#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 0.69 -0.34 0.00 1.01 -1.26 -4.93 120.40 115.56 1by6 s VAL 45 Ca 0.00 -2.76 0.14 0.00 0.00 0.00 0.00 61.98 59.37 1by6 s VAL 45 Cb 0.00 -1.48 0.43 0.00 0.00 0.00 0.00 36.38 35.33 1by6 s VAL 45 CO 0.00 -1.17 1.32 0.47 0.00 0.00 0.00 175.10 175.72 1by6 n ASP 46 N 2.89 -0.65 -2.66 3.32 9.92 -1.26 -5.01 116.55 123.10 1by6 n ASP 46 Ca 0.26 -2.34 -0.04 0.00 -0.53 0.00 0.00 54.79 52.13 1by6 n ASP 46 Cb 0.45 0.41 0.07 0.00 -0.64 0.00 0.00 41.12 41.40 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 -0.85 0.10 0.26 -1.24 4.07 -1.26 -5.01 120.64 116.71 1by6 n GLU 47 Ca -0.05 -0.67 0.14 0.00 -0.06 0.00 0.00 57.16 56.52 1by6 n GLU 47 Cb 0.85 -0.10 0.66 0.00 -0.06 0.00 0.00 31.44 32.79 1by6 n GLU 47 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 1by6 h LYS 48 N 3.35 0.00 -2.34 5.31 3.64 -2.00 -3.49 116.57 121.03 1by6 h LYS 48 Ca -0.19 0.00 0.25 0.00 -1.27 0.00 0.00 60.65 59.45 1by6 h LYS 48 Cb 1.20 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.94 1by6 h LYS 48 CO -0.19 0.11 -0.46 1.28 -2.27 0.00 0.00 179.45 177.92 1by6 n LEU 49 N -3.34 -0.52 -4.53 5.20 4.32 -1.26 -4.00 117.00 112.87 1by6 n LEU 49 Ca -0.00 1.17 -0.19 0.00 -0.02 0.00 0.00 56.01 56.96 1by6 n LEU 49 Cb 0.31 -3.33 -0.15 0.00 -1.62 0.00 0.00 43.42 38.63 1by6 n LEU 49 CO 0.29 -2.33 1.70 -1.14 -1.22 0.00 0.00 177.39 174.70 1by6 n ARG 50 N -3.23 0.28 -0.06 3.23 3.00 -1.26 -4.65 116.66 113.97 1by6 n ARG 50 Ca -0.01 -0.38 -0.10 0.00 -0.00 0.00 0.00 57.85 57.36 1by6 n ARG 50 Cb 0.62 -2.30 -0.15 0.00 0.00 0.00 0.00 32.46 30.62 1by6 n ARG 50 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1by6 n ASP 51 N 11.95 0.57 0.05 6.15 -0.08 -1.26 -4.18 116.55 129.76 1by6 n ASP 51 Ca 0.58 0.20 0.20 0.00 -1.51 0.00 0.00 54.79 54.25 1by6 n ASP 51 Cb 0.28 0.37 0.57 0.00 2.34 0.00 0.00 41.12 44.68 1by6 n ASP 51 CO 0.00 0.00 0.00 0.17 0.12 0.00 0.00 177.20 177.49 1by6 h LEU 52 N 0.00 0.00 -1.54 -2.67 -0.00 -1.94 -1.23 115.31 107.93 1by6 h LEU 52 Ca -0.42 0.00 0.46 0.00 -0.00 0.00 0.00 57.88 57.92 1by6 h LEU 52 Cb 2.12 0.00 -0.12 0.00 -0.00 0.00 0.00 40.66 42.66 1by6 h LEU 52 CO 0.05 0.00 0.96 0.22 -0.00 0.00 0.00 178.44 179.67 1by6 h TYR 53 N 0.00 0.40 -0.07 0.17 5.03 -1.95 0.43 116.97 120.97 1by6 h TYR 53 Ca 0.25 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.54 1by6 h TYR 53 Cb 1.77 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 39.93 1by6 h TYR 53 CO 0.00 -0.17 0.05 0.45 -1.32 0.00 0.00 178.16 177.17 1by6 n SER 54 N -4.53 3.30 0.10 -2.11 2.88 -0.46 -4.24 113.62 108.55 1by6 n SER 54 Ca 0.38 -2.16 0.00 0.00 -1.33 0.00 0.00 58.87 55.77 1by6 n SER 54 Cb 1.55 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 64.43 1by6 n SER 54 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1by6 n LYS 55 N 0.47 0.00 0.00 -1.46 4.76 0.15 -5.09 118.16 116.99 1by6 n LYS 55 Ca 0.04 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.48 1by6 n LYS 55 Cb 0.58 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.77 