#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i9n s GLY 2 N 0.00 -0.45 0.71 -0.13 0.00 -1.26 -5.15 107.32 101.04 2i9n s GLY 2 Ca 0.00 0.42 -0.16 0.00 0.00 0.00 0.00 44.72 44.98 2i9n s GLY 2 CO 0.00 0.12 0.79 0.58 0.00 0.00 0.00 173.10 174.59 2i9n n LYS 3 N 0.01 0.43 -0.00 2.90 0.00 -1.26 -4.92 118.16 115.33 2i9n n LYS 3 Ca -0.17 0.20 0.04 0.00 -0.00 0.00 0.00 58.31 58.37 2i9n n LYS 3 Cb 0.63 -2.05 -0.05 0.00 -0.00 0.00 0.00 35.03 33.55 2i9n n LYS 3 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.40 174.73 2i9n n TRP 4 N -2.42 0.00 -3.29 5.58 4.27 -1.26 -4.95 117.44 115.37 2i9n n TRP 4 Ca 0.12 0.00 -0.15 0.00 -3.89 0.00 0.00 57.50 53.57 2i9n n TRP 4 Cb 0.49 -0.02 0.08 0.00 -1.36 0.00 0.00 31.31 30.50 2i9n n TRP 4 CO 0.00 0.00 0.00 2.41 -2.29 0.00 0.00 177.69 177.81 2i9n n THR 5 N -1.26 -7.36 -2.86 -1.67 -1.04 -1.23 -4.98 114.28 93.88 2i9n n THR 5 Ca 0.01 -0.90 -0.32 0.00 -2.04 0.00 0.00 64.05 60.80 2i9n n THR 5 Cb 0.14 -5.67 -0.06 0.00 -1.82 0.00 0.00 70.33 62.93 2i9n n THR 5 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 2i9n s TYR 6 N -3.36 3.38 -0.94 -1.42 5.04 0.28 -3.57 117.35 116.75 2i9n s TYR 6 Ca 0.22 1.37 0.00 0.00 -2.44 0.00 0.00 57.07 56.22 2i9n s TYR 6 Cb -0.03 -2.68 0.00 0.00 0.35 0.00 0.00 41.96 39.61 2i9n s TYR 6 CO 0.71 -0.09 0.00 0.09 -1.34 0.00 0.00 175.55 174.92 2i9n n ASN 7 N -0.81 -3.02 -2.05 4.32 3.02 -1.26 0.12 115.26 115.58 2i9n n ASN 7 Ca 0.05 0.25 -0.13 0.00 -0.03 0.00 0.00 54.58 54.72 2i9n n ASN 7 Cb 0.54 -2.74 0.03 0.00 -0.61 0.00 0.00 39.78 37.00 2i9n n ASN 7 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2i9n n GLY 8 N -0.50 0.04 3.19 7.41 0.00 -1.23 -5.02 105.19 109.07 2i9n n GLY 8 Ca -0.11 -0.20 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 2i9n n GLY 8 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2i9n s ILE 9 N -3.04 0.01 -0.24 -0.61 -5.25 0.33 -5.09 121.20 107.32 2i9n s ILE 9 Ca 0.25 -0.06 -0.28 0.00 -0.99 0.00 0.00 60.65 59.57 2i9n s ILE 9 Cb -0.11 -0.44 0.01 0.00 2.95 0.00 0.00 42.46 44.87 2i9n s ILE 9 CO 0.31 -0.03 0.99 -0.89 -1.79 0.00 0.00 174.94 173.53 2i9n s THR 10 N -0.02 4.71 0.49 8.37 2.01 -1.26 -0.56 115.64 129.38 2i9n s THR 10 Ca -0.02 1.90 -0.05 0.00 0.31 0.00 0.00 61.69 63.84 2i9n s THR 10 Cb -0.03 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.19 2i9n s THR 10 CO 0.01 -0.17 0.78 -0.31 -0.69 0.00 0.00 174.62 174.24 2i9n s TYR 11 N 3.14 3.52 -0.27 4.92 1.51 -1.26 -4.95 117.35 123.96 2i9n s TYR 11 Ca 0.42 0.76 -0.15 0.00 -1.01 0.00 0.00 57.07 57.09 2i9n s TYR 11 Cb -0.15 -2.33 -0.13 0.00 -0.11 0.00 0.00 41.96 39.24 2i9n s TYR 11 CO 0.07 -0.32 -0.25 -1.91 -1.11 0.00 0.00 175.55 172.03 2i9n n GLU 12 N -2.27 0.59 0.00 -0.62 4.07 -1.26 -4.28 120.64 116.87 2i9n n