#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 -0.37 0.42 -0.13 0.00 -1.26 -4.90 107.32 101.07 2i9n s GLY 2 Ca 0.00 -0.45 -0.25 0.00 0.00 0.00 0.00 44.72 44.02 2i9n s GLY 2 CO 0.00 3.98 1.19 0.58 0.00 0.00 0.00 173.10 178.85 2i9n n LYS 3 N 8.98 1.72 -3.13 2.90 0.00 -1.26 -4.96 118.16 122.42 2i9n n LYS 3 Ca 0.37 0.61 -0.14 0.00 -0.00 0.00 0.00 58.31 59.15 2i9n n LYS 3 Cb 0.51 -2.27 -0.03 0.00 -0.00 0.00 0.00 35.03 33.24 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 -0.31 0.38 -3.60 5.58 4.27 0.21 -4.89 117.44 119.09 2i9n n TRP 4 Ca 0.08 -1.10 -0.27 0.00 -3.89 0.00 0.00 57.50 52.32 2i9n n TRP 4 Cb 0.39 -0.15 -0.16 0.00 -1.36 0.00 0.00 31.31 30.03 2i9n n TRP 4 CO 0.00 0.00 0.00 0.99 -2.29 0.00 0.00 177.69 176.39 2i9n s THR 5 N -1.76 -0.04 -0.21 -1.67 2.01 -1.24 0.40 115.64 113.13 2i9n s THR 5 Ca 0.01 -0.36 -0.13 0.00 0.31 0.00 0.00 61.69 61.52 2i9n s THR 5 Cb -0.00 -0.72 -0.19 0.00 0.01 0.00 0.00 72.50 71.60 2i9n s THR 5 CO 0.01 -0.40 0.06 0.00 -0.69 0.00 0.00 174.62 173.60 2i9n n TYR 6 N 5.25 0.72 -3.25 4.92 9.36 -1.26 -4.66 117.16 128.24 2i9n n TYR 6 Ca -0.07 0.24 -0.25 0.00 3.32 0.00 0.00 57.90 61.14 2i9n n TYR 6 Cb 0.47 -1.08 -0.07 0.00 -0.63 0.00 0.00 39.34 38.03 2i9n n TYR 6 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 2i9n n ASN 7 N -4.01 2.40 -4.12 2.98 4.13 -1.26 -4.90 115.26 110.48 2i9n n ASN 7 Ca -0.39 -3.19 -0.31 0.00 1.68 0.00 0.00 54.58 52.37 2i9n n ASN 7 Cb 0.86 -0.64 -0.03 0.00 -1.54 0.00 0.00 39.78 38.42 2i9n n ASN 7 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2i9n n GLY 8 N 0.81 -0.30 3.17 7.41 0.00 -1.26 -4.94 105.19 110.07 2i9n n GLY 8 Ca 0.27 0.14 -0.11 0.00 0.00 0.00 0.00 46.02 46.33 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 -3.73 0.11 -1.06 -0.61 -5.25 -1.26 -5.08 121.20 104.31 2i9n s ILE 9 Ca 0.31 -1.94 -0.04 0.00 -0.99 0.00 0.00 60.65 58.00 2i9n s ILE 9 Cb -0.17 -2.17 0.30 0.00 2.95 0.00 0.00 42.46 43.37 2i9n s ILE 9 CO 0.92 -0.34 1.42 0.41 -1.79 0.00 0.00 174.94 175.56 2i9n n THR 10 N -0.15 5.14 -1.93 8.37 -1.04 -1.26 -3.70 114.28 119.71 2i9n n THR 10 Ca -0.03 -5.87 -0.42 0.00 -2.04 0.00 0.00 64.05 55.69 2i9n n THR 10 Cb 0.64 -2.11 -0.03 0.00 -1.82 0.00 0.00 70.33 67.01 2i9n n THR 10 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2i9n s TYR 11 N -2.68 3.00 -0.09 -1.42 1.51 0.16 -4.77 117.35 113.06 2i9n s TYR 11 Ca 0.31 0.79 0.08 0.00 -1.01 0.00 0.00 57.07 57.24 2i9n s TYR 11 Cb 0.04 -3.92 -0.11 0.00 -0.11 0.00 0.00 41.96 37.86 2i9n s TYR 11 CO 0.09 -3.20 0.04 -0.85 -1.11 0.00 0.00 175.55 170.52 2i9n n GLU 12 N 3.10 2.45 -0.06 -0.62 0.28 -1.26 0.64 120.64 125.16 2i9n n GLU 12 Ca 0.10 -0.01 -0.04 0.00 -0.16 0.00 0.00 57.16 57.06 2i9n n GLU 12 Cb 0.39 -1.23 0.04 0.00 1.43 0.00 0.00 31.44 32.07 2i9n n GLU 12 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2i9n n GLY 13 N 2.43 -2.84 0.00 -1.84 0.00 -1.26 -4.77 105.19 96.91 2i9n n GLY 13 Ca -0.14 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.66 6.36 3.27 -0.02 0.00 -1.26 -4.91 105.19 107.97 2i9n n GLY 14 Ca 0.02 -1.99 -0.37 0.00 0.00 0.00 0.00 46.02 43.68 2i9n n GLY 14 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2i9n s GLY 15 N -0.14 1.82 0.34 -0.02 0.00 -1.26 -5.08 107.32 102.97 2i9n s GLY 15 Ca 0.00 -1.69 0.05 0.00 0.00 0.00 0.00 44.72 43.09 2i9n s GLY 15 CO 0.00 0.74 0.02 -0.32 0.00 0.00 0.00 173.10 173.53 2i9n s GLY 16 N 1.40 2.15 -0.06 0.20 0.00 -1.26 -5.09 107.32 104.67 2i9n s GLY 16 Ca -0.01 -2.10 0.05 0.00 0.00 0.00 0.00 44.72 42.66 2i9n s GLY 16 CO 0.02 -1.91 -0.23 -0.56 0.00 0.00 0.00 173.10 170.43 2i9n s SER 17 N -3.54 3.26 -1.29 1.64 0.01 -1.26 -4.71 113.70 107.81 2i9n s SER 17 Ca 0.35 -0.46 -0.12 0.00 1.31 0.00 0.00 55.95 57.03 2i9n s SER 17 Cb 0.08 -0.88 0.00 0.00 0.21 0.00 0.00 66.02 65.43 2i9n s SER 17 CO 0.16 0.25 0.57 0.00 0.41 0.00 0.00 173.24 174.63 2i9n n ALA 18 N 2.89 -2.29 -2.15 1.44 0.00 -1.26 0.17 120.51 119.31 2i9n n ALA 18 Ca -0.17 -0.31 -0.14 0.00 0.00 0.00 0.00 53.44 52.82 2i9n n ALA 18 Cb 0.52 -2.58 -0.02 0.00 0.00 0.00 0.00 19.45 17.37 2i9n n ALA 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2i9n n ALA 19 N -4.42 -0.60 -3.02 0.00 0.00 -1.26 -1.69 120.51 109.51 2i9n n ALA 19 Ca -0.21 0.14 -0.20 0.00 0.00 0.00 0.00 53.44 53.18 2i9n n ALA 19 Cb 0.64 -1.55 -0.04 0.00 0.00 0.00 0.00 19.45 18.50 2i9n n ALA 19 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2i9n n GLU 20 N -2.58 -1.33 0.00 0.00 0.28 0.44 -4.75 120.64 112.71 2i9n n GLU 20 Ca -0.15 0.06 0.00 0.00 -0.16 0.00 0.00 57.16 56.91 2i9n n GLU 20 Cb 0.57 -3.20 0.00 0.00 1.43 0.00 0.00 31.44 30.24 2i9n n GLU 20 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2i9n n ALA 21 N -2.54 0.00 -0.33 -1.84 0.00 -0.68 -4.11 120.51 111.00 2i9n n ALA 21 Ca 0.05 -0.04 0.21 0.00 0.00 0.00 0.00 53.44 53.67 2i9n n ALA 21 Cb 0.32 0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.20 2i9n n ALA 21 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 2i9n h TYR 22 N 0.00 0.85 -0.93 0.00 -0.00 -1.86 0.16 116.97 115.19 2i9n h TYR 22 Ca 0.00 0.04 0.17 0.00 -0.00 0.00 0.00 58.73 58.94 2i9n h TYR 22 Cb 0.00 -0.21 -0.17 0.00 -0.00 0.00 0.00 36.73 36.35 2i9n h TYR 22 CO 0.00 -0.14 -0.31 0.00 -0.00 0.00 0.00 178.16 177.71 2i9n h ALA 23 N 1.82 0.37 -0.88 0.10 0.00 -1.86 1.58 119.26 120.38 2i9n h ALA 23 Ca 0.69 0.31 0.24 0.00 0.00 0.00 