#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h7d n VAL 2 N 0.00 4.78 -2.75 2.03 0.31 -1.26 -4.76 118.33 116.69 1h7d n VAL 2 Ca 0.00 -5.79 -0.05 0.00 -0.01 0.00 0.00 64.34 58.48 1h7d n VAL 2 Cb 0.00 -2.10 0.03 0.00 -0.91 0.00 0.00 33.84 30.85 1h7d n VAL 2 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1h7d n ALA 3 N 1.29 -1.79 -3.14 3.52 0.00 -1.26 -5.04 120.51 114.09 1h7d n ALA 3 Ca 0.27 -1.12 -0.31 0.00 0.00 0.00 0.00 53.44 52.28 1h7d n ALA 3 Cb 0.35 -1.50 -0.04 0.00 0.00 0.00 0.00 19.45 18.25 1h7d n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h7d n ALA 4 N 2.46 4.62 -2.92 0.00 0.00 -1.26 -4.87 120.51 118.55 1h7d n ALA 4 Ca 0.15 -4.75 0.04 0.00 0.00 0.00 0.00 53.44 48.88 1h7d n ALA 4 Cb 0.59 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.84 1h7d n ALA 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h7d s ALA 5 N -3.00 -4.67 -0.25 0.00 0.00 -1.26 -5.03 121.76 107.56 1h7d s ALA 5 Ca 0.41 1.47 -0.00 0.00 0.00 0.00 0.00 51.96 53.83 1h7d s ALA 5 Cb 0.17 -2.99 0.19 0.00 0.00 0.00 0.00 23.12 20.49 1h7d s ALA 5 CO -0.04 -2.36 1.93 -1.33 0.00 0.00 0.00 175.76 173.97 1h7d n MET 6 N 4.31 1.64 -0.07 0.00 2.81 -1.26 -4.24 117.12 120.30 1h7d n MET 6 Ca 0.08 -1.27 -0.06 0.00 -1.81 0.00 0.00 57.70 54.64 1h7d n MET 6 Cb 0.62 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.60 1h7d n MET 6 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1h7d h LEU 7 N 2.40 0.00 -2.64 4.03 3.38 -2.01 -3.50 115.31 116.97 1h7d h LEU 7 Ca 0.24 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1h7d h LEU 7 Cb 1.03 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.80 1h7d h LEU 7 CO 0.60 0.76 -0.07 0.18 0.09 0.00 0.00 178.44 180.01 1h7d n LEU 8 N -4.66 -4.69 0.00 1.67 4.77 -1.26 -4.96 117.00 107.88 1h7d n LEU 8 Ca -0.08 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 1h7d n LEU 8 Cb 0.23 -2.31 0.00 0.00 -2.33 0.00 0.00 43.42 39.02 1h7d n LEU 8 CO 0.10 -0.56 0.00 -2.11 -1.33 0.00 0.00 177.39 173.49 1h7d n ARG 9 N -1.59 0.00 -3.89 3.23 1.85 -1.26 -5.04 116.66 109.96 1h7d n ARG 9 Ca -0.01 0.00 -0.28 0.00 -1.00 0.00 0.00 57.85 56.57 1h7d n ARG 9 Cb 0.51 -0.03 0.02 0.00 -1.05 0.00 0.00 32.46 31.91 1h7d n ARG 9 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1h7d n SER 10 N -1.96 -2.93 -3.02 2.89 2.88 -1.26 -3.34 113.62 106.88 1h7d n SER 10 Ca 0.00 -0.85 -0.00 0.00 -1.33 0.00 0.00 58.87 56.69 1h7d n SER 10 Cb 0.00 -3.70 -0.00 0.00 -0.75 0.00 0.00 64.21 59.76 1h7d n SER 10 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h7d s PRO 12 N -1.16 3.20 -0.07 0.00 0.04 -1.21 -4.62 135.00 131.18 1h7d s PRO 12 Ca -0.01 -1.33 0.09 0.00 0.04 0.00 0.00 61.00 59.79 1h7d s PRO 12 Cb 0.00 -5.34 -0.24 0.00 0.04 0.00 0.00 34.50 28.96 1h7d s PRO 12 CO 0.28 -3.01 0.55 1.55 0.04 0.00 0.00 177.00 176.41 1h7d n VAL 13 N 7.17 1.63 -2.67 -0.36 3.14 -1.26 -4.99 118.33 120.99 1h7d n VAL 13 Ca 0.44 -0.77 -0.08 0.00 -2.96 0.00 0.00 64.34 60.96 1h7d n VAL 13 Cb 0.47 -1.14 0.04 0.00 -1.06 0.00 0.00 33.84 32.16 1h7d n VAL 13 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1h7d n LEU 14 N -3.11 -3.15 -3.66 6.55 7.99 -1.26 -1.22 117.00 119.14 1h7d n LEU 14 Ca -0.21 -0.32 -0.28 0.00 -0.01 0.00 0.00 56.01 55.19 1h7d n LEU 14 Cb 1.06 -1.83 0.01 0.00 -0.11 0.00 0.00 43.42 42.55 1h7d n LEU 14 CO 0.44 0.17 -0.23 -1.54 -1.51 0.00 0.00 177.39 174.72 1h7d n SER 15 N -2.12 -5.21 -2.33 -1.43 3.41 -1.26 -3.88 113.62 100.80 1h7d n SER 15 Ca -0.13 -0.66 -0.05 0.00 -0.26 0.00 0.00 58.87 57.78 1h7d n SER 15 Cb 0.58 -1.86 0.01 0.00 -0.26 0.00 0.00 64.21 62.67 1h7d n SER 15 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1h7d n GLN 16 N -1.79 -1.53 -0.02 4.33 3.00 -1.25 -5.03 117.38 115.09 1h7d n GLN 16 Ca -0.23 1.54 -0.01 0.00 -0.01 0.00 0.00 57.00 58.29 1h7d n GLN 16 Cb 0.68 -4.06 -0.00 0.00 0.00 0.00 0.00 30.24 26.86 1h7d n GLN 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1h7d n GLY 17 N -0.31 -0.64 3.66 1.08 0.00 -0.35 -4.34 105.19 104.29 1h7d n GLY 17 Ca 0.07 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 1h7d n GLY 17 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h7d s PRO 18 N -1.35 4.25 0.00 1.61 0.04 -1.26 -3.88 135.00 134.40 1h7d s PRO 18 Ca -0.04 1.68 0.00 0.00 0.04 0.00 0.00 61.00 62.67 1h7d s PRO 18 Cb 0.01 -3.74 0.00 0.00 0.04 0.00 0.00 34.50 30.81 1h7d s PRO 18 CO 0.06 -0.67 0.00 2.41 0.04 0.00 0.00 177.00 178.84 1h7d n THR 19 N 5.26 0.00 -3.72 1.26 -1.04 -1.26 -4.68 114.28 110.10 1h7d n THR 19 Ca 0.14 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.87 1h7d n THR 19 Cb 0.45 0.00 0.01 0.00 -1.82 0.00 0.00 70.33 68.97 1h7d n THR 19 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1h7d n GLY 20 N 0.00 -1.14 3.61 3.41 0.00 -1.25 -2.72 105.19 107.10 1h7d n GLY 20 Ca 0.00 0.50 -0.28 0.00 0.00 0.00 0.00 46.02 46.24 1h7d n GLY 20 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1h7d n LEU 21 N -3.35 -2.65 0.03 0.99 4.77 -1.26 -4.93 117.00 110.60 1h7d n LEU 21 Ca -0.18 -0.57 -0.01 0.00 -0.03 0.00 0.00 56.01 55.21 1h7d n LEU 21 Cb 0.62 -1.80 -0.00 0.00 -2.33 0.00 0.00 43.42 39.91 1h7d n LEU 21 CO 0.65 0.04 -0.12 -0.11 -1.33 0.00 0.00 177.39 176.52 1h7d n LEU 22 N -1.63 1.15 0.10 2.23 7.94 -1.10 -4.55 117.00 121.14 1h7d n LEU 22 Ca -0.20 0.15 0.04 0.00 -1.11 0.00 0.00 56.01 54.89 1h7d n LEU 22 Cb 0.67 -0.37 0.46 0.00 0.53 0.00 0.00 43.42 44.72 1h7d n LEU 22 CO 0.60 -0.64 1.05 1.23 -1.11 0.00 0.00 177.39 178.51 1h7d h GLY 23 N -0.12 0.34 2.00 -3.96 0.00 -1.87 0.30 103.07 99.76 1h7d h GLY 23 Ca -0.01 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.17 1h7d h GLY 23 CO -0.00 0.15 0.00 0.50 0.00 0.00 0.00 176.54 177.18 1h7d h LYS 24 N 0.32 0.00 0.00 4.80 1.57 -1.97 -0.41 116.57 120.88 1h7d h LYS 24 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1h7d h LYS 24 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1h7d h LYS 24 CO -0.01 0.00 -0.70 0.28 -0.57 0.00 0.00 179.45 178.46 1h7d n VAL 25 