#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i6c n LEU 2 N 0.00 0.04 -0.31 -0.35 -0.00 -1.26 -4.76 117.00 110.36 1i6c n LEU 2 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 56.01 56.16 1i6c n LEU 2 Cb 0.00 0.00 0.39 0.00 -0.00 0.00 0.00 43.42 43.81 1i6c n LEU 2 CO 0.00 -0.24 1.21 1.55 -0.00 0.00 0.00 177.39 179.91 1i6c h PRO 3 N 0.00 0.63 -5.59 1.47 0.13 -1.97 -3.34 132.00 123.33 1i6c h PRO 3 Ca 0.00 -0.04 -0.24 0.00 -0.87 0.00 0.00 66.00 64.85 1i6c h PRO 3 Cb 0.03 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.00 1i6c h PRO 3 CO 0.00 0.42 0.71 -1.25 -0.23 0.00 0.00 178.00 177.65 1i6c s PRO 4 N -5.69 2.10 -0.06 1.56 0.04 -1.26 -2.07 135.00 129.62 1i6c s PRO 4 Ca -0.10 0.46 -0.00 0.00 0.04 0.00 0.00 61.00 61.39 1i6c s PRO 4 Cb 0.24 -4.77 -0.00 0.00 0.04 0.00 0.00 34.50 30.00 1i6c s PRO 4 CO 0.79 -3.69 0.05 0.41 0.04 0.00 0.00 177.00 174.61 1i6c n GLY 5 N 6.52 0.73 3.85 0.56 0.00 -1.26 -4.54 105.19 111.04 1i6c n GLY 5 Ca 0.39 -0.27 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 1i6c n GLY 5 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1i6c s TRP 6 N -3.02 2.87 -0.26 1.61 1.48 -0.88 -0.85 118.94 119.88 1i6c s TRP 6 Ca 0.02 -0.33 -0.25 0.00 -1.06 0.00 0.00 56.10 54.48 1i6c s TRP 6 Cb -0.00 -1.83 0.10 0.00 -1.16 0.00 0.00 33.47 30.57 1i6c s TRP 6 CO 0.04 0.16 0.88 -2.00 -4.06 0.00 0.00 176.95 171.97 1i6c s GLU 7 N -4.00 0.67 0.09 3.25 -6.30 -0.48 -4.96 118.70 106.97 1i6c s GLU 7 Ca 0.42 0.75 -0.31 0.00 -2.50 0.00 0.00 54.97 53.33 1i6c s GLU 7 Cb -0.05 0.33 -0.09 0.00 0.00 0.00 0.00 34.13 34.31 1i6c s GLU 7 CO 0.26 -0.09 1.79 -1.59 0.02 0.00 0.00 175.26 175.65 1i6c s LYS 8 N 0.20 4.15 0.21 4.30 0.00 -1.26 -2.69 119.74 124.66 1i6c s LYS 8 Ca 0.01 2.51 0.10 0.00 0.00 0.00 0.00 55.97 58.60 1i6c s LYS 8 Cb -0.05 -3.66 -0.04 0.00 0.00 0.00 0.00 37.83 34.07 1i6c s LYS 8 CO -0.02 -0.82 -0.14 1.03 0.00 0.00 0.00 175.35 175.39 1i6c s ARG 9 N 2.92 1.89 -0.13 1.78 1.81 0.12 -4.99 118.95 122.36 1i6c s ARG 9 Ca 0.80 -1.43 -0.29 0.00 -1.72 0.00 0.00 55.73 53.08 1i6c s ARG 9 Cb -0.44 -2.02 -0.01 0.00 -0.45 0.00 0.00 34.95 32.03 1i6c s ARG 9 CO 0.36 0.40 1.11 -1.64 -0.68 0.00 0.00 175.30 174.84 1i6c s MET 10 N -2.99 4.34 -0.81 3.54 -1.94 -1.26 -0.39 119.30 119.79 1i6c s MET 10 Ca 0.25 1.50 -0.25 0.00 -1.71 0.00 0.00 55.69 55.48 1i6c s MET 10 Cb -0.08 -3.60 -0.03 0.00 2.01 0.00 0.00 34.83 33.13 1i6c s MET 10 CO 0.14 -0.48 1.89 0.45 -0.01 0.00 0.00 175.02 177.01 1i6c s SER 11 N 1.35 5.25 -0.74 3.03 0.15 0.43 -4.85 113.70 118.33 1i6c