#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 0.75 -0.28 0.00 1.01 -1.26 -4.98 120.40 115.64 1by6 s VAL 45 Ca 0.00 -1.12 0.20 0.00 0.00 0.00 0.00 61.98 61.06 1by6 s VAL 45 Cb 0.00 -1.46 0.50 0.00 0.00 0.00 0.00 36.38 35.42 1by6 s VAL 45 CO 0.00 -0.53 1.10 -0.67 0.00 0.00 0.00 175.10 175.00 1by6 n ASP 46 N 4.92 2.03 0.00 3.32 -0.08 -1.26 -5.06 116.55 120.42 1by6 n ASP 46 Ca -0.05 -2.36 0.00 0.00 -1.51 0.00 0.00 54.79 50.87 1by6 n ASP 46 Cb 0.43 -0.47 0.00 0.00 2.34 0.00 0.00 41.12 43.42 1by6 n ASP 46 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1by6 n GLU 47 N -0.54 0.64 -0.10 -0.67 -0.58 -1.26 -5.10 120.64 113.03 1by6 n GLU 47 Ca 0.12 0.00 -0.19 0.00 -0.42 0.00 0.00 57.16 56.67 1by6 n GLU 47 Cb 0.82 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.63 1by6 n GLU 47 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1by6 n LYS 48 N 0.00 0.47 -1.11 3.49 0.00 -1.26 -5.09 118.16 114.66 1by6 n LYS 48 Ca 0.00 0.20 0.13 0.00 0.00 0.00 0.00 58.31 58.64 1by6 n LYS 48 Cb 0.00 -1.30 -0.04 0.00 0.00 0.00 0.00 35.03 33.68 1by6 n LYS 48 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1by6 n LEU 49 N -4.12 -0.57 -3.54 3.14 4.32 -1.26 -3.46 117.00 111.51 1by6 n LEU 49 Ca -0.35 1.30 -0.44 0.00 -0.02 0.00 0.00 56.01 56.50 1by6 n LEU 49 Cb 0.70 -3.56 -0.09 0.00 -1.62 0.00 0.00 43.42 38.85 1by6 n LEU 49 CO 0.07 -2.31 1.74 -1.14 -1.22 0.00 0.00 177.39 174.54 1by6 n ARG 50 N -3.44 0.63 0.19 3.23 3.00 -1.26 -4.56 116.66 114.45 1by6 n ARG 50 Ca -0.02 -1.34 0.06 0.00 -0.00 0.00 0.00 57.85 56.55 1by6 n ARG 50 Cb 0.62 -2.67 0.36 0.00 0.00 0.00 0.00 32.46 30.78 1by6 n ARG 50 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 1by6 h ASP 51 N 9.10 0.00 -0.57 6.15 3.58 -1.99 -3.09 116.42 129.61 1by6 h ASP 51 Ca 0.33 0.00 0.16 0.00 0.42 0.00 0.00 57.03 57.94 1by6 h ASP 51 Cb 0.68 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.71 1by6 h ASP 51 CO 2.00 0.35 0.84 0.17 -2.88 0.00 0.00 179.24 179.73 1by6 h LEU 52 N 0.00 0.00 -1.00 2.28 -0.00 -1.91 -1.15 115.31 113.53 1by6 h LEU 52 Ca -0.00 0.00 0.38 0.00 -0.00 0.00 0.00 57.88 58.26 1by6 h LEU 52 Cb 0.86 0.00 -0.17 0.00 -0.00 0.00 0.00 40.66 41.35 1by6 h LEU 52 CO 0.05 0.00 0.52 0.22 -0.00 0.00 0.00 178.44 179.22 1by6 h TYR 53 N 0.00 0.81 -0.84 0.17 5.03 -1.93 0.11 116.97 120.32 1by6 h TYR 53 Ca 0.27 0.04 0.17 0.00 2.58 0.00 0.00 58.73 61.79 1by6 h TYR 53 Cb 1.95 -0.18 -0.16 0.00 1.55 0.00 0.00 36.73 39.89 1by6 h TYR 53 CO 0.00 -0.39 -0.21 0.77 -1.32 0.00 0.00 178.16 177.01 1by6 h SER 54 N 0.09 -0.79 0.00 -2.11 0.02 -1.51 -3.40 113.55 105.85 1by6 h SER 54 Ca 0.80 0.25 0.00 0.00 -0.84 0.00 0.00 61.79 62.00 1by6 h SER 54 Cb 2.03 0.52 0.00 0.00 0.14 0.00 0.00 62.40 65.09 1by6 h SER 54 CO -0.73 -0.28 0.00 1.17 -1.14 0.00 0.00 176.83 175.85 1by6 n LYS 55 N -5.54 1.68 -1.83 3.45 3.00 0.39 -4.96 118.16 114.34 1by6 n LYS 55 Ca 0.12 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.38 1by6 n LYS 55 Cb 0.42 0.00 0.07 0.00 0.00 