N -2.32 0.00 -2.52 0.50 0.31 0.43 -3.78 118.33 110.95 1h7d n VAL 25 Ca 0.02 -0.21 -0.17 0.00 -0.01 0.00 0.00 64.34 63.97 1h7d n VAL 25 Cb 0.23 0.92 0.02 0.00 -0.91 0.00 0.00 33.84 34.10 1h7d n VAL 25 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1h7d n ALA 26 N -1.36 4.20 0.00 3.52 0.00 0.76 -4.67 120.51 122.95 1h7d n ALA 26 Ca 0.02 -3.66 0.00 0.00 0.00 0.00 0.00 53.44 49.80 1h7d n ALA 26 Cb 0.21 -0.69 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1h7d n ALA 26 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1h7d n LYS 27 N -0.38 0.00 -0.19 0.00 4.81 -0.25 -4.81 118.16 117.34 1h7d n LYS 27 Ca 0.26 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.64 1h7d n LYS 27 Cb 0.77 0.00 0.11 0.00 0.02 0.00 0.00 35.03 35.93 1h7d n LYS 27 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1h7d h THR 28 N 0.00 1.25 -0.07 3.15 2.02 -1.65 -2.29 112.91 115.33 1h7d h THR 28 Ca 0.00 -0.95 -0.06 0.00 0.77 0.00 0.00 66.41 66.17 1h7d h THR 28 Cb 0.00 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 1h7d h THR 28 CO 0.00 0.36 -0.26 0.22 0.37 0.00 0.00 175.52 176.21 1h7d h TYR 29 N 0.94 0.12 -0.35 3.16 5.03 -1.83 -1.57 116.97 122.48 1h7d h TYR 29 Ca 0.19 -0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.44 1h7d h TYR 29 Cb 0.38 -0.03 -0.03 0.00 1.55 0.00 0.00 36.73 38.59 1h7d h TYR 29 CO 0.03 0.37 0.06 0.94 -1.32 0.00 0.00 178.16 178.23 1h7d n GLN 30 N -4.19 2.84 0.00 1.82 -0.06 -0.88 -3.65 117.38 113.27 1h7d n GLN 30 Ca -0.02 -1.67 0.00 0.00 -2.00 0.00 0.00 57.00 53.32 1h7d n GLN 30 Cb 0.34 -1.86 0.00 0.00 -4.06 0.00 0.00 30.24 24.66 1h7d n GLN 30 CO 0.00 0.00 0.00 0.34 -0.20 0.00 0.00 177.06 177.20 1h7d n PHE 31 N 0.21 0.00 0.19 3.69 -0.00 -0.62 -4.52 117.46 116.40 1h7d n PHE 31 Ca 0.18 0.00 0.05 0.00 -0.00 0.00 0.00 57.45 57.68 1h7d n PHE 31 Cb 0.82 0.00 0.21 0.00 -0.00 0.00 0.00 39.48 40.51 1h7d n PHE 31 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 1h7d n LEU 32 N -2.37 3.18 -0.04 -2.13 7.99 -0.99 -4.02 117.00 118.61 1h7d n LEU 32 Ca 0.00 -1.61 -0.09 0.00 -0.01 0.00 0.00 56.01 54.30 1h7d n LEU 32 Cb 0.44 -0.50 -0.03 0.00 -0.11 0.00 0.00 43.42 43.22 1h7d n LEU 32 CO 0.00 0.49 -0.80 0.33 -1.51 0.00 0.00 177.39 175.90 1h7d n PHE 33 N 0.46 0.00 -1.51 -1.77 -0.00 -1.24 -4.75 117.46 108.66 1h7d n PHE 33 Ca 0.15 0.00 -0.40 0.00 -0.00 0.00 0.00 57.45 57.20 1h7d n PHE 33 Cb 0.64 -0.31 -0.02 0.00 -0.00 0.00 0.00 39.48 39.79 1h7d n PHE 33 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1h7d n SER 34 N -3.38 7.82 -3.15 -2.13 3.41 -1.26 -4.49 113.62 110.44 1h7d n SER 34 Ca -0.17 -2.71 0.03 0.00 -0.26 0.00 0.00 58.87 55.76 1h7d n SER 34 Cb 0.62 -1.54 -0.00 0.00 -0.26 0.00 0.00 64.21 63.03 1h7d n SER 34 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1h7d s ILE 35 N 1.76 -0.91 0.00 -1.33 -5.25 -1.26 -5.00 121.20 109.20 1h7d s ILE 35 Ca 0.63 0.00 0.00 0.00 -0.99 0.00 0.00 60.65 60.29 1h7d s ILE 35 Cb 0.17 -0.63 0.00 0.00 2.95 0.00 0.00 42.46 