s SER 11 Ca 0.50 -0.36 -0.20 0.00 0.70 0.00 0.00 55.95 56.59 1i6c s SER 11 Cb -0.20 -2.55 -0.16 0.00 -1.71 0.00 0.00 66.02 61.41 1i6c s SER 11 CO 0.16 -2.56 1.92 -2.11 1.20 0.00 0.00 173.24 171.84 1i6c n ARG 12 N 8.98 1.47 0.04 5.44 1.85 -1.26 -3.65 116.66 129.53 1i6c n ARG 12 Ca 0.33 -1.74 0.00 0.00 -1.00 0.00 0.00 57.85 55.43 1i6c n ARG 12 Cb 0.49 -2.83 0.00 0.00 -1.05 0.00 0.00 32.46 29.06 1i6c n ARG 12 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1i6c n SER 13 N 7.17 -0.66 -2.68 2.89 2.88 -1.26 -5.03 113.62 116.92 1i6c n SER 13 Ca 0.48 0.16 -0.08 0.00 -1.33 0.00 0.00 58.87 58.10 1i6c n SER 13 Cb 0.37 0.94 0.04 0.00 -0.75 0.00 0.00 64.21 64.80 1i6c n SER 13 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1i6c n SER 14 N -2.69 1.28 -2.45 -3.46 2.88 -1.25 -5.04 113.62 102.90 1i6c n SER 14 Ca 0.00 -2.61 -0.14 0.00 -1.33 0.00 0.00 58.87 54.79 1i6c n SER 14 Cb 0.00 -0.45 0.05 0.00 -0.75 0.00 0.00 64.21 63.07 1i6c n SER 14 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1i6c n GLY 15 N -0.16 0.00 3.71 0.46 0.00 -1.24 -5.06 105.19 102.91 1i6c n GLY 15 Ca 0.08 -0.10 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 1i6c n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i6c s ARG 16 N -5.60 2.27 0.50 1.61 3.00 -1.24 -5.03 118.95 114.46 1i6c s ARG 16 Ca 0.28 -1.67 -0.07 0.00 0.00 0.00 0.00 55.73 54.28 1i6c s ARG 16 Cb -0.12 -2.07 -0.04 0.00 0.00 0.00 0.00 34.95 32.72 1i6c s ARG 16 CO 0.45 0.05 0.83 0.54 0.00 0.00 0.00 175.30 177.17 1i6c s VAL 17 N -2.49 4.87 0.16 3.52 0.11 -1.26 -0.43 120.40 124.87 1i6c s VAL 17 Ca 0.38 0.35 -0.01 0.00 -2.93 0.00 0.00 61.98 59.77 1i6c s VAL 17 Cb -0.00 -3.86 -0.04 0.00 -1.53 0.00 0.00 36.38 30.95 1i6c s VAL 17 CO 0.22 -0.88 0.08 -0.72 -3.33 0.00 0.00 175.10 170.47 1i6c s TYR 18 N -2.79 0.99 0.01 1.54 1.13 0.47 -4.61 117.35 114.08 1i6c s TYR 18 Ca 0.49 -1.27 0.05 0.00 -1.41 0.00 0.00 57.07 54.93 1i6c s TYR 18 Cb -0.10 -0.52 -0.03 0.00 -1.10 0.00 0.00 41.96 40.20 1i6c s TYR 18 CO 0.46 -0.54 -0.15 0.71 -2.51 0.00 0.00 175.55 173.51 1i6c s TYR 19 N -4.06 2.65 -0.14 -3.49 1.51 0.17 -0.70 117.35 113.28 1i6c s TYR 19 Ca 0.29 -0.20 -0.07 0.00 -1.01 0.00 0.00 57.07 56.09 1i6c s TYR 19 Cb 0.07 -1.54 0.06 0.00 -0.11 0.00 0.00 41.96 40.44 1i6c s TYR 19 CO 0.05 0.24 0.32 0.12 -1.11 0.00 0.00 175.55 175.18 1i6c s PHE 20 N -0.87 -0.48 -0.06 2.71 5.36 -1.09 -1.26 117.98 122.29 1i6c s PHE 20 Ca 0.14 1.05 -0.28 0.00 -0.96 0.00 0.00 56.93 56.88 1i6c s PHE 20 Cb -0.11 0.14 -0.03 0.00 -0.34 0.00 0.00 43.02 42.69 