#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 -0.87 -0.25 3.14 -0.00 -1.26 -4.40 117.00 113.37 1i6c n LEU 2 Ca 0.00 1.60 0.05 0.00 -0.00 0.00 0.00 56.01 57.66 1i6c n LEU 2 Cb 0.00 -0.24 0.17 0.00 -0.00 0.00 0.00 43.42 43.35 1i6c n LEU 2 CO 0.00 -1.33 0.90 1.55 -0.00 0.00 0.00 177.39 178.51 1i6c h PRO 3 N 0.00 0.21 -5.53 1.47 0.13 -1.99 -3.38 132.00 122.91 1i6c h PRO 3 Ca 0.19 -0.01 -0.34 0.00 -0.87 0.00 0.00 66.00 64.96 1i6c h PRO 3 Cb 0.41 -0.05 0.01 0.00 0.13 0.00 0.00 31.00 31.50 1i6c h PRO 3 CO -0.86 0.14 1.23 -0.35 -0.23 0.00 0.00 178.00 177.93 1i6c n PRO 4 N -5.21 0.90 -1.62 1.56 -0.04 -1.26 -2.17 135.00 127.15 1i6c n PRO 4 Ca 0.14 -0.22 -0.01 0.00 -0.04 0.00 0.00 63.50 63.36 1i6c n PRO 4 Cb 0.46 -3.48 0.00 0.00 -0.04 0.00 0.00 33.50 30.44 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 6.22 0.78 3.78 0.55 0.00 -1.26 -4.56 105.19 110.70 1i6c n GLY 5 Ca 0.40 -0.24 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 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 2.69 -0.20 1.61 1.48 -0.92 -0.25 118.94 120.32 1i6c s TRP 6 Ca 0.03 -0.47 -0.22 0.00 -1.06 0.00 0.00 56.10 54.37 1i6c s TRP 6 Cb -0.00 -1.89 0.06 0.00 -1.16 0.00 0.00 33.47 30.48 1i6c s TRP 6 CO 0.04 0.16 0.61 -2.00 -4.06 0.00 0.00 176.95 171.71 1i6c s GLU 7 N -3.95 0.76 0.08 3.25 2.12 -0.75 -4.94 118.70 115.27 1i6c s GLU 7 Ca 0.42 0.74 -0.31 0.00 0.36 0.00 0.00 54.97 56.18 1i6c s GLU 7 Cb -0.01 0.37 -0.09 0.00 0.26 0.00 0.00 34.13 34.66 1i6c s GLU 7 CO 0.24 -0.12 1.78 -1.59 -0.54 0.00 0.00 175.26 175.03 1i6c s LYS 8 N 0.07 4.16 -0.07 4.30 0.00 -1.26 -1.11 119.74 125.83 1i6c s LYS 8 Ca -0.02 2.48 0.01 0.00 0.00 0.00 0.00 55.97 58.43 1i6c s LYS 8 Cb -0.04 -3.72 0.02 0.00 0.00 0.00 0.00 37.83 34.10 1i6c s LYS 8 CO 0.02 -0.82 -0.06 1.03 0.00 0.00 0.00 175.35 175.52 1i6c s ARG 9 N 3.08 1.14 0.29 1.78 0.52 -0.53 -4.97 118.95 120.26 1i6c s ARG 9 Ca 0.79 -0.17 -0.29 0.00 -0.52 0.00 0.00 55.73 55.54 1i6c s ARG 9 Cb -0.42 -1.16 -0.10 0.00 0.52 0.00 0.00 34.95 33.79 1i6c s ARG 9 CO 0.35 -0.14 1.27 -1.64 0.02 0.00 0.00 175.30 175.17 1i6c s MET 10 N 1.23 4.41 0.24 3.54 -1.94 -1.26 -0.46 119.30 125.05 1i6c s MET 10 Ca -0.05 2.11 -0.31 0.00 -1.71 0.00 0.00 55.69 55.72 1i6c s MET 10 Cb -0.14 -3.12 -0.13 0.00 2.01 0.00 0.00 34.83 33.45 1i6c s MET 10 CO -0.02 -0.13 1.45 0.45 -0.01 0.00 0.00 175.02 176.76 1i6c n SER 11 N 1.26 2.92 -2.22 3.03 2.88 -0.26 -4.88 113.62 116.35 1i6c n SER 11 Ca 0.01 1.14 -0.15 0.00 -1.33 0.00 0.00 