#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1by6 s VAL 45 N 0.00 0.74 -0.11 0.00 1.01 -1.26 -4.90 120.40 115.88 1by6 s VAL 45 Ca 0.00 -2.89 0.12 0.00 0.00 0.00 0.00 61.98 59.21 1by6 s VAL 45 Cb 0.00 -1.52 0.26 0.00 0.00 0.00 0.00 36.38 35.12 1by6 s VAL 45 CO 0.00 -1.19 1.17 0.47 0.00 0.00 0.00 175.10 175.55 1by6 n ASP 46 N 2.73 -0.27 -3.57 3.32 9.92 -1.26 -5.01 116.55 122.41 1by6 n ASP 46 Ca 0.28 -2.05 -0.44 0.00 -0.53 0.00 0.00 54.79 52.05 1by6 n ASP 46 Cb 0.46 0.13 -0.09 0.00 -0.64 0.00 0.00 41.12 40.98 1by6 n ASP 46 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1by6 n GLU 47 N -0.29 0.73 0.00 -1.24 4.07 -1.26 -4.60 120.64 118.05 1by6 n GLU 47 Ca -0.13 -1.41 0.00 0.00 -0.06 0.00 0.00 57.16 55.56 1by6 n GLU 47 Cb 0.86 -2.71 0.00 0.00 -0.06 0.00 0.00 31.44 29.53 1by6 n GLU 47 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1by6 n LYS 48 N 7.52 0.00 -0.54 5.31 4.81 -1.26 -5.03 118.16 128.97 1by6 n LYS 48 Ca 0.48 0.00 -0.17 0.00 -0.87 0.00 0.00 58.31 57.76 1by6 n LYS 48 Cb 0.41 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.45 1by6 n LYS 48 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1by6 n LEU 49 N 0.00 3.54 0.00 3.14 4.32 -1.26 -3.40 117.00 123.34 1by6 n LEU 49 Ca 0.00 -2.36 0.00 0.00 -0.02 0.00 0.00 56.01 53.63 1by6 n LEU 49 Cb 0.00 -0.93 0.00 0.00 -1.62 0.00 0.00 43.42 40.87 1by6 n LEU 49 CO 0.00 0.07 -0.06 -1.14 -1.22 0.00 0.00 177.39 175.04 1by6 n ARG 50 N 4.51 0.00 0.21 3.23 3.00 -1.26 -4.79 116.66 121.56 1by6 n ARG 50 Ca 0.32 0.00 0.13 0.00 -0.00 0.00 0.00 57.85 58.30 1by6 n ARG 50 Cb 0.10 -0.20 0.68 0.00 0.00 0.00 0.00 32.46 33.04 1by6 n ARG 50 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 1by6 h ASP 51 N 0.00 0.00 -0.15 6.15 5.19 -1.91 -3.16 116.42 122.54 1by6 h ASP 51 Ca 0.00 0.00 0.02 0.00 -0.62 0.00 0.00 57.03 56.43 1by6 h ASP 51 Cb 0.11 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.60 1by6 h ASP 51 CO 0.00 0.00 -0.17 0.25 -3.12 0.00 0.00 179.24 176.20 1by6 h LEU 52 N 0.00 -0.57 -1.50 1.55 5.85 -1.87 0.51 115.31 119.29 1by6 h LEU 52 Ca 0.00 0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.85 1by6 h LEU 52 Cb 0.21 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1by6 h LEU 52 CO 0.00 -0.11 0.57 0.22 -0.34 0.00 0.00 178.44 178.78 1by6 h TYR 53 N -0.10 0.00 -0.02 1.25 3.20 -1.93 0.87 116.97 120.24 1by6 h TYR 53 Ca 0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1by6 h TYR 53 Cb 0.17 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.44 1by6 h TYR 53 CO -0.69 0.00 0.00 0.43 -1.64 0.00 0.00 178.16 176.26 1by6 n SER 54 N -3.01 0.14 0.00 -2.11 7.64 0.18 -4.41 113.62 112.05 1by6 n SER 54 Ca 0.03 -1.62 0.00 0.00 1.01 0.00 0.00 58.87 58.29 1by6 n SER 54 Cb 0.66 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.85 1by6 n SER 54 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1by6 n LYS 55 N -0.61 0.00 0.00 1.43 2.85 0.29 -5.11 118.16 117.02 1by6 n LYS 55 Ca 0.10 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.36 1by6 n LYS 55 Cb 0.07 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.45 1by6 n LYS 55 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1by6 