#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i6c h LEU 2 N 0.00 -0.11 -1.48 -5.58 -0.00 -1.93 -3.49 115.31 102.72 1i6c h LEU 2 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.83 1i6c h LEU 2 Cb 0.00 0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 40.68 1i6c h LEU 2 CO 0.00 0.04 -0.27 1.55 -0.00 0.00 0.00 178.44 179.76 1i6c h PRO 3 N -0.36 0.00 -5.77 0.17 0.13 -1.98 -3.44 132.00 120.75 1i6c h PRO 3 Ca -0.01 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.55 1i6c h PRO 3 Cb 0.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.22 1i6c h PRO 3 CO 0.02 0.27 1.55 -0.35 -0.23 0.00 0.00 178.00 179.25 1i6c n PRO 4 N -4.11 1.20 -2.11 1.56 -0.04 -1.26 -2.25 135.00 127.99 1i6c n PRO 4 Ca -0.02 0.23 -0.03 0.00 -0.04 0.00 0.00 63.50 63.64 1i6c n PRO 4 Cb 0.33 -2.90 0.00 0.00 -0.04 0.00 0.00 33.50 30.89 1i6c n PRO 4 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1i6c n GLY 5 N 6.16 -1.55 3.32 0.55 0.00 -1.26 -4.66 105.19 107.75 1i6c n GLY 5 Ca 0.39 0.43 -0.17 0.00 0.00 0.00 0.00 46.02 46.67 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 -1.52 1.51 -0.16 1.61 1.48 -0.95 -0.19 118.94 120.71 1i6c s TRP 6 Ca 0.09 -1.00 -0.19 0.00 -1.06 0.00 0.00 56.10 53.94 1i6c s TRP 6 Cb -0.03 -0.89 0.05 0.00 -1.16 0.00 0.00 33.47 31.45 1i6c s TRP 6 CO 0.36 -0.14 0.51 -2.00 -4.06 0.00 0.00 176.95 171.61 1i6c s GLU 7 N -3.92 0.64 -0.06 3.25 2.12 -0.64 -4.94 118.70 115.16 1i6c s GLU 7 Ca 0.30 0.59 -0.29 0.00 0.36 0.00 0.00 54.97 55.93 1i6c s GLU 7 Cb 0.06 0.31 -0.07 0.00 0.26 0.00 0.00 34.13 34.69 1i6c s GLU 7 CO 0.09 -0.10 2.04 0.21 -0.54 0.00 0.00 175.26 176.96 1i6c s LYS 8 N 0.01 3.78 -0.08 4.30 2.36 -1.26 -1.48 119.74 127.36 1i6c s LYS 8 Ca -0.02 2.38 0.03 0.00 -2.55 0.00 0.00 55.97 55.80 1i6c s LYS 8 Cb -0.03 -4.23 0.01 0.00 -1.05 0.00 0.00 37.83 32.53 1i6c s LYS 8 CO 0.02 -1.37 -0.15 1.03 1.55 0.00 0.00 175.35 176.43 1i6c s ARG 9 N 5.12 2.06 0.25 4.03 0.52 0.31 -5.00 118.95 126.25 1i6c s ARG 9 Ca 0.92 -0.53 -0.30 0.00 -0.52 0.00 0.00 55.73 55.30 1i6c s ARG 9 Cb -0.39 -1.66 -0.10 0.00 0.52 0.00 0.00 34.95 33.32 1i6c s ARG 9 CO 0.39 0.05 1.39 -1.64 0.02 0.00 0.00 175.30 175.50 1i6c s MET 10 N 0.64 4.31 -0.74 3.54 -1.94 -1.26 -0.12 119.30 123.73 1i6c s MET 10 Ca -0.14 2.24 -0.26 0.00 -1.71 0.00 0.00 55.69 55.82 1i6c s MET 10 Cb -0.16 -3.12 -0.03 0.00 2.01 0.00 0.00 34.83 33.53 1i6c s MET 10 CO 0.04 -0.34 1.88 -1.54 -0.01 0.00 0.00 175.02 175.05 1i6c s SER 11 N 0.19 5.25 0.00 3.03 