0.00 0.00 35.03 35.52 1by6 n LYS 55 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1by6 n SER 56 N 0.00 2.52 0.06 3.14 7.64 -1.26 -4.80 113.62 120.91 1by6 n SER 56 Ca 0.00 -2.96 0.06 0.00 1.01 0.00 0.00 58.87 56.98 1by6 n SER 56 Cb 0.00 -0.41 0.28 0.00 -1.01 0.00 0.00 64.21 63.07 1by6 n SER 56 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1by6 n THR 57 N -0.53 1.36 -1.03 0.44 5.66 -1.26 -1.92 114.28 117.00 1by6 n THR 57 Ca 0.21 0.45 -0.38 0.00 -3.05 0.00 0.00 64.05 61.28 1by6 n THR 57 Cb 0.90 -1.38 -0.10 0.00 -1.55 0.00 0.00 70.33 68.20 1by6 n THR 57 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1by6 n ALA 58 N -1.61 1.54 0.00 1.79 0.00 -1.26 -4.45 120.51 116.52 1by6 n ALA 58 Ca 0.01 -2.83 0.00 0.00 0.00 0.00 0.00 53.44 50.62 1by6 n ALA 58 Cb 0.08 -3.62 0.00 0.00 0.00 0.00 0.00 19.45 15.91 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 10.96 0.00 -0.12 0.00 0.00 -1.26 -4.67 120.51 125.42 1by6 n ALA 59 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1by6 n ALA 59 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 0.00 -0.44 0.00 0.00 -1.25 -4.06 117.12 111.37 1by6 n MET 60 Ca 0.00 0.73 -0.14 0.00 0.00 0.00 0.00 57.70 58.29 1by6 n MET 60 Cb 0.00 -1.12 0.13 0.00 0.00 0.00 0.00 33.22 32.23 1by6 n MET 60 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1by6 n SER 61 N -2.50 -2.88 0.00 6.12 2.88 -0.81 -3.12 113.62 113.31 1by6 n SER 61 Ca 0.00 -0.39 0.00 0.00 -1.33 0.00 0.00 58.87 57.15 1by6 n SER 61 Cb 0.00 -0.67 0.00 0.00 -0.75 0.00 0.00 64.21 62.79 1by6 n SER 61 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1by6 n THR 62 N -4.22 0.00 -3.88 2.46 -1.04 -1.26 -4.56 114.28 101.77 1by6 n THR 62 Ca 0.06 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.79 1by6 n THR 62 Cb 0.27 0.00 -0.17 0.00 -1.82 0.00 0.00 70.33 68.61 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 0.00 1.62 0.03 -1.42 6.14 -1.18 -4.52 117.35 118.01 1by6 s TYR 63 Ca 0.00 -0.99 -0.02 0.00 0.64 0.00 0.00 57.07 56.70 1by6 s TYR 63 Cb 0.00 -1.28 -0.01 0.00 0.42 0.00 0.00 41.96 41.09 1by6 s TYR 63 CO 0.00 -0.59 -0.04 2.41 0.64 0.00 0.00 175.55 177.97 1by6 n THR 64 N 4.90 0.75 -0.02 4.34 -1.04 -1.25 -4.58 114.28 117.38 1by6 n THR 64 Ca -0.12 0.25 -0.02 0.00 -2.04 0.00 0.00 64.05 62.12 1by6 n THR 64 Cb 0.48 -1.47 -0.02 0.00 -1.82 0.00 0.00 70.33 67.50 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 3.12 -0.14 0.00 3.41 0.00 -1.26 -5.00 105.19 105.32 1by6 n GLY 65 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1by6 n GLY 65 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1by6 n ILE 66 N -2.27 0.00 -1.65 -0.61 3.06 -1.26 -5.13 119.36 111.50 1by6 n ILE 66 Ca -0.06 0.00 -0.47 0.00 -2.50 0.00 0.00 62.75 59.71 1by6 n ILE 66 Cb 0.60 0.00 -0.05 0.00 0.54 0.00 0.00 39.64 40.74 1by6 n ILE 66 CO 0.00 0.00 0.00 2.22 -2.50 0.00 0.00 176.55 176.27 1by6 n PHE 67 N 0.00 2.10 -3.64 9.51 1.16 -1.26 -4.96 117.46 120.38 1by6 n PHE 67 Ca 0.00 0.35 -0.04 0.00 -1.87 0.00 