n SER 56 N 0.00 0.00 0.22 -5.58 7.64 -0.66 -4.88 113.62 110.35 1by6 n SER 56 Ca 0.00 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.01 1by6 n SER 56 Cb 0.00 0.05 0.48 0.00 -1.01 0.00 0.00 64.21 63.73 1by6 n SER 56 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1by6 h THR 57 N 0.00 0.06 -1.00 0.44 1.03 -1.88 -2.44 112.91 109.12 1by6 h THR 57 Ca 0.00 0.00 0.26 0.00 -0.01 0.00 0.00 66.41 66.66 1by6 h THR 57 Cb 0.00 0.35 -0.19 0.00 -1.07 0.00 0.00 68.15 67.24 1by6 h THR 57 CO 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 175.52 175.48 1by6 h ALA 58 N 0.80 1.07 0.00 0.00 0.00 -1.92 -3.43 119.26 115.78 1by6 h ALA 58 Ca 0.10 0.36 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1by6 h ALA 58 Cb 1.50 0.64 0.00 0.00 0.00 0.00 0.00 17.79 19.93 1by6 h ALA 58 CO -0.00 -0.54 0.00 0.00 0.00 0.00 0.00 179.25 178.71 1by6 n ALA 59 N -3.25 0.00 -3.57 0.00 0.00 -0.92 -5.04 120.51 107.72 1by6 n ALA 59 Ca 0.22 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.49 1by6 n ALA 59 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.17 1by6 n ALA 59 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1by6 n MET 60 N 0.00 -1.47 -3.69 0.00 1.56 -1.25 -1.33 117.12 110.95 1by6 n MET 60 Ca 0.00 0.97 -0.27 0.00 -0.27 0.00 0.00 57.70 58.13 1by6 n MET 60 Cb 0.00 -3.35 0.01 0.00 2.15 0.00 0.00 33.22 32.03 1by6 n MET 60 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 1by6 n SER 61 N -2.37 -5.15 -3.20 6.12 2.88 -1.26 0.06 113.62 110.71 1by6 n SER 61 Ca -0.22 -0.72 -0.18 0.00 -1.33 0.00 0.00 58.87 56.42 1by6 n SER 61 Cb 0.64 -1.85 -0.03 0.00 -0.75 0.00 0.00 64.21 62.22 1by6 n SER 61 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1by6 n THR 62 N -1.98 0.00 -3.70 2.46 5.66 -1.16 -4.83 114.28 110.73 1by6 n THR 62 Ca -0.25 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.39 1by6 n THR 62 Cb 0.68 -0.21 -0.09 0.00 -1.55 0.00 0.00 70.33 69.17 1by6 n THR 62 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 1by6 s TYR 63 N -2.37 3.56 -0.18 1.09 6.14 0.11 -4.88 117.35 120.83 1by6 s TYR 63 Ca 0.35 -2.85 -0.16 0.00 0.64 0.00 0.00 57.07 55.05 1by6 s TYR 63 Cb -0.20 -3.19 -0.06 0.00 0.42 0.00 0.00 41.96 38.93 1by6 s TYR 63 CO 0.42 -0.79 -0.29 2.41 0.64 0.00 0.00 175.55 177.94 1by6 n THR 64 N 3.02 1.48 -2.76 4.34 -1.04 -1.26 -4.63 114.28 113.43 1by6 n THR 64 Ca 0.13 0.13 -0.01 0.00 -2.04 0.00 0.00 64.05 62.26 1by6 n THR 64 Cb 0.37 -2.33 0.09 0.00 -1.82 0.00 0.00 70.33 66.64 1by6 n THR 64 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1by6 n GLY 65 N 1.49 1.91 3.69 3.41 0.00 -1.26 -5.00 105.19 109.44 1by6 n GLY 65 Ca -0.15 -0.63 -0.26 0.00 0.00 0.00 0.00 46.02 44.98 1by6 n GLY 65 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1by6 n ILE 66 N -1.06 -5.27 -1.62 -0.61 5.41 -1.26 -4.79 119.36 110.16 1by6 n ILE 66 Ca -0.05 -0.78 -0.50 0.00 1.00 0.00 0.00 62.75 62.42 1by6 n ILE 66 Cb 0.84 -4.09 -0.05 0.00 -0.71 0.00 0.00 39.64 35.63 1by6 n ILE 66 CO 0.00 0.00 0.00 2.22 0.00 0.00 0.00 176.55 178.77 1by6 n PHE 67 N -4.16 1.80 -3.68 1.39 1.16 -1.26 -4.95 117.46 107.77 1by6 n PHE 67 Ca -0.19 0.50 -0.25 0.00 -1.87 