GLU 12 Ca 0.01 0.32 0.00 0.00 -0.06 0.00 0.00 57.16 57.43 2i9n n GLU 12 Cb 0.55 -1.54 0.00 0.00 -0.06 0.00 0.00 31.44 30.39 2i9n n GLU 12 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2i9n n GLY 13 N 1.30 -1.89 0.00 8.31 0.00 -1.26 -4.88 105.19 106.77 2i9n n GLY 13 Ca -0.50 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2i9n n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i9n n GLY 14 N -1.30 -0.07 0.83 -0.02 0.00 -1.26 -5.12 105.19 98.25 2i9n n GLY 14 Ca 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.45 2i9n n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i9n n GLY 15 N -1.40 -1.03 3.95 -0.02 0.00 -1.26 -5.14 105.19 100.28 2i9n n GLY 15 Ca 0.00 0.26 -0.24 0.00 0.00 0.00 0.00 46.02 46.05 2i9n n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2i9n s GLY 16 N -1.56 1.62 0.12 -0.02 0.00 -1.26 -5.01 107.32 101.20 2i9n s GLY 16 Ca 0.00 -0.99 -0.26 0.00 0.00 0.00 0.00 44.72 43.47 2i9n s GLY 16 CO 0.00 -0.77 0.91 -0.45 0.00 0.00 0.00 173.10 172.79 2i9n s SER 17 N -4.28 -0.25 0.21 1.64 0.15 -1.24 -4.97 113.70 104.96 2i9n s SER 17 Ca 0.51 -0.28 -0.19 0.00 0.70 0.00 0.00 55.95 56.69 2i9n s SER 17 Cb -0.10 0.48 0.18 0.00 -1.71 0.00 0.00 66.02 64.87 2i9n s SER 17 CO 0.40 -0.85 1.56 0.00 1.20 0.00 0.00 173.24 175.55 2i9n h ALA 18 N 2.00 0.04 0.01 5.45 0.00 -1.99 1.15 119.26 125.93 2i9n h ALA 18 Ca -0.24 0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.94 2i9n h ALA 18 Cb 1.24 0.97 -0.05 0.00 0.00 0.00 0.00 17.79 19.95 2i9n h ALA 18 CO 0.27 -0.67 -0.31 0.00 0.00 0.00 0.00 179.25 178.54 2i9n h ALA 19 N 1.19 -0.46 -0.74 0.00 0.00 -2.01 -1.40 119.26 115.85 2i9n h ALA 19 Ca 0.30 -0.02 -0.56 0.00 0.00 0.00 0.00 54.91 54.63 2i9n h ALA 19 Cb 0.57 0.55 -0.22 0.00 0.00 0.00 0.00 17.79 18.70 2i9n h ALA 19 CO -0.89 -0.83 0.67 0.39 0.00 0.00 0.00 179.25 178.59 2i9n n GLU 20 N -5.41 2.40 0.02 0.00 -0.58 0.11 -3.27 120.64 113.91 2i9n n GLU 20 Ca -0.05 -2.64 0.00 0.00 -0.42 0.00 0.00 57.16 54.05 2i9n n GLU 20 Cb 0.32 -2.07 0.00 0.00 -0.57 0.00 0.00 31.44 29.12 2i9n n GLU 20 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2i9n n ALA 21 N -0.00 3.00 -0.05 0.62 0.00 0.36 -3.64 120.51 120.79 2i9n n ALA 21 Ca 0.49 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.72 2i9n n ALA 21 Cb 0.51 0.28 -0.13 0.00 0.00 0.00 0.00 19.45 20.11 2i9n n ALA 21 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2i9n n TYR 22 N -2.99 0.80 -0.11 0.00 0.18 -1.06 -4.32 117.16 109.67 2i9n n TYR 22 Ca 0.00 0.18 -0.05 0.00 1.88 0.00 0.00 57.90 59.91 2i9n n TYR 22 Cb 0.24 -1.10 0.01 0.00 -0.38 0.00 0.00 39.34 38.10 2i9n n TYR 22 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2i9n h ALA 23 N -0.03 0.23 -0.94 -3.48 0.00 -1.75 0.29 119.26 113.59 2i9n h ALA 