0.00 57.45 55.89 1by6 n PHE 67 Cb 0.00 -2.50 -0.06 0.00 -1.61 0.00 0.00 39.48 35.32 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 0.90 -0.44 0.00 1.97 -4.23 -1.26 -4.97 115.64 107.61 1by6 s THR 68 Ca 0.80 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.31 1by6 s THR 68 Cb -0.74 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.10 1by6 s THR 68 CO 0.40 0.00 0.00 -0.67 -0.54 0.00 0.00 174.62 173.81 1by6 n ASP 69 N 4.79 0.00 0.00 3.99 2.03 -1.26 -4.57 116.55 121.53 1by6 n ASP 69 Ca -0.16 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.15 1by6 n ASP 69 Cb 0.55 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 1by6 n ASP 69 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1by6 n GLN 70 N 0.00 0.00 -0.32 -0.67 3.00 -1.26 0.64 117.38 118.76 1by6 n GLN 70 Ca 0.00 0.55 0.29 0.00 -0.01 0.00 0.00 57.00 57.83 1by6 n GLN 70 Cb 0.00 -1.02 0.54 0.00 0.00 0.00 0.00 30.24 29.76 1by6 n GLN 70 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1by6 h VAL 71 N 0.00 0.06 -0.08 5.09 2.07 -1.96 1.80 116.25 123.24 1by6 h VAL 71 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1by6 h VAL 71 Cb 0.00 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.76 1by6 h VAL 71 CO 0.00 0.01 0.00 -0.11 0.02 0.00 0.00 177.57 177.49 1by6 n LEU 72 N -5.23 1.18 -0.99 2.57 0.00 0.21 -3.84 117.00 110.90 1by6 n LEU 72 Ca 0.36 -0.46 -0.01 0.00 0.00 0.00 0.00 56.01 55.89 1by6 n LEU 72 Cb 1.19 -0.05 0.16 0.00 0.00 0.00 0.00 43.42 44.71 1by6 n LEU 72 CO 0.02 0.23 0.30 -0.24 0.00 0.00 0.00 177.39 177.71 1by6 n SER 73 N -0.03 2.46 0.01 1.96 2.88 0.61 -4.74 113.62 116.77 1by6 n SER 73 Ca 0.17 -3.79 -0.01 0.00 -1.33 0.00 0.00 58.87 53.91 1by6 n SER 73 Cb 0.27 -0.48 -0.00 0.00 -0.75 0.00 0.00 64.21 63.25 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 -0.96 0.40 -0.34 2.46 0.31 -1.16 -4.73 118.33 114.31 1by6 n VAL 74 Ca 0.24 0.10 0.05 0.00 -0.01 0.00 0.00 64.34 64.72 1by6 n VAL 74 Cb 0.77 -1.55 0.20 0.00 -0.91 0.00 0.00 33.84 32.36 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 -0.05 0.84 -9.40 7.52 7.12 -1.86 -3.40 115.31 116.09 1by6 h LEU 75 Ca -0.03 0.04 -0.57 0.00 0.13 0.00 0.00 57.88 57.46 1by6 h LEU 75 Cb 0.76 -0.13 -0.07 0.00 -0.53 0.00 0.00 40.66 40.70 1by6 h LEU 75 CO -0.02 0.47 -0.08 -0.75 -0.13 0.00 0.00 178.44 177.94 1by6 s LYS 76 N -6.00 4.33 0.00 1.25 2.47 -1.26 -3.57 119.74 116.96 1by6 s LYS 76 Ca -0.12 0.58 0.00 0.00 -1.56 0.00 0.00 55.97 54.87 1by6 s LYS 76 Cb 0.21 -3.40 0.00 0.00 -1.46 0.00 0.00 37.83 33.17 1by6 s LYS 76 CO 0.80 0.22 0.00 0.41 0.16 0.00 0.00 175.35 176.94 1by6 n GLY 77 N 2.97 1.38 1.61 5.54 0.00 -1.26 -4.90 105.19 110.53 1by6 n GLY 77 Ca -0.06 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 0.24 0.00 1.61 4.07 -1.26 -5.20 120.64 120.11 1by6 n GLU 78 Ca 0.00 -0.23 0.00 0.00 -0.06 0.00 0.00 57.16 56.87 1by6 n GLU 78 Cb 0.00 0.13 0.00 0.00 -0.06 0.00 0.00 31.44 31.51 1by6 n GLU 78 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16