#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 1.04 0.00 0.00 1.01 -1.26 -4.90 120.40 116.30 1by6 s VAL 45 Ca 0.00 -2.65 0.00 0.00 0.00 0.00 0.00 61.98 59.33 1by6 s VAL 45 Cb 0.00 -1.72 0.00 0.00 0.00 0.00 0.00 36.38 34.66 1by6 s VAL 45 CO 0.00 -1.03 0.00 0.47 0.00 0.00 0.00 175.10 174.54 1by6 n ASP 46 N 3.22 2.26 -4.41 3.32 8.00 -1.26 -5.02 116.55 122.66 1by6 n ASP 46 Ca 0.17 0.00 -0.48 0.00 0.71 0.00 0.00 54.79 55.19 1by6 n ASP 46 Cb 0.39 0.10 -0.14 0.00 -0.02 0.00 0.00 41.12 41.46 1by6 n ASP 46 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1by6 n GLU 47 N -1.71 0.02 0.00 -1.24 4.07 -1.26 -4.11 120.64 116.40 1by6 n GLU 47 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1by6 n GLU 47 Cb 0.26 -1.53 0.00 0.00 -0.06 0.00 0.00 31.44 30.11 1by6 n GLU 47 CO 0.00 0.00 0.00 0.36 -0.06 0.00 0.00 177.13 177.43 1by6 n LYS 48 N 8.13 0.00 0.00 5.31 2.85 -1.26 -4.98 118.16 128.20 1by6 n LYS 48 Ca 0.61 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.87 1by6 n LYS 48 Cb 0.01 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.39 1by6 n LYS 48 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1by6 n LEU 49 N 0.00 0.00 -0.10 -5.58 7.99 -1.26 -4.28 117.00 113.76 1by6 n LEU 49 Ca 0.00 0.94 -0.24 0.00 -0.01 0.00 0.00 56.01 56.70 1by6 n LEU 49 Cb 0.00 -0.44 -0.11 0.00 -0.11 0.00 0.00 43.42 42.75 1by6 n LEU 49 CO 0.00 -0.44 -1.00 -1.14 -1.51 0.00 0.00 177.39 173.30 1by6 n ARG 50 N -2.28 0.62 -3.64 3.23 0.63 -1.26 -4.98 116.66 108.98 1by6 n ARG 50 Ca 0.00 0.36 -0.21 0.00 -0.92 0.00 0.00 57.85 57.08 1by6 n ARG 50 Cb 0.00 -1.62 0.04 0.00 0.45 0.00 0.00 32.46 31.33 1by6 n ARG 50 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1by6 n ASP 51 N -4.06 -1.95 -2.20 6.15 2.03 -1.26 -0.63 116.55 114.64 1by6 n ASP 51 Ca -0.42 -0.81 -0.06 0.00 0.52 0.00 0.00 54.79 54.03 1by6 n ASP 51 Cb 0.85 -4.19 -0.01 0.00 -0.72 0.00 0.00 41.12 37.05 1by6 n ASP 51 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1by6 n LEU 52 N -4.18 -0.52 -4.45 -2.67 4.77 -1.26 -1.37 117.00 107.32 1by6 n LEU 52 Ca -0.27 0.31 -0.41 0.00 -0.03 0.00 0.00 56.01 55.61 1by6 n LEU 52 Cb 0.67 -1.46 -0.07 0.00 -2.33 0.00 0.00 43.42 40.23 1by6 n LEU 52 CO 0.67 -0.11 -0.13 0.00 -1.33 0.00 0.00 177.39 176.48 1by6 n TYR 53 N -2.60 -1.28 0.00 -1.77 9.36 0.20 0.75 117.16 121.82 1by6 n TYR 53 Ca -0.07 0.70 0.00 0.00 3.32 0.00 0.00 57.90 61.85 1by6 n TYR 53 Cb 0.48 -2.04 0.00 0.00 -0.63 0.00 0.00 39.34 37.15 1by6 n TYR 53 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1by6 n SER 54 N -2.48 0.00 -1.64 2.98 2.88 -0.47 -4.72 113.62 110.18 1by6 n SER 54 Ca 0.11 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 1by6 n SER 54 Cb 0.46 -0.32 0.00 0.00 -0.75 0.00 0.00 64.21 63.60 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 -1.90 -4.51 0.00 -1.46 5.02 0.23 -4.78 118.16 110.76 1by6 n LYS 55 Ca 0.00 3.26 0.00 0.00 -2.02 0.00 0.00 58.31 59.55 1by6 n LYS 55 Cb 0.00 -3.55 0.00 0.00 -0.02 0.00 0.00 