1.04 -0.18 -4.89 113.70 118.15 1i6c s SER 11 Ca 0.57 -0.13 -0.03 0.00 0.48 0.00 0.00 55.95 56.84 1i6c s SER 11 Cb -0.40 -2.54 -0.15 0.00 0.10 0.00 0.00 66.02 63.02 1i6c s SER 11 CO 0.44 -2.51 2.44 -2.11 0.98 0.00 0.00 173.24 172.49 1i6c n ARG 12 N 9.05 1.27 0.00 4.02 1.85 -1.26 -3.88 116.66 127.71 1i6c n ARG 12 Ca 0.28 -0.56 0.00 0.00 -1.00 0.00 0.00 57.85 56.57 1i6c n ARG 12 Cb 0.50 -1.71 0.00 0.00 -1.05 0.00 0.00 32.46 30.19 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 2.46 0.00 -3.18 2.89 2.88 -1.26 -5.14 113.62 112.26 1i6c n SER 13 Ca 0.24 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.83 1i6c n SER 13 Cb 0.59 0.11 -0.02 0.00 -0.75 0.00 0.00 64.21 64.14 1i6c n SER 13 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1i6c s SER 14 N -1.96 -0.47 0.00 -3.46 0.01 -1.25 -5.13 113.70 101.43 1i6c s SER 14 Ca 0.00 0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.61 1i6c s SER 14 Cb 0.00 1.42 0.00 0.00 0.21 0.00 0.00 66.02 67.65 1i6c s SER 14 CO 0.00 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.17 1i6c n GLY 15 N 5.36 -1.27 3.05 3.44 0.00 -1.26 -5.09 105.19 109.41 1i6c n GLY 15 Ca -0.07 0.42 -0.12 0.00 0.00 0.00 0.00 46.02 46.25 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 0.00 0.50 0.20 1.61 3.00 -1.26 -5.04 118.95 117.96 1i6c s ARG 16 Ca 0.00 -0.76 -0.31 0.00 0.00 0.00 0.00 55.73 54.66 1i6c s ARG 16 Cb 0.00 -0.21 -0.11 0.00 0.00 0.00 0.00 34.95 34.63 1i6c s ARG 16 CO 0.00 0.03 1.60 0.54 0.00 0.00 0.00 175.30 177.47 1i6c s VAL 17 N -1.50 2.38 0.42 3.52 0.11 -1.26 -1.01 120.40 123.05 1i6c s VAL 17 Ca -0.10 0.28 0.05 0.00 -2.93 0.00 0.00 61.98 59.28 1i6c s VAL 17 Cb -0.09 -3.18 -0.06 0.00 -1.53 0.00 0.00 36.38 31.52 1i6c s VAL 17 CO -0.00 0.03 0.03 -0.72 -3.33 0.00 0.00 175.10 171.10 1i6c s TYR 18 N 0.86 2.21 -0.02 1.54 -0.85 0.84 -4.89 117.35 117.03 1i6c s TYR 18 Ca 0.69 -0.84 0.04 0.00 -0.52 0.00 0.00 57.07 56.44 1i6c s TYR 18 Cb -0.46 -1.60 -0.01 0.00 0.38 0.00 0.00 41.96 40.28 1i6c s TYR 18 CO 0.35 0.26 -0.13 0.71 -1.52 0.00 0.00 175.55 175.22 1i6c s TYR 19 N -2.90 1.23 -0.03 -3.49 1.51 -0.03 -0.53 117.35 113.11 1i6c s TYR 19 Ca 0.28 -0.27 0.03 0.00 -1.01 0.00 0.00 57.07 56.10 1i6c s TYR 19 Cb 0.07 -0.81 0.00 0.00 -0.11 0.00 0.00 41.96 41.11 1i6c s TYR 19 CO 0.14 -0.06 -0.12 0.12 -1.11 0.00 0.00 175.55 174.51 1i6c s PHE 20 N -0.14 1.26 -0.15 2.71 5.36 -0.55 -0.70 117.98 125.76 1i6c s PHE 20 Ca 0.02 -0.34 -0.16 0.00 -0.96 0.00 0.00 56.93 55.49 1i6c