58.87 58.54 1i6c n SER 11 Cb 0.42 -1.45 -0.14 0.00 -0.75 0.00 0.00 64.21 62.30 1i6c n SER 11 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1i6c n ARG 12 N 2.20 2.12 0.00 -1.46 1.85 -1.26 -4.42 116.66 115.69 1i6c n ARG 12 Ca 0.12 -1.11 0.00 0.00 -1.00 0.00 0.00 57.85 55.86 1i6c n ARG 12 Cb 0.32 -2.09 0.00 0.00 -1.05 0.00 0.00 32.46 29.64 1i6c n ARG 12 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1i6c n SER 13 N 2.70 0.00 -3.19 2.89 3.41 -1.26 -5.15 113.62 113.02 1i6c n SER 13 Ca 0.45 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 59.11 1i6c n SER 13 Cb 0.77 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.70 1i6c n SER 13 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1i6c s SER 14 N 2.00 -0.74 0.00 4.04 0.15 -1.26 -5.12 113.70 112.77 1i6c s SER 14 Ca 0.00 0.53 0.00 0.00 0.70 0.00 0.00 55.95 57.18 1i6c s SER 14 Cb 0.00 1.65 0.00 0.00 -1.71 0.00 0.00 66.02 65.96 1i6c s SER 14 CO 0.00 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 174.91 1i6c n GLY 15 N 5.40 -1.18 3.22 9.45 0.00 -1.26 -5.12 105.19 115.70 1i6c n GLY 15 Ca -0.06 0.48 -0.13 0.00 0.00 0.00 0.00 46.02 46.32 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 1.01 -0.10 1.61 3.00 -1.26 -5.07 118.95 118.14 1i6c s ARG 16 Ca 0.00 -1.45 -0.15 0.00 0.00 0.00 0.00 55.73 54.13 1i6c s ARG 16 Cb 0.00 -0.32 -0.05 0.00 0.00 0.00 0.00 34.95 34.58 1i6c s ARG 16 CO 0.00 -0.05 0.38 0.54 0.00 0.00 0.00 175.30 176.16 1i6c s VAL 17 N -3.58 5.20 -0.10 3.52 0.11 -1.26 -1.10 120.40 123.19 1i6c s VAL 17 Ca 0.18 0.74 0.00 0.00 -2.93 0.00 0.00 61.98 59.98 1i6c s VAL 17 Cb 0.05 -3.70 -0.02 0.00 -1.53 0.00 0.00 36.38 31.17 1i6c s VAL 17 CO 0.00 0.43 -0.09 -0.72 -3.33 0.00 0.00 175.10 171.39 1i6c s TYR 18 N 0.04 2.88 -0.04 1.54 -0.85 0.39 -4.74 117.35 116.57 1i6c s TYR 18 Ca 0.21 -0.23 -0.04 0.00 -0.52 0.00 0.00 57.07 56.49 1i6c s TYR 18 Cb -0.15 -1.77 -0.04 0.00 0.38 0.00 0.00 41.96 40.38 1i6c s TYR 18 CO 0.08 0.10 0.16 0.71 -1.52 0.00 0.00 175.55 175.09 1i6c s TYR 19 N -0.29 3.54 0.08 -3.49 1.51 -1.09 -1.46 117.35 116.15 1i6c s TYR 19 Ca 0.03 0.39 0.05 0.00 -1.01 0.00 0.00 57.07 56.53 1i6c s TYR 19 Cb -0.13 -1.85 -0.03 0.00 -0.11 0.00 0.00 41.96 39.84 1i6c s TYR 19 CO 0.03 0.66 -0.14 0.12 -1.11 0.00 0.00 175.55 175.11 1i6c s PHE 20 N -1.23 1.21 -0.11 2.71 5.36 -0.27 -1.43 117.98 124.22 1i6c s PHE 20 Ca 0.23 -0.49 0.02 0.00 -0.96 0.00 0.00 56.93 55.74 1i6c s PHE 20 Cb -0.12 -0.67 -0.01 0.00 -0.34 0.00 0.00 43.02 41.88 