23 Ca -0.48 0.15 0.22 0.00 0.00 0.00 0.00 54.91 54.80 2i9n h ALA 23 Cb 1.93 0.30 -0.17 0.00 0.00 0.00 0.00 17.79 19.84 2i9n h ALA 23 CO -0.01 -0.46 -0.09 -0.22 0.00 0.00 0.00 179.25 178.47 2i9n h LYS 24 N -0.01 0.02 -0.34 0.00 3.64 -1.77 0.91 116.57 119.02 2i9n h LYS 24 Ca 0.18 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.48 2i9n h LYS 24 Cb 0.29 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 2i9n h LYS 24 CO -0.39 0.01 -0.12 0.00 -2.27 0.00 0.00 179.45 176.68 2i9n h ARG 25 N 0.02 0.68 -0.38 1.90 2.47 -1.23 -2.99 114.38 114.84 2i9n h ARG 25 Ca 0.51 -0.28 0.06 0.00 -1.26 0.00 0.00 59.98 59.01 2i9n h ARG 25 Cb 0.92 -0.03 -0.08 0.00 -1.65 0.00 0.00 29.97 29.13 2i9n h ARG 25 CO -0.91 0.86 -0.50 0.82 0.56 0.00 0.00 179.97 180.80 2i9n h ILE 26 N 0.46 0.05 -0.46 2.04 1.08 0.26 0.18 117.51 121.12 2i9n h ILE 26 Ca 0.08 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.64 2i9n h ILE 26 Cb 0.64 0.05 -0.10 0.00 -3.07 0.00 0.00 36.82 34.34 2i9n h ILE 26 CO 0.04 0.00 -0.33 0.00 -0.69 0.00 0.00 178.15 177.17 2i9n h ALA 27 N 0.15 -0.13 -0.15 1.87 0.00 -1.01 0.51 119.26 120.49 2i9n h ALA 27 Ca 0.10 0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.16 2i9n h ALA 27 Cb 0.60 0.73 -0.06 0.00 0.00 0.00 0.00 17.79 19.06 2i9n h ALA 27 CO -0.57 -0.71 -0.47 0.93 0.00 0.00 0.00 179.25 178.43 2i9n h GLU 28 N -0.22 -0.46 -0.28 0.00 5.08 -0.87 0.29 114.58 118.12 2i9n h GLU 28 Ca 0.19 0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.62 2i9n h GLU 28 Cb 0.54 0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.84 2i9n h GLU 28 CO -0.58 -0.31 -0.34 0.00 -1.00 0.00 0.00 179.01 176.78 2i9n h ALA 29 N -0.42 -0.57 -0.99 3.43 0.00 0.23 -1.17 119.26 119.77 2i9n h ALA 29 Ca 0.03 0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.08 2i9n h ALA 29 Cb 0.58 0.98 -0.14 0.00 0.00 0.00 0.00 17.79 19.21 2i9n h ALA 29 CO -0.40 -0.74 -0.46 -1.33 0.00 0.00 0.00 179.25 176.33 2i9n n MET 30 N -4.32 -0.30 -2.32 0.00 2.81 0.08 -3.76 117.12 109.30 2i9n n MET 30 Ca -0.02 1.51 -0.42 0.00 -1.81 0.00 0.00 57.70 56.96 2i9n n MET 30 Cb 0.20 -2.24 -0.02 0.00 -0.71 0.00 0.00 33.22 30.45 2i9n n MET 30 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2i9n s ALA 31 N -5.78 2.92 -0.15 3.04 0.00 0.05 -4.98 121.76 116.86 2i9n s ALA 31 Ca -0.13 -0.31 -0.00 0.00 0.00 0.00 0.00 51.96 51.51 2i9n s ALA 31 Cb 0.17 -4.01 -0.01 0.00 0.00 0.00 0.00 23.12 19.26 2i9n s ALA 31 CO 0.67 -2.65 -0.13 0.21 0.00 0.00 0.00 175.76 173.86 2i9n s LYS 32 N 5.27 3.34 0.00 0.00 2.20 -1.25 -4.79 119.74 124.51 2i9n s LYS 32 Ca 0.60 -0.70 0.00 0.00 -0.36 0.00 0.00 55.97 55.52 2i9n s LYS 32 Cb -0.13 -2.67 0.00 0.00 -1.51 0.00 0.00 37.83 33.51 2i9n s LYS 32 CO 0.30 0.11 0.00 0.41 -0.36 0.00 0.00 175.35 175.81