#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1by6 n VAL 45 N 0.00 -0.50 -2.52 0.00 0.31 -1.26 -4.91 118.33 109.44 1by6 n VAL 45 Ca 0.00 -3.82 -0.01 0.00 -0.01 0.00 0.00 64.34 60.50 1by6 n VAL 45 Cb 0.00 -1.80 0.03 0.00 -0.91 0.00 0.00 33.84 31.16 1by6 n VAL 45 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1by6 n ASP 46 N 2.46 0.13 -2.84 4.52 8.00 -1.26 -5.00 116.55 122.56 1by6 n ASP 46 Ca 0.27 -2.06 -0.09 0.00 0.71 0.00 0.00 54.79 53.63 1by6 n ASP 46 Cb 0.46 0.02 0.01 0.00 -0.02 0.00 0.00 41.12 41.58 1by6 n ASP 46 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1by6 n GLU 47 N -0.41 0.59 -3.92 -1.24 -0.58 -1.26 -5.10 120.64 108.72 1by6 n GLU 47 Ca -0.07 -2.13 -0.34 0.00 -0.42 0.00 0.00 57.16 54.20 1by6 n GLU 47 Cb 0.89 -1.48 -0.14 0.00 -0.57 0.00 0.00 31.44 30.15 1by6 n GLU 47 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1by6 s LYS 48 N 0.62 2.16 1.08 3.49 2.36 -1.26 -5.10 119.74 123.09 1by6 s LYS 48 Ca 0.31 -1.49 -0.17 0.00 -2.55 0.00 0.00 55.97 52.07 1by6 s LYS 48 Cb 0.08 -3.23 0.09 0.00 -1.05 0.00 0.00 37.83 33.72 1by6 s LYS 48 CO -0.13 -0.76 0.11 1.28 1.55 0.00 0.00 175.35 177.40 1by6 n LEU 49 N 4.53 -1.81 -0.01 5.43 7.99 -1.26 -4.93 117.00 126.94 1by6 n LEU 49 Ca -0.08 -0.01 -0.12 0.00 -0.01 0.00 0.00 56.01 55.78 1by6 n LEU 49 Cb 0.42 -1.02 -0.14 0.00 -0.11 0.00 0.00 43.42 42.58 1by6 n LEU 49 CO 0.26 -3.23 -0.59 -0.09 -1.51 0.00 0.00 177.39 172.23 1by6 h ARG 50 N -1.95 0.08 -6.08 3.23 2.43 -2.02 -3.49 114.38 106.58 1by6 h ARG 50 Ca -0.51 -0.13 -0.30 0.00 -0.81 0.00 0.00 59.98 58.23 1by6 h ARG 50 Cb 1.34 0.05 0.03 0.00 -0.42 0.00 0.00 29.97 30.97 1by6 h ARG 50 CO 0.37 0.70 -0.67 -3.47 -1.51 0.00 0.00 179.97 175.40 1by6 n ASP 51 N -3.17 -6.07 -2.39 -3.80 2.03 -1.26 -0.44 116.55 101.44 1by6 n ASP 51 Ca -0.21 -0.67 -0.05 0.00 0.52 0.00 0.00 54.79 54.38 1by6 n ASP 51 Cb 1.05 -3.56 -0.00 0.00 -0.72 0.00 0.00 41.12 37.89 1by6 n ASP 51 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1by6 n LEU 52 N -2.86 -0.44 -3.15 -2.67 0.00 -1.26 -2.10 117.00 104.53 1by6 n LEU 52 Ca -0.13 0.37 -0.08 0.00 0.00 0.00 0.00 56.01 56.17 1by6 n LEU 52 Cb 0.59 -1.42 0.00 0.00 0.00 0.00 0.00 43.42 42.60 1by6 n LEU 52 CO 0.61 -0.06 0.16 0.00 0.00 0.00 0.00 177.39 178.10 1by6 n TYR 53 N -2.75 -2.94 -3.37 1.96 9.36 0.41 -3.91 117.16 115.93 1by6 n TYR 53 Ca -0.06 1.15 -0.35 0.00 3.32 0.00 0.00 57.90 61.96 1by6 n TYR 53 Cb 0.52 -3.78 0.03 0.00 -0.63 0.00 0.00 39.34 35.48 1by6 n TYR 53 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 1by6 n SER 54 N -1.50 -4.98 -0.45 2.98 3.41 -0.89 -4.88 113.62 107.32 1by6 n SER 54 Ca -0.03 -0.24 0.06 0.00 -0.26 0.00 0.00 58.87 58.40 1by6 n SER 54 Cb 0.53 -1.47 0.05 0.00 -0.26 0.00 0.00 64.21 63.06 1by6 n SER 54 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1by6 n LYS 55 N -0.41 0.64 -0.07 4.33 4.81 -1.25 -4.47 118.16 121.75 1by6 n LYS 55 Ca -0.11 -1.16 -0.22 0.00 -0.87 0.00 0.00 58.31 55.95 1by6 n LYS 55 Cb 0.64 -1.22 -0.12 0.00 0.02 0.00 0.00 35.03 34.35 1by6 n LYS 55 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1by6 