1i6c s PHE 20 CO 0.14 0.06 -0.19 1.21 -1.46 0.00 0.00 175.22 174.98 1i6c s ASN 21 N -1.89 3.51 -0.10 6.13 3.04 -0.99 -1.81 114.94 122.83 1i6c s ASN 21 Ca -0.00 -0.44 -0.28 0.00 0.04 0.00 0.00 52.86 52.18 1i6c s ASN 21 Cb -0.09 -1.43 -0.25 0.00 -1.54 0.00 0.00 41.25 37.95 1i6c s ASN 21 CO 0.02 0.18 0.91 0.45 -3.04 0.00 0.00 177.10 175.62 1i6c h HIS 22 N 6.61 0.03 -0.02 0.43 3.86 -0.90 -2.33 115.15 122.83 1i6c h HIS 22 Ca -0.24 -0.02 -0.14 0.00 -1.16 0.00 0.00 60.37 58.81 1i6c h HIS 22 Cb 1.22 -0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.70 1i6c h HIS 22 CO 0.48 0.88 -0.55 0.82 0.86 0.00 0.00 177.93 180.42 1i6c h ILE 23 N -0.82 1.42 -0.12 2.45 1.08 -1.80 -3.15 117.51 116.57 1i6c h ILE 23 Ca -0.01 -2.01 0.01 0.00 -0.39 0.00 0.00 64.86 62.46 1i6c h ILE 23 Cb 0.89 2.52 -0.01 0.00 -3.07 0.00 0.00 36.82 37.15 1i6c h ILE 23 CO 0.01 0.58 0.06 0.74 -0.69 0.00 0.00 178.15 178.85 1i6c h THR 24 N -0.09 1.00 -3.47 -0.27 2.02 -1.88 -3.50 112.91 106.73 1i6c h THR 24 Ca -0.06 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.07 1i6c h THR 24 Cb 1.25 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 68.51 1i6c h THR 24 CO 0.11 0.02 -0.01 -3.20 0.37 0.00 0.00 175.52 172.81 1i6c n ASN 25 N -5.03 -3.16 -3.61 4.18 5.15 -0.89 -5.09 115.26 106.81 1i6c n ASN 25 Ca -0.05 0.00 -0.15 0.00 -0.60 0.00 0.00 54.58 53.79 1i6c n ASN 25 Cb 0.04 -1.86 -0.13 0.00 -0.53 0.00 0.00 39.78 37.30 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 -2.76 -0.48 -0.03 5.20 0.00 -1.14 -4.99 121.76 117.56 1i6c s ALA 26 Ca 0.01 0.74 -0.08 0.00 0.00 0.00 0.00 51.96 52.62 1i6c s ALA 26 Cb -0.00 -1.10 -0.05 0.00 0.00 0.00 0.00 23.12 21.97 1i6c s ALA 26 CO 0.15 -0.79 0.26 -1.54 0.00 0.00 0.00 175.76 173.84 1i6c s SER 27 N 2.39 6.53 0.00 0.00 1.04 -1.26 -2.33 113.70 120.07 1i6c s SER 27 Ca 0.03 0.62 0.00 0.00 0.48 0.00 0.00 55.95 57.08 1i6c s SER 27 Cb -0.13 -2.12 0.00 0.00 0.10 0.00 0.00 66.02 63.87 1i6c s SER 27 CO -0.09 0.31 0.00 0.00 0.98 0.00 0.00 173.24 174.44 1i6c n GLN 28 N 1.52 0.00 0.00 4.02 -0.00 -0.52 -4.94 117.38 117.47 1i6c n GLN 28 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.86 1i6c n GLN 28 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.77 1i6c n GLN 28 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 1i6c n TRP 29 N 0.00 0.00 -4.76 2.61 7.02 -1.26 -2.66 117.44 118.39 1i6c n TRP 29 Ca 0.00 0.00 -0.25 0.00 -1.02 0.00 0.00 57.50 56.23 1i6c n TRP 29 Cb 0.00 0.00 -0.15 0.00 -2.42 0.00 0.00 