0.00 0.00 57.45 55.64 1by6 n PHE 67 Cb 0.64 -2.41 -0.17 0.00 -1.61 0.00 0.00 39.48 35.92 1by6 n PHE 67 CO 0.00 0.00 0.00 0.95 -1.87 0.00 0.00 176.76 175.84 1by6 s THR 68 N 0.71 0.12 0.36 1.97 -4.23 -1.26 -5.03 115.64 108.28 1by6 s THR 68 Ca 0.83 -0.10 0.00 0.00 -1.18 0.00 0.00 61.69 61.24 1by6 s THR 68 Cb -0.86 -0.59 0.00 0.00 1.34 0.00 0.00 72.50 72.39 1by6 s THR 68 CO 0.44 -0.09 0.00 -0.67 -0.54 0.00 0.00 174.62 173.76 1by6 n ASP 69 N 5.21 -6.25 0.00 3.99 2.03 -1.26 -4.49 116.55 115.78 1by6 n ASP 69 Ca -0.07 0.77 0.00 0.00 0.52 0.00 0.00 54.79 56.01 1by6 n ASP 69 Cb 0.49 -3.84 0.00 0.00 -0.72 0.00 0.00 41.12 37.05 1by6 n ASP 69 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1by6 n GLN 70 N -3.69 0.00 -0.37 -0.67 -0.06 -1.26 -4.16 117.38 107.17 1by6 n GLN 70 Ca -0.03 0.00 -0.07 0.00 -2.00 0.00 0.00 57.00 54.90 1by6 n GLN 70 Cb 0.63 0.00 0.05 0.00 -4.06 0.00 0.00 30.24 26.85 1by6 n GLN 70 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 1by6 n VAL 71 N 0.00 1.67 -2.61 1.69 0.31 -1.26 -3.99 118.33 114.14 1by6 n VAL 71 Ca 0.00 -0.57 -0.07 0.00 -0.01 0.00 0.00 64.34 63.68 1by6 n VAL 71 Cb 0.00 -0.89 0.04 0.00 -0.91 0.00 0.00 33.84 32.08 1by6 n VAL 71 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1by6 n LEU 72 N 0.10 2.49 0.00 7.52 4.32 -1.26 -4.90 117.00 125.27 1by6 n LEU 72 Ca 0.17 -3.55 0.00 0.00 -0.02 0.00 0.00 56.01 52.61 1by6 n LEU 72 Cb 0.81 0.25 0.00 0.00 -1.62 0.00 0.00 43.42 42.85 1by6 n LEU 72 CO 0.17 1.36 0.00 -0.24 -1.22 0.00 0.00 177.39 177.46 1by6 n SER 73 N -0.60 0.00 -0.04 -1.43 2.88 -1.26 -5.04 113.62 108.14 1by6 n SER 73 Ca 0.17 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.67 1by6 n SER 73 Cb 0.84 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.26 1by6 n SER 73 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1by6 n VAL 74 N 0.00 0.45 -0.37 2.46 0.31 -1.26 -4.16 118.33 115.76 1by6 n VAL 74 Ca 0.00 -0.22 0.03 0.00 -0.01 0.00 0.00 64.34 64.14 1by6 n VAL 74 Cb 0.00 -0.81 0.10 0.00 -0.91 0.00 0.00 33.84 32.23 1by6 n VAL 74 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1by6 n LEU 75 N -2.50 -0.46 -0.11 7.52 -0.00 -1.26 -2.79 117.00 117.39 1by6 n LEU 75 Ca -0.12 1.72 -0.21 0.00 -0.00 0.00 0.00 56.01 57.40 1by6 n LEU 75 Cb 0.68 -0.48 -0.10 0.00 -0.00 0.00 0.00 43.42 43.53 1by6 n LEU 75 CO 0.11 -1.61 -0.71 1.17 -0.00 0.00 0.00 177.39 176.34 1by6 n LYS 76 N -5.57 0.56 -2.21 1.96 3.00 -1.26 -5.02 118.16 109.62 1by6 n LYS 76 Ca 0.14 0.49 0.00 0.00 -0.00 0.00 0.00 58.31 58.94 1by6 n LYS 76 Cb 0.46 -1.68 0.00 0.00 0.00 0.00 0.00 35.03 33.82 1by6 n LYS 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1by6 n GLY 77 N 1.41 0.90 0.00 3.14 0.00 -1.12 -4.93 105.19 104.60 1by6 n GLY 77 Ca -0.34 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1by6 n GLY 77 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1by6 n GLU 78 N -0.51 0.00 0.00 1.61 -0.58 -1.26 -5.11 120.64 114.78 1by6 n GLU 78 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1by6 n GLU 78 Cb 0.45 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.32 1by6 n GLU 78 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80