n SER 56 N 0.61 1.97 0.28 3.14 3.41 -1.26 -3.94 113.62 117.84 1by6 n SER 56 Ca 0.07 0.31 -0.12 0.00 -0.26 0.00 0.00 58.87 58.87 1by6 n SER 56 Cb 0.28 -0.89 -0.06 0.00 -0.26 0.00 0.00 64.21 63.29 1by6 n SER 56 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1by6 h THR 57 N -0.56 0.00 -1.18 6.66 2.02 -1.98 -3.06 112.91 114.80 1by6 h THR 57 Ca -0.42 -0.42 0.34 0.00 0.77 0.00 0.00 66.41 66.69 1by6 h THR 57 Cb 1.63 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.99 1by6 h THR 57 CO -0.11 0.00 0.92 0.00 0.37 0.00 0.00 175.52 176.69 1by6 h ALA 58 N -1.23 3.08 -3.05 6.16 0.00 -1.81 -3.40 119.26 119.02 1by6 h ALA 58 Ca -0.08 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1by6 h ALA 58 Cb 0.59 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1by6 h ALA 58 CO 0.13 -1.53 0.00 0.00 0.00 0.00 0.00 179.25 177.85 1by6 n ALA 59 N -2.68 0.00 0.00 0.00 0.00 -1.16 -5.00 120.51 111.67 1by6 n ALA 59 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1by6 n ALA 59 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.75 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 -0.76 0.00 -3.29 0.00 0.00 -1.26 -5.01 117.12 106.79 1by6 n MET 60 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.70 57.55 1by6 n MET 60 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 33.22 33.24 1by6 n MET 60 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1by6 n SER 61 N 0.00 -6.22 -3.41 6.12 7.64 -1.26 -3.48 113.62 113.00 1by6 n SER 61 Ca 0.00 0.22 -0.33 0.00 1.01 0.00 0.00 58.87 59.77 1by6 n SER 61 Cb 0.00 -1.78 0.03 0.00 -1.01 0.00 0.00 64.21 61.46 1by6 n SER 61 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1by6 n THR 62 N 0.69 -4.77 -2.94 0.44 -1.04 -1.26 -4.98 114.28 100.42 1by6 n THR 62 Ca -0.03 0.22 0.03 0.00 -2.04 0.00 0.00 64.05 62.23 1by6 n THR 62 Cb 0.55 -4.01 0.00 0.00 -1.82 0.00 0.00 70.33 65.06 1by6 n THR 62 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 1by6 s TYR 63 N -1.58 -0.65 -0.19 -1.42 6.14 -1.23 -5.06 117.35 113.36 1by6 s TYR 63 Ca 0.35 0.18 -0.09 0.00 0.64 0.00 0.00 57.07 58.14 1by6 s TYR 63 Cb -0.04 0.12 -0.08 0.00 0.42 0.00 0.00 41.96 42.38 1by6 s TYR 63 CO 0.82 -0.42 -0.24 2.41 0.64 0.00 0.00 175.55 178.75 1by6 n THR 64 N 4.21 1.04 -0.50 4.34 -1.04 -1.26 -4.27 114.28 116.79 1by6 n THR 64 Ca 0.07 -0.25 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 1by6 n THR 64 Cb 0.61 -1.76 0.00 0.00 -1.82 0.00 0.00 70.33 67.35 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 1.83 4.27 0.72 3.41 0.00 -1.26 -5.08 105.19 109.08 1by6 n GLY 65 Ca -0.37 -1.70 -0.00 0.00 0.00 0.00 0.00 46.02 43.95 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 0.00 0.00 0.00 -0.61 5.41 -1.26 -5.10 119.36 117.80 1by6 n ILE 66 Ca 0.00 -0.16 0.00 0.00 1.00 0.00 0.00 62.75 63.59 1by6 n ILE 66 Cb 0.00 0.41 0.00 0.00 -0.71 0.00 0.00 39.64 39.34 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 0.08 0.00 -2.60 1.39 1.16 -1.26 -5.06 117.46 111.17 1by6 n PHE 67 Ca -0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 57.45 55.54 1by6 