35.03 31.46 1by6 n LYS 55 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1by6 n SER 56 N 0.62 0.00 -0.45 4.39 7.64 -1.26 -4.89 113.62 119.66 1by6 n SER 56 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.82 1by6 n SER 56 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 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 0.00 0.00 -4.36 0.44 -1.04 -1.26 -3.73 114.28 104.33 1by6 n THR 57 Ca 0.00 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.61 1by6 n THR 57 Cb 0.00 -0.90 -0.07 0.00 -1.82 0.00 0.00 70.33 67.53 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 1.11 -1.15 -2.67 2.41 0.00 -1.26 -4.71 120.51 114.24 1by6 n ALA 58 Ca -0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 53.44 53.17 1by6 n ALA 58 Cb 0.20 -2.36 0.09 0.00 0.00 0.00 0.00 19.45 17.39 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 -3.85 2.86 -0.87 0.00 0.00 -1.24 -4.97 120.51 112.43 1by6 n ALA 59 Ca 0.11 -1.50 -0.19 0.00 0.00 0.00 0.00 53.44 51.86 1by6 n ALA 59 Cb 0.43 -0.80 -0.08 0.00 0.00 0.00 0.00 19.45 19.00 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 -1.13 2.13 -2.07 0.00 1.56 -1.26 -4.79 117.12 111.57 1by6 n MET 60 Ca -0.11 -1.25 0.00 0.00 -0.27 0.00 0.00 57.70 56.07 1by6 n MET 60 Cb 0.85 -2.22 0.00 0.00 2.15 0.00 0.00 33.22 34.00 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 3.23 -7.66 -2.97 6.12 2.88 -1.26 -4.73 113.62 109.23 1by6 n SER 61 Ca 0.46 1.42 -0.01 0.00 -1.33 0.00 0.00 58.87 59.40 1by6 n SER 61 Cb 0.45 -4.58 -0.01 0.00 -0.75 0.00 0.00 64.21 59.32 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 1.91 -5.54 -2.98 2.46 -1.04 -1.26 -5.02 114.28 102.81 1by6 n THR 62 Ca 0.00 1.01 0.05 0.00 -2.04 0.00 0.00 64.05 63.07 1by6 n THR 62 Cb 0.00 -4.23 0.00 0.00 -1.82 0.00 0.00 70.33 64.28 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 -0.79 -0.07 -0.21 -1.42 5.04 -1.26 -5.07 117.35 113.58 1by6 s TYR 63 Ca -0.05 0.03 -0.12 0.00 -2.44 0.00 0.00 57.07 54.49 1by6 s TYR 63 Cb 0.00 0.01 -0.09 0.00 0.35 0.00 0.00 41.96 42.24 1by6 s TYR 63 CO 0.29 -0.04 -0.29 2.41 -1.34 0.00 0.00 175.55 176.57 1by6 n THR 64 N 4.49 1.30 -1.70 4.34 -1.04 -1.26 -4.75 114.28 115.66 1by6 n THR 64 Ca 0.08 -0.20 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 1by6 n THR 64 Cb 0.61 -1.90 0.00 0.00 -1.82 0.00 0.00 70.33 67.22 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 1.63 1.68 2.69 3.41 0.00 -1.26 -5.08 105.19 108.26 1by6 n GLY 65 Ca -0.37 -1.98 -0.07 0.00 0.00 0.00 0.00 46.02 43.59 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 0.45 -4.03 -0.61 5.41 -1.26 -5.11 119.36 114.22 1by6 n ILE 66 Ca 0.00 -2.14 -0.16 0.00 1.00 0.00 0.00 62.75 61.45 1by6 n ILE 66 Cb 0.00 0.89 -0.15 0.00 -0.71 0.00 0.00 39.64 39.67 1by6 n ILE 66 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 1by6 s PHE 67 N -1.31 0.37 -0.33 1.39 -0.12 -1.26 -5.04 117.98 111.68 1by6 s PHE 67 Ca 0.23 -0.05 0.15 0.00 -0.05 0.00 0.00 56.93 57.21 1by6 s PHE 67 Cb 