#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 0.68 -0.11 0.00 1.01 -1.26 -4.90 120.40 115.81 1by6 s VAL 45 Ca 0.00 -2.76 0.16 0.00 0.00 0.00 0.00 61.98 59.38 1by6 s VAL 45 Cb 0.00 -1.47 0.25 0.00 0.00 0.00 0.00 36.38 35.15 1by6 s VAL 45 CO 0.00 -1.17 1.13 -0.67 0.00 0.00 0.00 175.10 174.39 1by6 n ASP 46 N 2.88 1.95 -3.19 3.32 -0.08 -1.26 -5.06 116.55 115.11 1by6 n ASP 46 Ca 0.26 -2.93 0.00 0.00 -1.51 0.00 0.00 54.79 50.61 1by6 n ASP 46 Cb 0.45 -0.39 0.00 0.00 2.34 0.00 0.00 41.12 43.51 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 -1.19 -0.69 -2.90 -0.67 4.71 -1.26 -5.01 120.64 113.62 1by6 n GLU 47 Ca 0.13 0.00 -0.13 0.00 -0.01 0.00 0.00 57.16 57.16 1by6 n GLU 47 Cb 0.65 0.00 0.03 0.00 -1.01 0.00 0.00 31.44 31.12 1by6 n GLU 47 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 1by6 n LYS 48 N -1.25 0.91 -0.33 3.49 3.00 -1.26 -4.99 118.16 117.72 1by6 n LYS 48 Ca 0.00 -2.39 0.13 0.00 -0.00 0.00 0.00 58.31 56.05 1by6 n LYS 48 Cb 0.00 -1.31 0.26 0.00 0.00 0.00 0.00 35.03 33.98 1by6 n LYS 48 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 1by6 h LEU 49 N 3.36 -0.50 -9.06 3.14 7.12 -2.04 -3.38 115.31 113.95 1by6 h LEU 49 Ca -0.04 0.27 -0.68 0.00 0.13 0.00 0.00 57.88 57.56 1by6 h LEU 49 Cb 1.02 0.48 -0.20 0.00 -0.53 0.00 0.00 40.66 41.44 1by6 h LEU 49 CO 0.31 -0.33 -0.77 -0.60 -0.13 0.00 0.00 178.44 176.91 1by6 s ARG 50 N -6.04 2.20 0.00 1.25 3.00 -1.26 -4.97 118.95 113.13 1by6 s ARG 50 Ca -0.13 -0.92 0.00 0.00 -1.00 0.00 0.00 55.73 53.67 1by6 s ARG 50 Cb 0.28 -2.28 0.00 0.00 0.00 0.00 0.00 34.95 32.95 1by6 s ARG 50 CO 0.78 0.55 0.00 -3.47 0.00 0.00 0.00 175.30 173.16 1by6 n ASP 51 N 1.43 0.00 -0.05 -2.12 2.03 -1.26 -4.76 116.55 111.82 1by6 n ASP 51 Ca -0.16 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.03 1by6 n ASP 51 Cb 0.52 0.03 -0.06 0.00 -0.72 0.00 0.00 41.12 40.89 1by6 n ASP 51 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1by6 h LEU 52 N 0.00 -1.42 -0.44 -2.67 6.46 -1.95 -1.55 115.31 113.73 1by6 h LEU 52 Ca 0.00 0.19 -0.16 0.00 -0.12 0.00 0.00 57.88 57.80 1by6 h LEU 52 Cb 0.00 0.59 -0.01 0.00 -0.73 0.00 0.00 40.66 40.51 1by6 h LEU 52 CO 0.00 -0.41 -0.38 0.22 -0.62 0.00 0.00 178.44 177.24 1by6 h TYR 53 N -0.45 1.05 -1.12 1.25 5.03 -1.93 -2.96 116.97 117.84 1by6 h TYR 53 Ca 0.09 -0.31 0.31 0.00 2.58 0.00 0.00 58.73 61.40 1by6 h TYR 53 Cb 0.62 -0.22 -0.09 0.00 1.55 0.00 0.00 36.73 38.59 1by6 h TYR 53 CO -0.55 1.12 0.74 0.77 -1.32 0.00 0.00 178.16 178.92 1by6 h SER 54 N 0.72 0.30 0.00 -2.11 0.02 -1.63 -3.26 113.55 107.60 1by6 h SER 54 Ca 0.06 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1by6 h SER 54 Cb 0.96 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.53 1by6 h SER 54 CO 0.09 0.03 0.00 1.17 -1.14 0.00 0.00 176.83 176.98 1by6 n LYS 55 N -4.52 0.00 0.00 3.45 0.00 -0.67 -5.07 118.16 111.35 1by6 n LYS 55 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.58 1by6 n LYS 55 Cb 1.05 -0.19 0.00 0.00 0.00 0.00 0.00 35.03 35.89 1by6 n