1i6c s PHE 20 CO 0.04 -0.31 0.91 1.21 -1.46 0.00 0.00 175.22 175.61 1i6c s ASN 21 N 1.57 7.21 0.02 6.13 3.04 -1.09 -1.38 114.94 130.44 1i6c s ASN 21 Ca -0.07 1.47 -0.18 0.00 0.04 0.00 0.00 52.86 54.12 1i6c s ASN 21 Cb -0.10 -2.52 -0.29 0.00 -1.54 0.00 0.00 41.25 36.80 1i6c s ASN 21 CO -0.10 -0.29 1.05 0.45 -3.04 0.00 0.00 177.10 175.17 1i6c h HIS 22 N 6.93 0.82 0.02 0.43 3.86 -1.27 -2.52 115.15 123.43 1i6c h HIS 22 Ca -0.37 -0.52 -0.00 0.00 -1.16 0.00 0.00 60.37 58.32 1i6c h HIS 22 Cb 1.19 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 29.59 1i6c h HIS 22 CO 0.69 1.37 -0.01 0.82 0.86 0.00 0.00 177.93 181.65 1i6c h ILE 23 N 0.04 1.43 0.14 2.45 2.04 -1.80 -3.31 117.51 118.51 1i6c h ILE 23 Ca -0.15 -1.79 -0.01 0.00 1.00 0.00 0.00 64.86 63.91 1i6c h ILE 23 Cb 1.73 2.57 0.00 0.00 -0.74 0.00 0.00 36.82 40.38 1i6c h ILE 23 CO 0.19 0.43 -0.07 0.74 0.00 0.00 0.00 178.15 179.45 1i6c h THR 24 N -0.86 0.93 -2.32 -0.27 2.02 -1.87 -3.50 112.91 107.05 1i6c h THR 24 Ca -0.00 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.90 1i6c h THR 24 Cb 0.74 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1i6c h THR 24 CO 0.01 0.07 0.00 0.59 0.37 0.00 0.00 175.52 176.55 1i6c n ASN 25 N -5.11 -1.54 -3.84 4.18 3.02 -0.96 -5.11 115.26 105.89 1i6c n ASN 25 Ca -0.09 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.16 1i6c n ASN 25 Cb 0.15 -0.76 -0.15 0.00 -0.61 0.00 0.00 39.78 38.41 1i6c n ASN 25 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1i6c s ALA 26 N -2.77 1.96 0.10 5.41 0.00 -1.16 -4.97 121.76 120.32 1i6c s ALA 26 Ca 0.00 -1.84 -0.21 0.00 0.00 0.00 0.00 51.96 49.91 1i6c s ALA 26 Cb 0.00 -1.68 -0.07 0.00 0.00 0.00 0.00 23.12 21.37 1i6c s ALA 26 CO 0.00 -1.59 0.62 -1.54 0.00 0.00 0.00 175.76 173.25 1i6c s SER 27 N 1.39 7.15 0.00 0.00 1.04 -1.26 -2.67 113.70 119.35 1i6c s SER 27 Ca 0.08 1.36 0.00 0.00 0.48 0.00 0.00 55.95 57.87 1i6c s SER 27 Cb -0.18 -2.39 0.00 0.00 0.10 0.00 0.00 66.02 63.55 1i6c s SER 27 CO -0.17 0.26 0.00 0.00 0.98 0.00 0.00 173.24 174.31 1i6c n GLN 28 N 1.68 0.00 0.00 4.02 10.64 -0.39 -5.01 117.38 128.32 1i6c n GLN 28 Ca -0.09 0.00 0.04 0.00 -1.83 0.00 0.00 57.00 55.12 1i6c n GLN 28 Cb 0.50 0.00 -0.04 0.00 -0.86 0.00 0.00 30.24 29.84 1i6c n GLN 28 CO 0.00 0.00 0.00 1.87 -1.83 0.00 0.00 177.06 177.10 1i6c n TRP 29 N 0.00 0.00 -4.30 2.61 -0.00 -1.26 -0.66 117.44 113.82 1i6c n TRP 29 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 57.50 57.32 1i6c n TRP 29 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 31.31 31.21 