#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x9s s VAL 3 N 0.00 4.38 0.34 3.15 1.01 -1.26 -1.40 120.40 126.61 2x9s s VAL 3 Ca 0.00 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 2x9s s VAL 3 Cb 0.00 -3.39 -0.00 0.00 0.00 0.00 0.00 36.38 32.99 2x9s s VAL 3 CO 0.00 -0.14 0.44 0.00 0.00 0.00 0.00 175.10 175.40 2x9s s ARG 4 N 1.53 1.87 -0.05 2.72 1.70 -1.20 -4.86 118.95 120.66 2x9s s ARG 4 Ca 0.02 -1.78 0.07 0.00 -0.47 0.00 0.00 55.73 53.57 2x9s s ARG 4 Cb -0.19 0.42 -0.24 0.00 -0.57 0.00 0.00 34.95 34.38 2x9s s ARG 4 CO 0.05 -0.76 0.65 0.00 -1.08 0.00 0.00 175.30 174.16 2x9s h ALA 5 N 2.13 0.66 -3.09 7.88 0.00 -1.91 0.32 119.26 125.24 2x9s h ALA 5 Ca -0.28 -1.41 -0.71 0.00 0.00 0.00 0.00 54.91 52.52 2x9s h ALA 5 Cb 1.24 0.49 -0.34 0.00 0.00 0.00 0.00 17.79 19.18 2x9s h ALA 5 CO 0.39 1.49 -0.36 0.45 0.00 0.00 0.00 179.25 181.22 2x9s s SER 6 N -6.36 5.40 -0.23 0.00 0.15 -1.26 -4.81 113.70 106.58 2x9s s SER 6 Ca -0.08 -2.62 -0.11 0.00 0.70 0.00 0.00 55.95 53.84 2x9s s SER 6 Cb 0.08 -1.89 -0.05 0.00 -1.71 0.00 0.00 66.02 62.45 2x9s s SER 6 CO 0.82 -0.44 0.16 -0.69 1.20 0.00 0.00 173.24 174.29 2x9s s VAL 7 N 0.28 5.37 0.32 4.45 1.01 -1.26 -5.08 120.40 125.48 2x9s s VAL 7 Ca 0.15 0.20 0.04 0.00 0.00 0.00 0.00 61.98 62.36 2x9s s VAL 7 Cb -0.20 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2x9s s VAL 7 CO -0.04 0.36 0.16 -0.54 0.00 0.00 0.00 175.10 175.05 2x9s s LYS 8 N 0.91 1.65 -0.07 2.72 1.02 -1.26 -5.09 119.74 119.63 2x9s s LYS 8 Ca 0.08 -1.95 -0.26 0.00 0.02 0.00 0.00 55.97 53.85 2x9s s LYS 8 Cb -0.13 -0.17 -0.03 0.00 -0.52 0.00 0.00 37.83 36.99 2x9s s LYS 8 CO 0.03 -0.46 0.84 1.03 -0.92 0.00 0.00 175.35 175.87 2x9s s ARG 9 N -3.78 4.45 -0.01 1.68 0.52 -1.26 -4.98 118.95 115.57 2x9s s ARG 9 Ca 0.34 1.12 -0.01 0.00 -0.52 0.00 0.00 55.73 56.67 2x9s s ARG 9 Cb 0.05 -3.48 -0.00 0.00 0.52 0.00 0.00 34.95 32.03 2x9s s ARG 9 CO 0.18 -0.07 -0.01 0.82 0.02 0.00 0.00 175.30 176.23 2x9s h ILE 10 N 4.88 0.00 -1.30 1.52 2.04 -1.91 -3.49 117.51 119.24 2x9s h ILE 10 Ca -0.38 -0.08 -0.48 0.00 1.00 0.00 0.00 64.86 64.93 2x9s h ILE 10 Cb 1.19 0.00 0.05 0.00 -0.74 0.00 0.00 36.82 37.32 2x9s h ILE 10 CO 0.78 0.00 -0.03 0.00 0.00 0.00 0.00 178.15 178.89 2x9s h ASP 12 N -0.06 0.78 0.79 0.00 2.03 -2.03 -2.73 116.42 115.19 2x9s h ASP 12 Ca -0.32 -0.03 0.00 0.00 -0.73 0.00 0.00 57.03 55.94 2x9s h ASP 12 Cb 1.28 -0.20 0.00 0.00 -0.83 0.00 0.00 39.33 39.59 2x9s h ASP 12 CO 0.41 0.58 0.00 0.29 -1.03 0.00 0.00 179.24 179.48 2x9s n LYS 13 N -4.60 0.11 -1.92 4.15 5.02 -1.26 -4.83 118.16 114.82 2x9s n LYS 13 Ca 0.06 0.28 -0.41 0.00 -2.02 0.00 0.00 58.31 56.21 2x9s n LYS 13 Cb 0.03 -1.68 -0.02 0.00 -0.02 0.00 0.00 35.03 33.34 2x9s n LYS 13 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2x9s s LYS 15 N -0.50 1.69 -0.58 0.00 2.20 0.37 -4.93 119.74 117.99 2x9s s LYS 15 Ca 0.60 -0.84 -0.16 0.00 -0.36 0.00 0.00 55.97 55.21 2x9s s LYS 15 Cb -0.44 -1.69 0.14 0.00 -1.51 0.00 0.00 37.83 34.33 2x9s s LYS 15 CO 0.46 0.46 0.57 0.08 -0.36 0.00 0.00 175.35 176.55 2x9s s VAL 16 N -0.59 5.19 0.40 4.02 1.01 -1.26 -0.04 120.40 129.13 2x9s s VAL 16 Ca 0.08 -1.53 -0.00 0.00 0.00 0.00 0.00 61.98 60.53 2x9s s VAL 16 Cb -0.09 -4.38 -0.02 0.00 0.00 0.00 0.00 36.38 31.89 2x9s s VAL 16 CO -0.00 -0.93 0.62 -0.63 0.00 0.00 0.00 175.10 174.16 2x9s s ILE 17 N 1.61 4.69 -0.36 2.22 -1.09 -1.02 -4.96 121.20 122.31 2x9s s ILE 17 Ca 0.06 -0.39 0.00 0.00 -2.23 0.00 0.00 60.65 58.10 2x9s s ILE 17 Cb -0.27 -3.73 0.14 0.00 -1.58 0.00 0.00 42.46 37.03 2x9s s ILE 17 CO 0.02 -0.52 0.23 -0.60 -1.23 0.00 0.00 174.94 172.84 2x9s s ARG 18 N -4.46 0.57 0.02 2.79 3.52 -1.26 -0.68 118.95 119.45 2x9s s ARG 18 Ca 0.44 -1.32 0.06 0.00 -0.13 0.00 0.00 55.73 54.78 2x9s s ARG 18 Cb -0.10 -1.25 -0.03 0.00 -1.56 0.00 0.00 34.95 32.01 2x9s s ARG 18 CO 0.38 -1.22 -0.18 -0.98 -0.81 0.00 0.00 175.30 172.49 2x9s s ARG 19 N 1.06 2.16 -1.44 5.12 1.70 -0.67 -4.70 118.95 122.17 2x9s s ARG 19 Ca 0.19 -0.92 -0.10 0.00 -0.47 0.00 0.00 55.73 54.43 2x9s s ARG 19 Cb -0.21 -2.22 0.03 0.00 -0.57 0.00 0.00 34.95 31.99 2x9s s ARG 19 CO -0.00 0.56 1.00 0.72 -1.08 0.00 0.00 175.30 176.49 2x9s n HIS 20 N 1.75 -2.52 0.00 5.89 8.25 -1.26 -1.95 115.22 125.38 2x9s n HIS 20 Ca -0.16 0.87 0.00 0.00 -0.26 0.00 0.00 57.72 58.17 2x9s n HIS 20 Cb 0.52 -4.55 0.00 0.00 1.12 0.00 0.00 29.99 27.08 2x9s n HIS 20 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2x9s n GLY 21 N -1.80 2.95 3.89 -1.41 0.00 -1.26 -5.00 105.19 102.56 2x9s n GLY 21 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2x9s n GLY 21 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x9s s ARG 22 N -0.02 3.59 -0.29 1.61 0.52 -0.82 -5.07 118.95 118.47 2x9s s ARG 22 Ca 0.00 -0.12 -0.22 0.00 -0.52 0.00 0.00 55.73 54.87 2x9s s ARG 22 Cb 0.00 -2.96 -0.01 0.00 0.52 0.00 0.00 34.95 32.50 2x9s s ARG 22 CO 0.00 0.55 0.70 0.08 0.02 0.00 0.00 175.30 176.65 2x9s s VAL 23 N -1.51 4.89 0.49 3.52 1.01 -1.26 -1.68 120.40 125.86 2x9s s VAL 23 Ca 0.36 1.09 0.05 0.00 0.00 0.00 0.00 61.98 63.48 2x9s s VAL 23 Cb -0.13 -4.04 -0.01 0.00 0.00 0.00 0.00 36.38 32.20 2x9s s VAL 23 CO 0.22 -0.13 0.21 -0.31 0.00 0.00 0.00 175.10 175.09 2x9s s TYR 24 N 2.72 2.06 -0.14 5.22 1.51 0.14 -1.56 117.35 127.30 2x9s s TYR 24 Ca 0.29 -0.78 -0.04 0.00 -1.01 0.00 0.00 57.07 55.53 2x9s s TYR 24 Cb -0.15 -1.85 0.06 0.00 -0.11 0.00 0.00 41.96 39.91 2x9s s TYR 24 CO 0.11 -0.03 0.10 0.08 -1.11 0.00 0.00 175.55 174.70 2x9s s VAL 25 N -2.74 -0.12 0.10 0.71 1.01 -0.27 -2.42 120.40 116.68 2x9s s VAL 25 Ca 0.29 -0.01 -0.04 0.00 0.00 0.00 0.00 61.98 62.22 2x9s s VAL 25 Cb 0.01 -0.48 -0.05 0.00 0.00 0.00 0.00 36.38 