00 -2.06 0.00 0.00 179.45 178.16 1lup h GLU 17 N -0.21 0.00 -0.00 0.00 4.39 -1.94 -1.81 114.58 115.00 1lup h GLU 17 Ca -0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1lup h GLU 17 Cb 1.28 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.93 1lup h GLU 17 CO 0.51 0.00 0.12 0.78 -1.16 0.00 0.00 179.01 179.26 1lup h GLY 18 N 0.00 0.00 -2.85 -3.84 0.00 -2.01 -3.42 103.07 90.95 1lup h GLY 18 Ca 0.01 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.79 1lup h GLY 18 CO -0.00 0.00 -0.61 1.08 0.00 0.00 0.00 176.54 177.01 1lup s LEU 19 N -6.07 3.41 0.27 3.11 1.43 -0.68 -5.07 118.68 115.08 1lup s LEU 19 Ca -0.04 -0.48 -0.03 0.00 -1.03 0.00 0.00 54.13 52.55 1lup s LEU 19 Cb 0.12 -1.96 -0.05 0.00 0.03 0.00 0.00 46.19 44.33 1lup s LEU 19 CO 0.37 0.01 0.52 -0.69 0.23 0.00 0.00 176.35 176.78 1lup s VAL 20 N -2.16 5.07 -0.27 -1.59 1.01 -1.24 -4.93 120.40 116.30 1lup s VAL 20 Ca 0.31 -0.08 -0.09 0.00 0.00 0.00 0.00 61.98 62.12 1lup s VAL 20 Cb -0.07 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1lup s VAL 20 CO 0.21 -0.31 0.13 0.00 0.00 0.00 0.00 175.10 175.14 1lup s ARG 22 N 1.67 0.29 0.00 0.00 3.52 -1.26 -4.99 118.95 118.19 1lup s ARG 22 Ca 0.06 0.24 0.00 0.00 -0.13 0.00 0.00 55.73 55.90 1lup s ARG 22 Cb -0.16 0.12 0.00 0.00 -1.56 0.00 0.00 34.95 33.35 1lup s ARG 22 CO 0.07 -0.53 0.00 1.28 -0.81 0.00 0.00 175.30 175.31 1lup n LEU 23 N 5.09 0.00 -3.81 -0.88 4.77 -1.26 -4.63 117.00 116.28 1lup n LEU 23 Ca 0.08 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.95 1lup n LEU 23 Cb 0.57 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.57 1lup n LEU 23 CO -0.12 0.00 -0.06 -1.66 -1.33 0.00 0.00 177.39 174.22 1lup s TRP 24 N 0.00 -0.03 -0.35 -1.77 -2.14 -1.26 -2.04 118.94 111.34 1lup s TRP 24 Ca 0.00 -0.08 -0.32 0.00 2.66 0.00 0.00 56.10 58.36 1lup s TRP 24 Cb 0.00 0.02 -0.10 0.00 -3.10 0.00 0.00 33.47 30.29 1lup s TRP 24 CO 0.00 -0.41 2.24 0.00 -2.66 0.00 0.00 176.95 176.12 1lup s LYS 26 N 6.57 2.12 -0.19 0.00 -2.85 -1.24 0.75 119.74 124.90 1lup s LYS 26 Ca 1.07 -1.96 -0.04 0.00 -1.00 0.00 0.00 55.97 54.05 1lup s LYS 26 Cb -0.67 -1.84 0.09 0.00 -2.06 0.00 0.00 37.83 33.35 1lup s LYS 26 CO 0.43 -0.09 0.25 -0.98 0.10 0.00 0.00 175.35 175.06 1lup s ARG 27 N -3.83 0.20 0.17 1.78 3.03 -1.26 -3.60 118.95 115.44 1lup s ARG 27 Ca 0.38 0.36 -0.33 0.00 2.03 0.00 0.00 55.73 58.18 1lup s ARG 27 Cb 0.06 -0.86 -0.13 0.00 -1.03 0.00 0.00 34.95 33.00 1lup s ARG 27 CO 0.21 -0.57 1.65 -0.89 -1.13 0.00 0.00 175.30 174.57 1lup n ILE 28 N 5.33 0.03 -4.54 4.99 2.08 -1.26 -5.00 119.36 121.00 1lup n ILE 28 Ca -0.05 -0.01 -0.21 0.00 0.56 0.00 0.00 62.75 63.04 1lup n ILE 28 Cb 0.50 -1.74 -0.15 0.00 -0.75 0.00 0.00 39.64 37.50 1lup n ILE 28 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 1lup s ILE 29 N 1.18 0.96 0.00 1.39 -1.09 -1.26 -5.03 121.20 117.35 1lup s ILE 29 Ca 0.78 -0.52 0.00 0.00 -2.23 0.00 0.00 60.65 58.68 1lup s ILE 29 Cb -0.61 -0.80 0.00 0.00 -1.58 0.00 0.00 42.46 39.47 1lup s ILE 29 CO 0.36 0.27 0.00 -0.46 -1.23 0.00 0.00 174.94 173.88 1lup n ASN 30 N 2.80 0.43 0.00 3.58 0.23 -1.26 -5.36 115.26 115.69 1lup n ASN 30 Ca -0.14 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.91 1lup n ASN 30 Cb 0.56 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 1lup n ASN 30 CO 0.00 0.00 0.00 1.15 -0.93 0.00 0.00 177.26 177.48