0.00 54.91 56.15 2i9n h ALA 23 Cb 1.51 0.84 -0.14 0.00 0.00 0.00 0.00 17.79 20.00 2i9n h ALA 23 CO -0.59 -0.51 0.24 0.87 0.00 0.00 0.00 179.25 179.25 2i9n h LYS 24 N -0.02 0.20 -0.20 0.00 1.57 -0.82 0.72 116.57 118.02 2i9n h LYS 24 Ca 0.39 -0.01 -0.19 0.00 -1.87 0.00 0.00 60.65 58.97 2i9n h LYS 24 Cb 0.64 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.90 2i9n h LYS 24 CO -0.95 0.13 -0.63 0.00 -0.57 0.00 0.00 179.45 177.43 2i9n h ARG 25 N 0.21 0.71 -0.38 3.15 2.47 0.20 -3.19 114.38 117.55 2i9n h ARG 25 Ca 0.56 -0.50 0.08 0.00 -1.26 0.00 0.00 59.98 58.86 2i9n h ARG 25 Cb 1.13 0.08 -0.08 0.00 -1.65 0.00 0.00 29.97 29.44 2i9n h ARG 25 CO -0.66 1.12 -0.21 0.82 0.56 0.00 0.00 179.97 181.60 2i9n h ILE 26 N 0.53 0.40 -0.40 2.04 1.08 0.43 0.54 117.51 122.12 2i9n h ILE 26 Ca -0.01 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.54 2i9n h ILE 26 Cb 1.23 0.40 -0.09 0.00 -3.07 0.00 0.00 36.82 35.29 2i9n h ILE 26 CO 0.13 0.00 -0.22 0.00 -0.69 0.00 0.00 178.15 177.37 2i9n h ALA 27 N 1.08 0.05 0.17 1.87 0.00 -1.08 0.88 119.26 122.23 2i9n h ALA 27 Ca 0.19 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.24 2i9n h ALA 27 Cb 0.44 0.52 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 2i9n h ALA 27 CO -0.47 -0.59 -0.45 0.93 0.00 0.00 0.00 179.25 178.67 2i9n h GLU 28 N -0.15 -0.67 -0.54 0.00 5.08 -1.08 -1.48 114.58 115.75 2i9n h GLU 28 Ca 0.19 0.05 0.06 0.00 -1.00 0.00 0.00 59.36 58.66 2i9n h GLU 28 Cb 0.45 0.15 -0.09 0.00 0.50 0.00 0.00 28.75 29.76 2i9n h GLU 28 CO -0.49 -0.45 -0.55 0.00 -1.00 0.00 0.00 179.01 176.52 2i9n h ALA 29 N -0.75 -0.72 -0.99 3.43 0.00 -0.30 -0.15 119.26 119.78 2i9n h ALA 29 Ca -0.02 0.03 0.14 0.00 0.00 0.00 0.00 54.91 55.06 2i9n h ALA 29 Cb 0.67 1.18 -0.15 0.00 0.00 0.00 0.00 17.79 19.50 2i9n h ALA 29 CO -0.21 -1.02 -0.43 -1.33 0.00 0.00 0.00 179.25 176.27 2i9n n MET 30 N -5.28 -0.27 -1.39 0.00 2.81 0.24 -4.51 117.12 108.72 2i9n n MET 30 Ca -0.02 1.51 -0.46 0.00 -1.81 0.00 0.00 57.70 56.92 2i9n n MET 30 Cb 0.31 -2.24 -0.02 0.00 -0.71 0.00 0.00 33.22 30.56 2i9n n MET 30 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2i9n n ALA 31 N -3.43 -2.69 -2.22 3.04 0.00 -0.07 -4.74 120.51 110.40 2i9n n ALA 31 Ca 0.08 0.34 -0.40 0.00 0.00 0.00 0.00 53.44 53.47 2i9n n ALA 31 Cb 0.37 -1.61 -0.03 0.00 0.00 0.00 0.00 19.45 18.18 2i9n n ALA 31 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2i9n s LYS 32 N -1.06 2.95 0.00 0.00 1.02 -1.26 -5.00 119.74 116.39 2i9n s LYS 32 Ca 0.62 0.47 0.00 0.00 0.02 0.00 0.00 55.97 57.08 2i9n s LYS 32 Cb -0.83 -4.27 0.00 0.00 -0.52 0.00 0.00 37.83 32.21 2i9n s LYS 32 CO 0.58 -2.36 0.00 0.41 -0.92 0.00 0.00 175.35 173.06