1i6c n TRP 29 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 177.69 175.69 1i6c s GLU 30 N -1.74 1.21 0.90 5.87 2.56 -1.26 -4.58 118.70 121.66 1i6c s GLU 30 Ca 0.03 -1.45 -0.15 0.00 0.00 0.00 0.00 54.97 53.40 1i6c s GLU 30 Cb 0.06 -1.03 -0.04 0.00 2.00 0.00 0.00 34.13 35.13 1i6c s GLU 30 CO 0.33 0.18 0.07 -2.13 -0.56 0.00 0.00 175.26 173.14 1i6c n ARG 31 N -0.03 -0.09 -0.02 4.30 0.63 -1.26 -4.78 116.66 115.42 1i6c n ARG 31 Ca -0.11 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 56.83 1i6c n ARG 31 Cb 0.59 -1.57 0.00 0.00 0.45 0.00 0.00 32.46 31.93 1i6c n ARG 31 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1i6c n PRO 32 N -0.21 0.40 0.00 -0.14 -0.04 -1.26 -4.91 135.00 128.84 1i6c n PRO 32 Ca 0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.51 1i6c n PRO 32 Cb 0.53 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.69 1i6c n PRO 32 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1i6c n SER 33 N 0.90 0.00 0.00 3.54 2.88 -1.26 -4.89 113.62 114.79 1i6c n SER 33 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1i6c n SER 33 Cb 0.20 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.66 1i6c n SER 33 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1i6c n GLY 34 N 0.00 2.28 0.00 0.46 0.00 -1.26 -4.21 105.19 102.46 1i6c n GLY 34 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1i6c n GLY 34 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1i6c n ASN 35 N 4.42 0.00 0.00 1.61 3.02 -1.26 -5.15 115.26 117.90 1i6c n ASN 35 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1i6c n ASN 35 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1i6c n ASN 35 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1i6c n SER 36 N 0.00 0.00 0.00 6.41 3.41 -1.26 -5.08 113.62 117.10 1i6c n SER 36 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1i6c n SER 36 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1i6c n SER 36 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1i6c n SER 37 N 0.00 2.95 0.16 4.04 2.88 -1.26 -4.70 113.62 117.69 1i6c n SER 37 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1i6c n SER 37 Cb 0.00 0.38 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 1i6c n SER 37 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1i6c n SER 38 N -1.24 -1.50 0.00 -3.46 7.64 -1.26 -5.21 113.62 108.60 1i6c n SER 38 Ca 0.00 0.58 0.00 0.00 1.01 0.00 0.00 58.87 60.46 1i6c n SER 38 Cb 0.21 1.55 0.00 0.00 -1.01 0.00 0.00 64.21 64.96 1i6c n SER 38 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64