35.87 2x9s s VAL 25 CO 0.17 -0.16 0.32 -0.63 0.00 0.00 0.00 175.10 174.80 2x9s s ILE 26 N 2.17 5.24 0.10 2.22 1.09 0.94 -2.80 121.20 130.16 2x9s s ILE 26 Ca 0.03 -0.06 -0.26 0.00 -1.10 0.00 0.00 60.65 59.26 2x9s s ILE 26 Cb -0.15 -3.62 0.08 0.00 -1.06 0.00 0.00 42.46 37.71 2x9s s ILE 26 CO -0.08 0.11 0.87 0.00 -0.10 0.00 0.00 174.94 175.73 2x9s h GLU 28 N 2.00 -0.72 -6.56 0.00 4.81 -1.99 -3.42 114.58 108.69 2x9s h GLU 28 Ca -0.24 0.05 -0.52 0.00 -0.13 0.00 0.00 59.36 58.52 2x9s h GLU 28 Cb 1.25 0.16 -0.03 0.00 0.63 0.00 0.00 28.75 30.76 2x9s h GLU 28 CO 0.29 -0.48 0.26 0.54 -0.73 0.00 0.00 179.01 178.89 2x9s s ASN 29 N -3.30 7.46 0.11 1.04 2.20 -1.26 -5.00 114.94 116.18 2x9s s ASN 29 Ca -0.12 1.73 -0.28 0.00 -0.94 0.00 0.00 52.86 53.26 2x9s s ASN 29 Cb 0.02 -2.55 -0.09 0.00 -2.00 0.00 0.00 41.25 36.63 2x9s s ASN 29 CO 0.36 0.11 1.64 1.55 -2.94 0.00 0.00 177.10 177.81 2x9s h PRO 30 N 4.75 -0.48 -0.58 3.55 0.13 -2.01 -3.07 132.00 134.28 2x9s h PRO 30 Ca -0.45 0.03 0.17 0.00 -0.87 0.00 0.00 66.00 64.88 2x9s h PRO 30 Cb 1.21 0.11 -0.02 0.00 0.13 0.00 0.00 31.00 32.42 2x9s h PRO 30 CO 0.69 -0.32 1.11 1.63 -0.23 0.00 0.00 178.00 180.88 2x9s n LYS 31 N -5.38 0.02 0.00 0.86 5.02 -1.26 0.85 118.16 118.27 2x9s n LYS 31 Ca -0.07 0.98 0.13 0.00 -2.02 0.00 0.00 58.31 57.33 2x9s n LYS 31 Cb 0.29 -2.52 0.42 0.00 -0.02 0.00 0.00 35.03 33.21 2x9s n LYS 31 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2x9s n HIS 32 N -2.89 0.00 -1.77 2.13 8.25 -1.16 -4.77 115.22 115.01 2x9s n HIS 32 Ca 0.13 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.18 2x9s n HIS 32 Cb 1.29 -0.25 -0.01 0.00 1.12 0.00 0.00 29.99 32.13 2x9s n HIS 32 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2x9s n LYS 33 N -1.21 2.72 -3.84 -0.41 5.02 0.25 -4.86 118.16 115.83 2x9s n LYS 33 Ca 0.09 0.96 -0.12 0.00 -2.02 0.00 0.00 58.31 57.22 2x9s n LYS 33 Cb 0.32 -2.72 -0.10 0.00 -0.02 0.00 0.00 35.03 32.51 2x9s n LYS 33 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2x9s s GLN 34 N -1.45 0.45 -0.12 1.97 -0.21 -1.12 -3.73 119.66 115.44 2x9s s GLN 34 Ca 0.57 -0.18 -0.03 0.00 0.02 0.00 0.00 55.36 55.74 2x9s s GLN 34 Cb -0.48 0.19 0.05 0.00 1.00 0.00 0.00 33.01 33.77 2x9s s GLN 34 CO 0.58 -0.10 0.06 0.50 -2.12 0.00 0.00 175.29 174.20 2x9s s ARG 35 N -0.97 0.19 0.36 2.91 3.52 -0.50 -1.11 118.95 123.36 2x9s s ARG 35 Ca -0.11 0.03 -0.28 0.00 -0.13 0.00 0.00 55.73 55.24 2x9s s ARG 35 Cb -0.06 -1.35 -0.11 0.00 -1.56 0.00 0.00 34.95 31.87 2x9s s ARG 35 CO 0.02 -0.51 1.48 -1.14 -0.81 0.00 0.00 175.30 174.33 2x9s s GLN 36 N 2.08 4.14 0.00 5.12 0.74 -0.60 -3.25 119.66 127.89 2x9s s GLN 36 Ca 0.03 2.53 0.00 0.00 0.05 0.00 0.00 55.36 57.97 2x9s s GLN 36 Cb -0.14 -2.99 0.00 0.00 1.10 0.00 0.00 33.01 30.98 2x9s s GLN 36 CO -0.06 -0.50 0.00 0.41 -0.55 0.00 0.00 175.29 174.58