1by6 n LYS 55 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1by6 n SER 56 N -3.13 0.00 -1.27 4.39 7.64 -1.22 -5.04 113.62 114.99 1by6 n SER 56 Ca 0.00 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 59.81 1by6 n SER 56 Cb 0.00 0.42 0.02 0.00 -1.01 0.00 0.00 64.21 63.64 1by6 n SER 56 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1by6 n THR 57 N -2.42 -0.77 -3.74 0.44 -1.04 -1.26 -3.33 114.28 102.17 1by6 n THR 57 Ca 0.00 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.74 1by6 n THR 57 Cb 0.00 -2.05 0.01 0.00 -1.82 0.00 0.00 70.33 66.47 1by6 n THR 57 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1by6 n ALA 58 N -2.90 -2.72 0.00 2.41 0.00 -1.26 -4.58 120.51 111.46 1by6 n ALA 58 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1by6 n ALA 58 Cb 0.52 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1by6 n ALA 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1by6 n ALA 59 N -2.18 0.00 -3.34 0.00 0.00 -1.26 -5.04 120.51 108.68 1by6 n ALA 59 Ca -0.28 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.00 1by6 n ALA 59 Cb 0.69 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.15 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 -1.68 -4.09 0.00 1.56 -1.21 -2.59 117.12 109.10 1by6 n MET 60 Ca 0.00 1.35 -0.37 0.00 -0.27 0.00 0.00 57.70 58.42 1by6 n MET 60 Cb 0.00 -3.98 -0.02 0.00 2.15 0.00 0.00 33.22 31.37 1by6 n MET 60 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 1by6 n SER 61 N -1.53 -1.98 -1.96 6.12 3.41 -1.26 -4.24 113.62 112.18 1by6 n SER 61 Ca -0.10 -1.22 0.00 0.00 -0.26 0.00 0.00 58.87 57.29 1by6 n SER 61 Cb 0.59 -2.05 0.00 0.00 -0.26 0.00 0.00 64.21 62.49 1by6 n SER 61 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1by6 n THR 62 N -4.71 -7.35 0.00 6.66 -1.04 -1.07 -5.02 114.28 101.76 1by6 n THR 62 Ca -0.21 2.79 0.00 0.00 -2.04 0.00 0.00 64.05 64.58 1by6 n THR 62 Cb 0.63 -3.82 0.00 0.00 -1.82 0.00 0.00 70.33 65.32 1by6 n THR 62 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1by6 n TYR 63 N 0.87 0.00 -1.37 -1.42 4.19 -1.20 -4.99 117.16 113.24 1by6 n TYR 63 Ca 0.00 0.00 -0.14 0.00 3.31 0.00 0.00 57.90 61.07 1by6 n TYR 63 Cb 0.00 0.00 -0.06 0.00 0.49 0.00 0.00 39.34 39.77 1by6 n TYR 63 CO 0.00 0.00 0.00 2.41 0.91 0.00 0.00 176.86 180.18 1by6 n THR 64 N -0.31 0.00 -3.72 2.97 -1.04 -1.26 -2.72 114.28 108.19 1by6 n THR 64 Ca 0.00 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.73 1by6 n THR 64 Cb 0.00 -1.58 0.03 0.00 -1.82 0.00 0.00 70.33 66.96 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 0.03 -0.70 1.26 3.41 0.00 -1.26 -4.90 105.19 103.03 1by6 n GLY 65 Ca -0.14 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -4.20 0.08 0.00 -0.61 2.08 -1.10 -5.16 119.36 110.44 1by6 n ILE 66 Ca -0.18 0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.16 1by6 n ILE 66 Cb 0.63 -0.79 0.00 0.00 -0.75 0.00 0.00 39.64 38.73 1by6 n ILE 66 CO 0.00 0.00 0.00 2.22 0.56 0.00 0.00 176.55 179.33 1by6 n PHE 67 N -2.58 0.00 0.00 