#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dll s LYS 2 N 0.00 3.22 -0.55 2.12 2.20 -1.26 -5.03 119.74 120.45 3dll s LYS 2 Ca 0.00 -0.73 -0.18 0.00 -0.36 0.00 0.00 55.97 54.69 3dll s LYS 2 Cb 0.00 -2.69 0.09 0.00 -1.51 0.00 0.00 37.83 33.72 3dll s LYS 2 CO 0.00 -0.04 0.62 0.08 -0.36 0.00 0.00 175.35 175.65 3dll s VAL 3 N 0.98 4.92 0.29 4.02 1.01 -1.26 -3.35 120.40 127.01 3dll s VAL 3 Ca -0.02 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.11 3dll s VAL 3 Cb -0.15 -4.37 -0.03 0.00 0.00 0.00 0.00 36.38 31.83 3dll s VAL 3 CO -0.02 -0.94 0.43 -0.13 0.00 0.00 0.00 175.10 174.44 3dll s ARG 4 N 2.44 3.37 0.00 2.72 0.52 -1.19 -4.94 118.95 121.87 3dll s ARG 4 Ca 0.11 -0.72 0.29 0.00 -0.52 0.00 0.00 55.73 54.89 3dll s ARG 4 Cb -0.23 -2.82 1.37 0.00 0.52 0.00 0.00 34.95 33.79 3dll s ARG 4 CO 0.08 0.28 1.94 0.45 0.02 0.00 0.00 175.30 178.07 3dll n SER 5 N -1.55 0.53 -3.90 0.23 2.88 -1.26 -4.48 113.62 106.08 3dll n SER 5 Ca -0.06 -0.84 -0.30 0.00 -1.33 0.00 0.00 58.87 56.34 3dll n SER 5 Cb 0.57 -0.05 -0.15 0.00 -0.75 0.00 0.00 64.21 63.83 3dll n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3dll s SER 6 N -2.27 4.18 -0.69 -3.46 0.15 -1.26 -5.08 113.70 105.26 3dll s SER 6 Ca 0.35 -1.62 -0.08 0.00 0.70 0.00 0.00 55.95 55.30 3dll s SER 6 Cb 0.21 -1.21 0.18 0.00 -1.71 0.00 0.00 66.02 63.49 3dll s SER 6 CO 0.42 -0.34 0.57 -0.69 1.20 0.00 0.00 173.24 174.40 3dll s VAL 7 N 1.32 4.54 0.00 4.45 1.01 -1.26 -5.04 120.40 125.41 3dll s VAL 7 Ca 0.04 -2.66 0.00 0.00 0.00 0.00 0.00 61.98 59.37 3dll s VAL 7 Cb -0.18 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.31 3dll s VAL 7 CO -0.13 -0.93 0.00 2.29 0.00 0.00 0.00 175.10 176.33 3dll n LYS 8 N 3.81 3.82 -4.33 2.72 2.85 -1.26 -5.08 118.16 120.69 3dll n LYS 8 Ca 0.09 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 57.00 3dll n LYS 8 Cb 0.42 0.00 -0.09 0.00 -0.65 0.00 0.00 35.03 34.71 3dll n LYS 8 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 3dll s LYS 9 N 1.85 2.99 -0.05 -1.58 3.01 -1.26 -5.00 119.74 119.69 3dll s LYS 9 Ca 0.00 -0.41 0.08 0.00 -1.01 0.00 0.00 55.97 54.63 3dll s LYS 9 Cb 0.00 -2.81 0.15 0.00 -1.01 0.00 0.00 37.83 34.16 3dll s LYS 9 CO 0.00 0.70 1.09 -1.33 0.51 0.00 0.00 175.35 176.32 3dll n MET 10 N 2.03 2.43 -0.31 1.68 2.81 -1.26 -5.06 117.12 119.43 3dll n MET 10 Ca -0.18 -1.96 0.00 0.00 -1.81 0.00 0.00 57.70 53.75 3dll n MET 10 Cb 0.54 -1.23 0.00 0.00 -0.71 0.00 0.00 33.22 31.82 3dll n MET 10 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3dll n ASP 12 N -0.06 3.98 0.00 0.00 2.03 -1.26 -4.29 116.55 116.95 3dll n ASP 12 Ca 0.00 -3.56 0.00 0.00 0.52 0.00 0.00 54.79 51.75 3dll n ASP 12 Cb 0.00 -0.53 0.00 0.00 -0.72 0.00 0.00 41.12 39.87 3dll n ASP 12 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3dll n ASN 13 N -0.25 0.00 -4.42 1.67 3.02 -1.26 -5.06 115.26 108.95 3dll n ASN 13 Ca 0.31 0.00 -0.47 0.00 -0.03 0.00 0.00 54.58 54.39 