s PHE 20 Cb -0.07 -0.87 -0.04 0.00 -0.34 0.00 0.00 43.02 41.69 1i6c s PHE 20 CO 0.00 -0.13 0.37 1.21 -1.46 0.00 0.00 175.22 175.21 1i6c s ASN 21 N 0.15 6.52 -0.01 6.13 3.04 -0.71 -1.62 114.94 128.44 1i6c s ASN 21 Ca -0.04 0.61 -0.25 0.00 0.04 0.00 0.00 52.86 53.22 1i6c s ASN 21 Cb -0.10 -2.23 -0.20 0.00 -1.54 0.00 0.00 41.25 37.19 1i6c s ASN 21 CO 0.01 0.04 1.33 0.45 -3.04 0.00 0.00 177.10 175.88 1i6c h HIS 22 N 6.81 -0.01 0.00 0.43 3.86 -0.84 -2.38 115.15 123.02 1i6c h HIS 22 Ca -0.40 -0.00 -0.29 0.00 -1.16 0.00 0.00 60.37 58.52 1i6c h HIS 22 Cb 1.17 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 29.59 1i6c h HIS 22 CO 0.62 0.41 -2.16 0.44 0.86 0.00 0.00 177.93 178.10 1i6c n ILE 23 N -4.89 1.09 -0.04 2.45 -5.35 -1.26 -3.70 119.36 107.65 1i6c n ILE 23 Ca -0.08 -0.71 -0.11 0.00 -0.27 0.00 0.00 62.75 61.58 1i6c n ILE 23 Cb 0.22 -0.49 -0.04 0.00 -1.74 0.00 0.00 39.64 37.59 1i6c n ILE 23 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1i6c h THR 24 N 0.00 1.11 -3.29 7.28 2.02 -1.89 -3.50 112.91 114.64 1i6c h THR 24 Ca -0.43 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.43 1i6c h THR 24 Cb 1.97 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 69.37 1i6c h THR 24 CO 0.02 0.11 -0.00 -3.20 0.37 0.00 0.00 175.52 172.82 1i6c n ASN 25 N -4.89 -2.72 -3.60 4.18 5.15 -0.91 -5.11 115.26 107.36 1i6c n ASN 25 Ca -0.04 -0.00 -0.19 0.00 -0.60 0.00 0.00 54.58 53.75 1i6c n ASN 25 Cb 0.08 -1.54 -0.15 0.00 -0.53 0.00 0.00 39.78 37.65 1i6c n ASN 25 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1i6c s ALA 26 N -2.87 -0.12 -0.19 5.20 0.00 -1.11 -4.99 121.76 117.68 1i6c s ALA 26 Ca 0.00 0.34 -0.18 0.00 0.00 0.00 0.00 51.96 52.12 1i6c s ALA 26 Cb -0.00 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.06 1i6c s ALA 26 CO 0.09 -0.87 0.49 -1.54 0.00 0.00 0.00 175.76 173.93 1i6c s SER 27 N 2.29 6.56 0.00 0.00 1.04 -1.26 -1.74 113.70 120.58 1i6c s SER 27 Ca 0.04 0.67 0.00 0.00 0.48 0.00 0.00 55.95 57.14 1i6c s SER 27 Cb -0.14 -2.28 0.00 0.00 0.10 0.00 0.00 66.02 63.70 1i6c s SER 27 CO -0.08 -0.14 0.00 0.00 0.98 0.00 0.00 173.24 174.00 1i6c n GLN 28 N 4.57 1.61 -0.65 4.02 10.64 0.12 -4.96 117.38 132.73 1i6c n GLN 28 Ca -0.06 0.00 0.05 0.00 -1.83 0.00 0.00 57.00 55.16 1i6c n GLN 28 Cb 0.51 0.00 0.08 0.00 -0.86 0.00 0.00 30.24 29.97 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 -3.85 2.61 -0.00 -1.26 -0.85 117.44 114.09 1i6c n TRP 29 Ca 0.00 -0.68 -0.36 0.00 -0.00 0.00 0.00 57.50 