1.39 1.16 -1.26 -5.10 117.46 111.07 1by6 n PHE 67 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 1by6 n PHE 67 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 1by6 n PHE 67 CO 0.00 0.00 0.00 2.41 -1.87 0.00 0.00 176.76 177.30 1by6 n THR 68 N -0.35 0.00 -3.72 1.97 -1.04 -1.26 -5.03 114.28 104.85 1by6 n THR 68 Ca 0.00 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.72 1by6 n THR 68 Cb 0.00 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.47 1by6 n THR 68 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1by6 s ASP 69 N -1.71 6.42 0.00 8.00 1.11 -1.26 -4.11 116.67 125.13 1by6 s ASP 69 Ca 0.00 0.45 0.00 0.00 0.18 0.00 0.00 52.55 53.18 1by6 s ASP 69 Cb 0.00 -2.03 0.00 0.00 1.07 0.00 0.00 42.92 41.96 1by6 s ASP 69 CO 0.00 0.02 0.00 1.67 1.18 0.00 0.00 175.17 178.04 1by6 n GLN 70 N -0.24 0.00 -0.70 8.23 -0.06 -1.26 -4.22 117.38 119.13 1by6 n GLN 70 Ca -0.04 0.00 -0.12 0.00 -2.00 0.00 0.00 57.00 54.84 1by6 n GLN 70 Cb 0.53 0.00 0.04 0.00 -4.06 0.00 0.00 30.24 26.75 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 2.38 -2.69 1.69 0.31 -1.26 -4.13 118.33 114.62 1by6 n VAL 71 Ca 0.00 -1.20 -0.06 0.00 -0.01 0.00 0.00 64.34 63.07 1by6 n VAL 71 Cb 0.00 -1.22 0.08 0.00 -0.91 0.00 0.00 33.84 31.80 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 0.41 -1.75 0.00 7.52 0.00 -1.26 -4.69 117.00 117.23 1by6 n LEU 72 Ca 0.23 -2.95 0.00 0.00 0.00 0.00 0.00 56.01 53.29 1by6 n LEU 72 Cb 0.66 0.53 0.00 0.00 0.00 0.00 0.00 43.42 44.61 1by6 n LEU 72 CO 0.27 1.73 0.00 -0.24 0.00 0.00 0.00 177.39 179.16 1by6 n SER 73 N -0.24 0.00 0.00 1.96 2.88 -1.26 -4.89 113.62 112.08 1by6 n SER 73 Ca -0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1by6 n SER 73 Cb 0.76 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.22 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 0.00 -0.13 2.46 0.31 -1.26 -4.27 118.33 115.44 1by6 n VAL 74 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 1by6 n VAL 74 Cb 0.00 -0.99 0.08 0.00 -0.91 0.00 0.00 33.84 32.03 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 0.87 0.00 7.52 7.12 -2.01 -3.30 115.31 125.51 1by6 h LEU 75 Ca 0.00 -0.27 -0.10 0.00 0.13 0.00 0.00 57.88 57.64 1by6 h LEU 75 Cb 0.93 -0.23 -0.01 0.00 -0.53 0.00 0.00 40.66 40.81 1by6 h LEU 75 CO 0.00 1.00 -0.57 0.11 -0.13 0.00 0.00 178.44 178.85 1by6 h LYS 76 N 0.78 0.00 0.00 1.25 1.79 -1.98 -3.49 116.57 114.92 1by6 h LYS 76 Ca 0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 1by6 h LYS 76 Cb 0.64 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 1by6 h LYS 76 CO 0.04 0.84 0.00 0.41 -1.08 0.00 0.00 179.45 179.66 1by6 n GLY 77 N 1.55 1.44 0.00 3.86 0.00 -1.25 -4.78 105.19 106.01 1by6 n GLY 77 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.30 0.00 0.00 1.61 -0.58 -1.26 -4.99 120.64 114.12 1by6 n GLU 78 Ca 0.00 0.00 0.06 0.00 -0.42 0.00 0.00 57.16 56.80 1by6 n GLU 78 Cb 0.00 0.00 0.05 0.00 -0.57 0.00 0.00 31.44 30.92 1by6 n GLU 78 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74