3dll n ASN 13 Cb 0.53 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.57 3dll n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dll s LYS 15 N 7.87 3.76 -0.30 0.00 -0.14 -1.26 -4.94 119.74 124.75 3dll s LYS 15 Ca 1.27 -2.88 -0.29 0.00 -1.36 0.00 0.00 55.97 52.71 3dll s LYS 15 Cb -1.25 -4.39 -0.01 0.00 -1.68 0.00 0.00 37.83 30.50 3dll s LYS 15 CO 0.53 -1.26 1.54 0.08 -0.76 0.00 0.00 175.35 175.48 3dll s VAL 16 N -0.63 3.79 0.32 3.17 1.01 -1.26 0.17 120.40 126.97 3dll s VAL 16 Ca 0.24 0.87 0.10 0.00 0.00 0.00 0.00 61.98 63.19 3dll s VAL 16 Cb -0.10 -3.89 -0.06 0.00 0.00 0.00 0.00 36.38 32.32 3dll s VAL 16 CO -0.09 -0.45 -0.13 -0.69 0.00 0.00 0.00 175.10 173.75 3dll s VAL 17 N 5.36 2.38 -0.29 2.92 1.01 0.34 -4.97 120.40 127.16 3dll s VAL 17 Ca 0.68 -2.26 -0.01 0.00 0.00 0.00 0.00 61.98 60.39 3dll s VAL 17 Cb -0.20 -2.53 0.13 0.00 0.00 0.00 0.00 36.38 33.78 3dll s VAL 17 CO 0.29 -0.28 0.30 -0.13 0.00 0.00 0.00 175.10 175.28 3dll s ARG 18 N -3.58 0.32 0.00 2.72 1.81 -1.25 -0.48 118.95 118.50 3dll s ARG 18 Ca 0.32 -0.11 0.00 0.00 -1.72 0.00 0.00 55.73 54.21 3dll s ARG 18 Cb -0.01 -0.67 0.00 0.00 -0.45 0.00 0.00 34.95 33.83 3dll s ARG 18 CO 0.16 -1.01 0.00 0.54 -0.68 0.00 0.00 175.30 174.31 3dll n ARG 19 N 5.31 0.78 -1.55 3.54 1.74 0.48 -4.81 116.66 122.15 3dll n ARG 19 Ca -0.02 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.67 3dll n ARG 19 Cb 0.47 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.86 3dll n ARG 19 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 3dll n HIS 20 N 0.00 1.46 -3.28 -1.55 -0.00 -1.26 -3.29 115.22 107.30 3dll n HIS 20 Ca 0.00 0.11 -0.14 0.00 -0.00 0.00 0.00 57.72 57.69 3dll n HIS 20 Cb 0.00 -2.63 -0.04 0.00 -0.00 0.00 0.00 29.99 27.32 3dll n HIS 20 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3dll n GLY 21 N 6.05 -0.06 3.25 1.57 0.00 -1.26 -4.84 105.19 109.90 3dll n GLY 21 Ca 0.39 0.08 -0.13 0.00 0.00 0.00 0.00 46.02 46.35 3dll n GLY 21 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dll s ARG 22 N -4.88 0.64 -0.77 1.61 6.06 -1.21 -5.01 118.95 115.39 3dll s ARG 22 Ca 0.02 -0.07 0.01 0.00 -2.50 0.00 0.00 55.73 53.19 3dll s ARG 22 Cb -0.01 0.29 0.35 0.00 0.06 0.00 0.00 34.95 35.64 3dll s ARG 22 CO 0.44 -0.17 1.53 0.28 -2.50 0.00 0.00 175.30 174.89 3dll n VAL 23 N 1.52 4.09 -1.73 7.11 0.31 -1.26 -0.39 118.33 127.98 3dll n VAL 23 Ca -0.20 -5.29 -0.41 0.00 -0.01 0.00 0.00 64.34 58.43 3dll n VAL 23 Cb 0.56 -1.39 0.01 0.00 -0.91 0.00 0.00 33.84 32.12 3dll n VAL 23 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3dll n LEU 24 N -0.30 4.46 -4.58 7.52 4.32 0.37 -4.28 117.00 124.51 3dll n LEU 24 Ca 0.43 1.14 -0.34 0.00 -0.02 0.00 0.00 56.01 57.22 3dll n LEU 24 Cb 0.36 -1.55 -0.11 0.00 -1.62 0.00 0.00 43.42 40.49 3dll n LEU 24 CO 0.44 -0.34 -0.36 -0.69 -1.22 0.00 0.00 177.39 175.21 3dll s VAL 25 N -1.17 3.84 -0.49 4.08 1.01 -0.74 0.13 120.40 127.04 3dll s VAL 25 Ca 0.59 -0.42 0.07 0.00 0.00 0.00 0.00 61.98 62.22 3dll s VAL 25 Cb -0.49 -2.60 0.37 0.00 0.00 0.00 0.00 36.38 33.66 3dll s VAL 25 CO 0.59 0.58 0.96 2.30 0.00 0.00 0.00 175.10 179.53 3dll n ILE 26 N 2.47 2.26 -1.63 2.22 -5.35 0.13 -3.67 119.36 115.78 3dll n ILE 26 Ca -0.18 -5.08 -0.31 0.00 -0.27 0.00 0.00 62.75 56.91 3dll n ILE 26 Cb 0.53 -1.04 0.04 0.00 -1.74 0.00 0.00 39.64 37.43 3dll n ILE 26 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3dll h SER 28 N -0.65 -0.11 -4.34 0.00 4.64 -1.97 -3.41 113.55 107.71 3dll h SER 28 Ca -0.44 0.12 -0.51 0.00 -0.47 0.00 0.00 61.79 60.49 3dll h SER 28 Cb 1.21 0.18 0.09 0.00 -0.31 0.00 0.00 62.40 63.58 3dll h SER 28 CO 0.58 -0.03 0.37 0.21 -0.87 0.00 0.00 176.83 177.09 3dll s ASN 29 N -5.27 5.38 -0.21 4.97 3.84 -1.26 -5.00 114.94 117.39 3dll s ASN 29 Ca -0.13 1.58 0.07 0.00 0.21 0.00 0.00 52.86 54.59 3dll s ASN 29 Cb 0.17 -2.46 -0.21 0.00 -0.55 0.00 0.00 41.25 38.20 3dll s ASN 29 CO 0.73 -1.44 0.01 1.33 -2.79 0.00 0.00 177.10 174.94 3dll n VAL 30 N -3.12 1.51 0.61 -5.21 0.24 -1.26 -3.76 118.33 107.33 3dll n VAL 30 Ca 0.07 -0.69 0.00 0.00 -2.04 0.00 0.00 64.34 61.68 3dll n VAL 30 Cb 0.54 -1.13 0.00 0.00 -1.47 0.00 0.00 33.84 31.78 3dll n VAL 30 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3dll n LYS 31 N -3.11 0.50 -0.00 7.34 4.01 -1.26 -0.22 118.16 125.42 3dll n LYS 31 Ca -0.38 0.00 0.02 0.00 -0.51 0.00 0.00 58.31 57.45 3dll n LYS 31 Cb 1.06 -1.20 -0.04 0.00 -0.51 0.00 0.00 35.03 34.34 3dll n LYS 31 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 3dll n HIS 32 N 0.09 0.00 -1.73 2.13 8.25 -1.25 -4.99 115.22 117.74 3dll n HIS 32 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 3dll n HIS 32 Cb 0.10 -0.10 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 3dll n HIS 32 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3dll s LYS 33 N -2.28 4.13 0.34 -0.41 1.02 0.69 -4.58 119.74 118.66 3dll s LYS 33 Ca -0.02 2.60 0.05 0.00 0.02 0.00 0.00 55.97 58.62 3dll s LYS 33 Cb 0.03 -3.30 -0.07 0.00 -0.52 0.00 0.00 37.83 33.97 3dll s LYS 33 CO 0.19 -0.79 0.03 -0.65 -0.92 0.00 0.00 175.35 173.21 3dll s GLN 34 N 1.86 1.73 -0.17 1.68 -0.21 -1.24 -4.02 119.66 119.28 3dll s GLN 34 Ca 0.77 -1.96 -0.25 0.00 0.02 0.00 0.00 55.36 53.94 3dll s GLN 34 Cb -0.48 -1.13 0.06 0.00 1.00 0.00 0.00 33.01 32.46 3dll s GLN 34 CO 0.34 -0.12 0.65 0.50 -2.12 0.00 0.00 175.29 174.54 3dll s ARG 35 N -3.82 0.86 -0.77 2.91 3.52 -1.21 -1.80 118.95 118.64 3dll s ARG 35 Ca 0.35 0.65 0.03 0.00 -0.13 0.00 0.00 55.73 56.63 3dll s ARG 35 Cb 0.08 0.41 0.27 0.00 -1.56 0.00 0.00 34.95 34.16 3dll s ARG 35 CO 0.16 -0.17 1.01 0.94 -0.81 0.00 0.00 175.30 176.42 3dll n GLN 36 N 2.05 3.23 0.00 5.12 7.27 -1.26 -3.17 117.38 130.63 3dll n GLN 36 Ca -0.16 -4.66 0.00 0.00 0.07 0.00 0.00 57.00 52.25 3dll n GLN 36 Cb 0.56 -2.34 0.00 0.00 2.41 0.00 0.00 30.24 30.87 3dll n GLN 36 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54