56.46 1i6c n TRP 29 Cb 0.00 -0.14 -0.13 0.00 -0.00 0.00 0.00 31.31 31.04 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 -1.39 3.27 -0.33 5.87 2.12 -1.26 -4.80 118.70 122.18 1i6c s GLU 30 Ca 0.24 -0.71 -0.27 0.00 0.36 0.00 0.00 54.97 54.59 1i6c s GLU 30 Cb 0.24 -3.15 -0.06 0.00 0.26 0.00 0.00 34.13 31.43 1i6c s GLU 30 CO -0.05 -0.29 2.28 0.50 -0.54 0.00 0.00 175.26 177.17 1i6c s ARG 31 N 1.48 2.72 0.52 4.30 3.52 -1.26 -4.83 118.95 125.41 1i6c s ARG 31 Ca 0.04 1.76 0.29 0.00 -0.13 0.00 0.00 55.73 57.69 1i6c s ARG 31 Cb -0.15 -4.45 1.44 0.00 -1.56 0.00 0.00 34.95 30.22 1i6c s ARG 31 CO -0.01 -2.57 2.05 -1.00 -0.81 0.00 0.00 175.30 172.96 1i6c h PRO 32 N 16.81 0.00 0.00 5.12 0.13 -1.97 -3.45 132.00 148.64 1i6c h PRO 32 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1i6c h PRO 32 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1i6c h PRO 32 CO 1.04 0.12 0.00 -1.13 -0.23 0.00 0.00 178.00 177.80 1i6c n SER 33 N -3.51 0.00 0.00 1.44 3.41 -1.26 -4.84 113.62 108.86 1i6c n SER 33 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1i6c n SER 33 Cb 0.26 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 1i6c n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i6c n GLY 34 N -0.66 1.27 1.26 5.00 0.00 -1.26 -4.51 105.19 106.29 1i6c n GLY 34 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.35 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 2.81 0.00 -4.75 1.61 4.13 -1.26 -5.04 115.26 112.76 1i6c n ASN 35 Ca 0.00 0.00 -0.40 0.00 1.68 0.00 0.00 54.58 55.86 1i6c n ASN 35 Cb 0.00 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.19 1i6c n ASN 35 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1i6c s SER 36 N -2.42 7.34 0.00 6.41 0.15 -1.26 -5.04 113.70 118.88 1i6c s SER 36 Ca 0.00 2.18 0.00 0.00 0.70 0.00 0.00 55.95 58.83 1i6c s SER 36 Cb 0.00 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 1i6c s SER 36 CO 0.00 -0.10 0.15 -0.24 1.20 0.00 0.00 173.24 174.25 1i6c n SER 37 N 1.46 0.00 0.00 5.45 2.88 -1.26 -4.84 113.62 117.31 1i6c n SER 37 Ca -0.01 0.57 0.00 0.00 -1.33 0.00 0.00 58.87 58.10 1i6c n SER 37 Cb 0.45 -0.49 0.00 0.00 -0.75 0.00 0.00 64.21 63.42 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 -1.97 0.00 0.00 -3.46 7.64 -1.26 -4.98 113.62 109.59 1i6c n SER 38 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1i6c n SER 38 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1i6c n SER 38 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64