LYS 55 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1by6 n SER 56 N -0.34 0.00 0.10 3.14 3.41 -1.19 -5.10 113.62 113.64 1by6 n SER 56 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1by6 n SER 56 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1by6 n SER 56 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1by6 n THR 57 N -0.03 0.00 -1.22 6.66 -1.04 -1.26 -4.93 114.28 112.45 1by6 n THR 57 Ca 0.00 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.80 1by6 n THR 57 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 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 -2.89 5.94 0.00 2.41 0.00 -1.26 -4.02 120.51 120.70 1by6 n ALA 58 Ca 0.00 -2.40 0.00 0.00 0.00 0.00 0.00 53.44 51.04 1by6 n ALA 58 Cb 0.00 -1.88 0.00 0.00 0.00 0.00 0.00 19.45 17.57 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 0.86 0.01 -0.07 0.00 0.00 -1.26 -4.90 120.51 115.16 1by6 n ALA 59 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1by6 n ALA 59 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 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 -1.08 0.00 0.00 0.00 0.00 -1.26 -4.62 117.12 110.16 1by6 n MET 60 Ca 0.00 0.82 0.00 0.00 0.00 0.00 0.00 57.70 58.52 1by6 n MET 60 Cb 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 33.22 31.75 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 -2.58 0.00 -4.63 6.12 7.64 -1.26 -4.92 113.62 113.98 1by6 n SER 61 Ca 0.00 0.00 -0.51 0.00 1.01 0.00 0.00 58.87 59.37 1by6 n SER 61 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 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 0.00 0.10 -0.04 0.44 -1.04 -1.26 -4.85 114.28 107.62 1by6 n THR 62 Ca 0.00 -0.02 -0.03 0.00 -2.04 0.00 0.00 64.05 61.96 1by6 n THR 62 Cb 0.00 -1.12 -0.08 0.00 -1.82 0.00 0.00 70.33 67.31 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 3.52 0.00 0.00 -1.42 4.19 -1.26 -4.07 117.16 118.11 1by6 n TYR 63 Ca 0.20 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.41 1by6 n TYR 63 Cb 0.21 -0.43 0.00 0.00 0.49 0.00 0.00 39.34 39.61 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 -2.27 0.00 -3.96 2.97 -1.04 -1.26 -4.30 114.28 104.43 1by6 n THR 64 Ca -0.13 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.48 1by6 n THR 64 Cb 0.72 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 69.25 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 -1.95 -0.80 2.72 3.41 0.00 -1.26 -4.90 105.19 102.41 1by6 n GLY 65 Ca 0.00 0.35 -0.06 0.00 0.00 0.00 0.00 46.02 46.31 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 -4.70 0.00 -3.82 -0.61 3.06 -1.26 -5.07 119.36 106.96 1by6 n ILE 66 Ca -0.13 -1.04 -0.30 0.00 -2.50 0.00 0.00 62.75 58.78 1by6 n ILE 66 Cb 0.59 1.21 -0.15 0.00 0.54 0.00 0.00 39.64 41.83 1by6 n ILE 66 CO 0.00 0.00 0.00 0.72 -2.50 0.00 0.00 176.55 174.77 1by6 s PHE 67 N 0.58 2.38 -0.95 9.51 -0.71 -1.26 -4.82 117.98 122.70 1by6 s PHE 67 Ca 0.29 -2.24 -0.05 0.00 -1.04 0.00 0.00 56.93 53.89 1by6 s PHE 67 Cb 0.18 -2.12 -0.06 0.00 -1.21 0.00 0.00 43.02 39.81 1by6 s PHE 67 CO -0.16 -0.88 0.83 2.41 -1.34 0.00 0.00 175.22 176.09 1by6 n THR 68 N 4.45 -8.34 -0.62 -4.49 -1.04 -1.26 -4.77 114.28 98.22 1by6 n THR 68 Ca 0.01 -1.20 0.47 0.00 -2.04 0.00 0.00 64.05 61.29 1by6 n THR 68 Cb 0.41 -6.16 0.73 0.00 -1.82 0.00 0.00 70.33 63.49 1by6 n THR 68 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1by6 n ASP 69 N -3.06 0.03 -0.22 8.00 8.00 -1.26 -1.06 116.55 126.98 1by6 n ASP 69 Ca -0.07 0.96 0.29 0.00 0.71 0.00 0.00 54.79 56.69 1by6 n ASP 69 Cb 0.61 -0.48 0.50 0.00 -0.02 0.00 0.00 41.12 41.74 1by6 n ASP 69 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 1by6 h GLN 70 N 0.00 0.00 0.00 -1.24 5.75 -2.02 0.95 115.11 118.55 1by6 h GLN 70 Ca 0.85 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 59.35 1by6 h GLN 70 Cb 3.32 0.00 0.00 0.00 1.07 0.00 0.00 27.48 31.87 1by6 h GLN 70 CO -0.08 0.00 0.00 0.28 -2.65 0.00 0.00 178.83 176.38 1by6 n VAL 71 N -3.36 0.28 -0.06 2.39 0.31 -0.23 -2.71 118.33 114.95 1by6 n VAL 71 Ca 0.23 0.07 -0.04 0.00 -0.01 0.00 0.00 64.34 64.59 1by6 n VAL 71 Cb 1.47 -0.81 -0.16 0.00 -0.91 0.00 0.00 33.84 33.43 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 -1.14 0.11 -0.17 7.52 7.94 0.33 -4.17 117.00 127.41 1by6 n LEU 72 Ca 0.10 0.05 0.15 0.00 -1.11 0.00 0.00 56.01 55.19 1by6 n LEU 72 Cb 0.09 0.33 0.68 0.00 0.53 0.00 0.00 43.42 45.05 1by6 n LEU 72 CO 0.11 0.35 0.93 -1.54 -1.11 0.00 0.00 177.39 176.12 1by6 n SER 73 N -2.66 0.59 -2.56 1.96 3.41 -1.10 -3.85 113.62 109.41 1by6 n SER 73 Ca -0.23 -0.90 -0.22 0.00 -0.26 0.00 0.00 58.87 57.25 1by6 n SER 73 Cb 0.99 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.91 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 -0.70 2.03 -0.32 -3.33 0.31 -1.23 -4.89 118.33 110.19 1by6 n VAL 74 Ca 0.18 -4.51 0.18 0.00 -0.01 0.00 0.00 64.34 60.18 1by6 n VAL 74 Cb 0.25 -0.79 0.36 0.00 -0.91 0.00 0.00 33.84 32.76 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 2.71 0.07 0.00 7.52 7.12 -1.76 -3.44 115.31 127.52 1by6 h LEU 75 Ca 0.19 0.22 0.00 0.00 0.13 0.00 0.00 57.88 58.42 1by6 h LEU 75 Cb 0.96 0.28 0.00 0.00 -0.53 0.00 0.00 40.66 41.37 1by6 h LEU 75 CO 0.76 -0.22 0.00 0.29 -0.13 0.00 0.00 178.44 179.14 1by6 n LYS 76 N -5.24 0.00 0.00 1.25 5.02 -1.26 -5.07 118.16 112.87 1by6 n LYS 76 Ca 0.26 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.55 1by6 n LYS 76 Cb 0.83 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.84 1by6 n LYS 76 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1by6 n GLY 77 N -0.27 0.63 1.36 0.72 0.00 -1.26 -3.43 105.19 102.93 1by6 n GLY 77 Ca 0.00 0.81 -0.01 0.00 0.00 0.00 0.00 46.02 46.82 1by6 n GLY 77 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1by6 n GLU 78 N 0.00 0.20 0.00 1.61 0.28 -1.26 -5.09 120.64 116.38 1by6 n GLU 78 Ca 0.00 -0.25 0.00 0.00 -0.16 0.00 0.00 57.16 56.75 1by6 n GLU 78 Cb 0.00 0.23 0.00 0.00 1.43 0.00 0.00 31.44 33.10 1by6 n GLU 78 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06