44.95 1h7d s ILE 35 CO -0.07 0.00 0.00 0.61 -1.79 0.00 0.00 174.94 173.69 1h7d n GLY 36 N 5.06 2.14 0.00 6.27 0.00 -1.26 -4.55 105.19 112.85 1h7d n GLY 36 Ca 0.07 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1h7d n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h7d n ARG 37 N 0.00 0.00 -1.17 1.61 1.74 -1.26 -5.14 116.66 112.44 1h7d n ARG 37 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1h7d n ARG 37 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1h7d n ARG 37 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1h7d s PRO 39 N -5.03 4.65 0.00 0.00 0.04 -1.26 -4.72 135.00 128.67 1h7d s PRO 39 Ca 0.00 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.80 1h7d s PRO 39 Cb 0.00 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.36 1h7d s PRO 39 CO 0.00 0.23 0.00 1.51 0.04 0.00 0.00 177.00 178.78 1h7d n ILE 40 N 1.18 0.00 0.04 0.56 0.00 -1.26 -5.00 119.36 114.87 1h7d n ILE 40 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 62.75 62.71 1h7d n ILE 40 Cb 0.45 0.00 -0.01 0.00 0.00 0.00 0.00 39.64 40.08 1h7d n ILE 40 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 1h7d h LEU 41 N 0.00 -0.14 -2.38 9.51 7.12 -1.96 -3.50 115.31 123.95 1h7d h LEU 41 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1h7d h LEU 41 Cb 0.00 0.04 0.00 0.00 -0.53 0.00 0.00 40.66 40.17 1h7d h LEU 41 CO 0.00 0.20 -0.65 0.00 -0.13 0.00 0.00 178.44 177.86 1h7d n ALA 42 N -2.55 -3.28 -0.06 1.25 0.00 -1.26 -4.95 120.51 109.66 1h7d n ALA 42 Ca -0.02 0.51 -0.13 0.00 0.00 0.00 0.00 53.44 53.79 1h7d n ALA 42 Cb 0.07 -1.29 -0.07 0.00 0.00 0.00 0.00 19.45 18.15 1h7d n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h7d h THR 43 N 2.09 1.35 0.00 0.00 1.03 -2.05 -3.41 112.91 111.92 1h7d h THR 43 Ca 0.00 -1.34 -0.01 0.00 -0.01 0.00 0.00 66.41 65.05 1h7d h THR 43 Cb 0.19 1.88 -0.00 0.00 -1.07 0.00 0.00 68.15 69.15 1h7d h THR 43 CO 0.09 0.40 -0.38 0.00 -0.01 0.00 0.00 175.52 175.62 1h7d n GLN 44 N -4.53 0.15 -2.57 0.00 1.13 -1.26 -5.12 117.38 105.19 1h7d n GLN 44 Ca -0.06 0.06 -0.04 0.00 -1.94 0.00 0.00 57.00 55.02 1h7d n GLN 44 Cb 0.38 -0.77 -0.03 0.00 0.11 0.00 0.00 30.24 29.93 1h7d n GLN 44 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1h7d n GLY 45 N 2.88 -4.95 3.65 1.08 0.00 -1.26 -4.88 105.19 101.70 1h7d n GLY 45 Ca -0.05 1.38 -0.43 0.00 0.00 0.00 0.00 46.02 46.92 1h7d n GLY 45 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h7d s PRO 46 N -0.93 4.11 -0.44 1.61 0.04 -1.26 -4.97 135.00 133.17 1h7d s PRO 46 Ca -0.20 1.55 -0.29 0.00 0.04 0.00 0.00 61.00 62.10 1h7d s PRO 46 Cb 0.01 -3.82 0.01 0.00 0.04 0.00 0.00 34.50 30.75 1h7d s PRO 46 CO 0.76 -0.86 1.36 0.99 0.04 0.00 0.00 177.00 179.28 1h7d s THR 47 N 3.86 3.95 0.45 1.26 2.01 -1.26 -4.72 115.64 121.19 1h7d s THR 47 Ca 0.56 0.96 0.00 0.00 0.31 0.00 0.00 61.69 63.52 1h7d s THR 47 Cb -0.21 -4.31 0.00 0.00 0.01 0.00 0.00 72.50 67.99 1h7d s THR 47 CO 0.18 -0.85 0.00 0.00 -0.69 0.00 0.00 174.62 173.26