31.31 28.74 1i6c n TRP 29 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 1i6c s GLU 30 N -0.49 1.42 0.36 -0.99 2.12 -1.26 -4.59 118.70 115.27 1i6c s GLU 30 Ca 0.00 -0.78 -0.26 0.00 0.36 0.00 0.00 54.97 54.29 1i6c s GLU 30 Cb 0.00 -1.44 -0.12 0.00 0.26 0.00 0.00 34.13 32.82 1i6c s GLU 30 CO 0.00 0.38 0.96 -2.13 -0.54 0.00 0.00 175.26 173.93 1i6c n ARG 31 N 2.27 1.27 0.00 4.30 0.00 -1.26 -4.75 116.66 118.49 1i6c n ARG 31 Ca -0.16 0.45 0.00 0.00 -0.00 0.00 0.00 57.85 58.14 1i6c n ARG 31 Cb 0.54 -1.89 0.00 0.00 0.00 0.00 0.00 32.46 31.10 1i6c n ARG 31 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1i6c n PRO 32 N 0.47 0.00 0.00 -0.14 -0.04 -1.26 -4.88 135.00 129.16 1i6c n PRO 32 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1i6c n PRO 32 Cb 0.36 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.32 1i6c n PRO 32 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1i6c n SER 33 N -0.99 0.00 0.00 3.54 7.64 -1.26 -4.83 113.62 117.72 1i6c n SER 33 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1i6c n SER 33 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1i6c n SER 33 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1i6c n GLY 34 N 0.00 2.24 0.95 0.23 0.00 -1.26 -4.16 105.19 103.19 1i6c n GLY 34 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 4.10 0.00 -4.72 1.61 5.03 -1.26 -5.11 115.26 114.91 1i6c n ASN 35 Ca 0.00 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.03 1i6c n ASN 35 Cb 0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 39.78 38.72 1i6c n ASN 35 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 1i6c s SER 36 N -3.91 7.42 -0.04 6.41 0.01 -1.26 -5.01 113.70 117.32 1i6c s SER 36 Ca 0.00 1.73 -0.03 0.00 1.31 0.00 0.00 55.95 58.96 1i6c s SER 36 Cb 0.00 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.63 1i6c s SER 36 CO 0.00 -0.18 0.21 -1.28 0.41 0.00 0.00 173.24 172.41 1i6c h SER 37 N 6.23 -0.10 0.00 2.44 0.87 -1.97 -3.45 113.55 117.56 1i6c h SER 37 Ca -0.42 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.14 1i6c h SER 37 Cb 1.22 0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 63.20 1i6c h SER 37 CO 0.74 0.16 -0.20 -1.20 -0.53 0.00 0.00 176.83 175.79 1i6c n SER 38 N -3.62 1.12 -0.68 6.23 7.64 -1.26 -5.09 113.62 117.96 1i6c n SER 38 Ca -0.02 0.15 0.13 0.00 1.01 0.00 0.00 58.87 60.15 1i6c n SER 38 Cb 0.05 -0.36 0.34 0.00 -1.01 0.00 0.00 64.21 63.24 1i6c n SER 38 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64