n PHE 67 Cb 0.70 0.00 0.05 0.00 -1.61 0.00 0.00 39.48 38.63 1by6 n PHE 67 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 1by6 n THR 68 N -0.01 0.44 -3.68 1.97 -2.24 -1.26 -4.99 114.28 104.52 1by6 n THR 68 Ca 0.00 -1.51 -0.14 0.00 -2.27 0.00 0.00 64.05 60.13 1by6 n THR 68 Cb 0.00 1.03 -0.08 0.00 -2.10 0.00 0.00 70.33 69.18 1by6 n THR 68 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1by6 s ASP 69 N -2.17 -0.46 0.00 3.42 2.15 -1.26 -4.89 116.67 113.46 1by6 s ASP 69 Ca 0.18 0.68 0.00 0.00 0.43 0.00 0.00 52.55 53.84 1by6 s ASP 69 Cb 0.33 0.71 0.00 0.00 -0.30 0.00 0.00 42.92 43.66 1by6 s ASP 69 CO -0.09 -0.36 0.00 1.67 -0.17 0.00 0.00 175.17 176.23 1by6 n GLN 70 N 1.92 0.00 0.00 4.34 -0.06 -1.26 -4.08 117.38 118.24 1by6 n GLN 70 Ca -0.17 0.00 0.04 0.00 -2.00 0.00 0.00 57.00 54.87 1by6 n GLN 70 Cb 0.56 0.00 0.26 0.00 -4.06 0.00 0.00 30.24 27.01 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 0.00 -2.86 1.69 0.31 -1.26 -3.78 118.33 112.43 1by6 n VAL 71 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.18 1by6 n VAL 71 Cb 0.00 -0.21 -0.00 0.00 -0.91 0.00 0.00 33.84 32.72 1by6 n VAL 71 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1by6 n LEU 72 N -0.66 1.71 -2.70 7.52 0.00 -1.26 -4.89 117.00 116.73 1by6 n LEU 72 Ca 0.07 -4.47 -0.07 0.00 0.00 0.00 0.00 56.01 51.54 1by6 n LEU 72 Cb 0.03 0.39 0.09 0.00 0.00 0.00 0.00 43.42 43.94 1by6 n LEU 72 CO 0.05 1.95 0.50 -0.24 0.00 0.00 0.00 177.39 179.65 1by6 n SER 73 N 0.02 -1.86 0.00 1.96 2.88 -1.25 -4.89 113.62 110.48 1by6 n SER 73 Ca 0.19 -2.60 0.00 0.00 -1.33 0.00 0.00 58.87 55.13 1by6 n SER 73 Cb 0.72 1.25 0.00 0.00 -0.75 0.00 0.00 64.21 65.42 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 -0.29 0.00 0.04 2.46 0.31 -1.26 -3.71 118.33 115.88 1by6 n VAL 74 Ca -0.05 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.16 1by6 n VAL 74 Cb 0.78 -0.64 -0.08 0.00 -0.91 0.00 0.00 33.84 32.99 1by6 n VAL 74 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1by6 h LEU 75 N 0.00 -0.04 -1.54 7.52 7.12 -1.99 -2.88 115.31 123.49 1by6 h LEU 75 Ca 0.00 -0.19 -0.04 0.00 0.13 0.00 0.00 57.88 57.79 1by6 h LEU 75 Cb 0.99 0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 41.12 1by6 h LEU 75 CO 0.00 0.16 -0.12 0.50 -0.13 0.00 0.00 178.44 178.85 1by6 h LYS 76 N -0.25 0.15 0.00 1.25 1.63 -1.97 -3.46 116.57 113.92 1by6 h LYS 76 Ca -0.01 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 1by6 h LYS 76 Cb 0.23 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.84 1by6 h LYS 76 CO 0.01 0.27 0.00 0.41 -3.45 0.00 0.00 179.45 176.69 1by6 n GLY 77 N -1.01 4.26 0.00 5.01 0.00 -1.09 -4.83 105.19 107.54 1by6 n GLY 77 Ca -0.01 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1by6 n GLY 77 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1by6 n GLU 78 N 0.00 0.00 0.00 1.61 4.07 -1.24 -4.79 120.64 120.28 1by6 n GLU 78 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1by6 n GLU 78 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1by6 n GLU 78 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22