0.42 -0.34 0.43 0.00 -0.63 0.00 0.00 43.02 42.91 1by6 s PHE 67 CO -0.04 -0.07 1.35 0.25 -0.05 0.00 0.00 175.22 176.66 1by6 n THR 68 N 3.56 0.39 -3.75 -4.49 -2.24 -1.26 -5.04 114.28 101.45 1by6 n THR 68 Ca -0.20 -1.74 -0.13 0.00 -2.27 0.00 0.00 64.05 59.71 1by6 n THR 68 Cb 0.54 1.04 -0.11 0.00 -2.10 0.00 0.00 70.33 69.71 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 -1.97 -0.36 0.00 3.42 2.15 -1.26 -4.95 116.67 113.71 1by6 s ASP 69 Ca 0.17 0.69 0.00 0.00 0.43 0.00 0.00 52.55 53.84 1by6 s ASP 69 Cb 0.41 0.68 0.00 0.00 -0.30 0.00 0.00 42.92 43.71 1by6 s ASP 69 CO -0.09 -0.12 0.00 1.67 -0.17 0.00 0.00 175.17 176.46 1by6 n GLN 70 N 3.06 0.00 -0.89 4.34 -0.06 -1.26 -4.44 117.38 118.13 1by6 n GLN 70 Ca -0.14 0.00 -0.10 0.00 -2.00 0.00 0.00 57.00 54.75 1by6 n GLN 70 Cb 0.57 0.00 -0.08 0.00 -4.06 0.00 0.00 30.24 26.67 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 2.70 -0.07 1.69 0.31 -1.26 -3.73 118.33 117.97 1by6 n VAL 71 Ca 0.00 -1.37 0.00 0.00 -0.01 0.00 0.00 64.34 62.96 1by6 n VAL 71 Cb 0.00 -1.73 0.00 0.00 -0.91 0.00 0.00 33.84 31.20 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 1.79 0.78 -1.04 7.52 7.94 -1.26 -4.58 117.00 128.14 1by6 n LEU 72 Ca 0.29 -0.85 0.09 0.00 -1.11 0.00 0.00 56.01 54.43 1by6 n LEU 72 Cb 0.71 0.00 0.24 0.00 0.53 0.00 0.00 43.42 44.90 1by6 n LEU 72 CO 0.13 0.20 0.70 -1.54 -1.11 0.00 0.00 177.39 175.77 1by6 n SER 73 N -0.13 3.46 -2.72 1.96 3.41 -1.24 -4.46 113.62 113.90 1by6 n SER 73 Ca 0.00 -1.98 -0.20 0.00 -0.26 0.00 0.00 58.87 56.42 1by6 n SER 73 Cb 0.02 -0.36 -0.00 0.00 -0.26 0.00 0.00 64.21 63.61 1by6 n SER 73 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1by6 n VAL 74 N 1.17 1.73 -0.35 -3.33 0.31 -1.26 -4.93 118.33 111.68 1by6 n VAL 74 Ca 0.19 -4.45 0.15 0.00 -0.01 0.00 0.00 64.34 60.21 1by6 n VAL 74 Cb 0.54 -0.58 0.29 0.00 -0.91 0.00 0.00 33.84 33.18 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 -0.21 -0.12 0.00 7.52 -0.00 -1.26 -4.53 117.00 118.40 1by6 n LEU 75 Ca 0.27 1.70 0.00 0.00 -0.00 0.00 0.00 56.01 57.97 1by6 n LEU 75 Cb 0.66 -0.62 0.00 0.00 -0.00 0.00 0.00 43.42 43.46 1by6 n LEU 75 CO 0.30 -1.72 0.00 0.29 -0.00 0.00 0.00 177.39 176.26 1by6 n LYS 76 N -5.50 0.00 0.00 1.96 4.76 -1.26 -5.05 118.16 113.07 1by6 n LYS 76 Ca 0.24 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.68 1by6 n LYS 76 Cb 0.77 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.96 1by6 n LYS 76 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1by6 n GLY 77 N 0.00 1.85 3.35 0.72 0.00 -1.26 -4.73 105.19 105.11 1by6 n GLY 77 Ca 0.00 0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 1by6 n GLY 77 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1by6 s GLU 78 N 0.00 0.72 0.00 1.61 0.41 -1.26 -5.04 118.70 115.14 1by6 s GLU 78 Ca 0.00 0.21 0.00 0.00 -0.41 0.00 0.00 54.97 54.77 1by6 s GLU 78 Cb 0.00 0.33 0.00 0.00 -1.78 0.00 0.00 34.13 32.68 1by6 s GLU 78 CO 0.00 -0.18 0.00 -1.91 -0.49 0.00 0.00 175.26 172.68