#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 0.00 -0.23 2.03 0.24 -1.26 -5.18 118.33 113.94 1h7d n VAL 2 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1h7d n VAL 2 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1h7d n VAL 2 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1h7d n ALA 3 N -3.00 0.00 -3.18 2.33 0.00 -1.26 -5.12 120.51 110.28 1h7d n ALA 3 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 1h7d n ALA 3 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1h7d n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h7d s ALA 4 N -1.06 -0.29 0.43 0.00 0.00 -1.26 -4.95 121.76 114.63 1h7d s ALA 4 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 51.96 50.60 1h7d s ALA 4 Cb 0.00 -2.10 0.00 0.00 0.00 0.00 0.00 23.12 21.02 1h7d s ALA 4 CO 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 175.76 173.65 1h7d n ALA 5 N 3.29 0.76 -3.83 0.00 0.00 -1.26 -5.07 120.51 114.40 1h7d n ALA 5 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.27 1h7d n ALA 5 Cb 0.50 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.98 1h7d n ALA 5 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1h7d n MET 6 N -3.46 -0.84 -2.43 0.00 2.00 -1.26 -3.78 117.12 107.34 1h7d n MET 6 Ca 0.00 0.31 -0.01 0.00 0.00 0.00 0.00 57.70 58.00 1h7d n MET 6 Cb 0.00 -3.51 0.00 0.00 0.00 0.00 0.00 33.22 29.71 1h7d n MET 6 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1h7d n LEU 7 N -4.51 -6.52 -2.79 4.03 4.77 -1.26 -5.02 117.00 105.70 1h7d n LEU 7 Ca -0.10 0.94 -0.10 0.00 -0.03 0.00 0.00 56.01 56.72 1h7d n LEU 7 Cb 0.58 -2.78 0.07 0.00 -2.33 0.00 0.00 43.42 38.96 1h7d n LEU 7 CO 0.70 -2.29 0.23 -0.11 -1.33 0.00 0.00 177.39 174.59 1h7d n LEU 8 N 0.35 -1.10 -1.63 2.23 -0.00 -1.25 -4.92 117.00 110.68 1h7d n LEU 8 Ca 0.02 -3.85 -0.01 0.00 -0.00 0.00 0.00 56.01 52.17 1h7d n LEU 8 Cb 0.07 0.53 0.03 0.00 -0.00 0.00 0.00 43.42 44.05 1h7d n LEU 8 CO 0.34 1.98 0.32 -2.11 -0.00 0.00 0.00 177.39 177.92 1h7d n ARG 9 N -0.03 0.34 -2.63 1.96 0.00 -1.26 -5.00 116.66 110.03 1h7d n ARG 9 Ca 0.07 -0.36 -0.05 0.00 -0.00 0.00 0.00 57.85 57.51 1h7d n ARG 9 Cb 0.76 0.20 0.07 0.00 -0.00 0.00 0.00 32.46 33.49 1h7d n ARG 9 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1h7d n SER 10 N -0.39 -1.53 -4.76 2.89 2.88 -1.26 -5.15 113.62 106.30 1h7d n SER 10 Ca -0.06 -2.11 -0.35 0.00 -1.33 0.00 0.00 58.87 55.02 1h7d n SER 10 Cb 0.57 0.94 0.02 0.00 -0.75 0.00 0.00 64.21 65.00 1h7d n SER 10 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h7d h PRO 12 N 0.93 -0.14 -4.02 0.00 0.13 -2.05 -3.47 132.00 123.39 1h7d h PRO 12 Ca -0.50 0.01 -0.40 0.00 -0.87 0.00 0.00 66.00 64.24 1h7d h PRO 12 Cb 1.28 0.03 0.04 0.00 0.13 0.00 0.00 31.00 32.48 1h7d h PRO 12 CO 0.56 -0.09 -0.57 0.28 -0.23 0.00 0.00 178.00 177.94 1h7d n VAL 13 N -3.23 -1.75 0.19 1.56 0.31 -1.26 -4.84 118.33 109.31 1h7d n VAL 13 Ca -0.02 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.36 1h7d n VAL 13 Cb 0.06 -3.31 0.21 0.00 -0.91 0.00 0.00 33.84 29.89 1h7d n VAL 13 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1h7d n LEU 14 N -3.69 3.17 -2.92 7.52 4.77 -1.26 -4.59 117.00 120.00 1h7d n LEU 14 Ca -0.14 -1.60 -0.25 0.00 -0.03 0.00 0.00 56.01 53.99 1h7d n LEU 14 Cb 0.63 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 41.17 1h7d n LEU 14 CO 0.42 0.50 2.52 -0.24 -1.33 0.00 0.00 177.39 179.26 1h7d n SER 15 N 0.49 6.32 -0.84 -1.43 2.88 -1.26 -3.17 113.62 116.61 1h7d n SER 15 Ca 0.15 -2.42 -0.04 0.00 -1.33 0.00 0.00 58.87 55.24 1h7d n SER 15 Cb 0.63 -1.30 -0.04 0.00 -0.75 0.00 0.00 64.21 62.75 1h7d n SER 15 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1h7d n GLN 16 N 3.49 0.00 0.00 -1.46 7.27 -1.26 -5.01 117.38 120.41 1h7d n GLN 16 Ca 0.56 -0.70 0.00 0.00 0.07 0.00 0.00 57.00 56.93 1h7d n GLN 16 Cb 0.35 0.29 0.00 0.00 2.41 0.00 0.00 30.24 33.28 1h7d n GLN 16 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1h7d n GLY 17 N 0.02 -0.41 0.00 1.69 0.00 -1.19 -5.03 105.19 100.27 1h7d n GLY 17 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1h7d n GLY 17 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1h7d n PRO 18 N -2.20 -0.46 0.08 1.61 -0.04 -1.26 -5.06 135.00 127.66 1h7d n PRO 18 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1h7d n PRO 18 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1h7d n PRO 18 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1h7d n THR 19 N -2.20 0.08 -1.29 0.52 -2.24 -1.26 -5.13 114.28 102.76 1h7d n THR 19 Ca 0.00 0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1h7d n THR 19 Cb 0.00 -0.62 0.00 0.00 -2.10 0.00 0.00 70.33 67.61 1h7d n THR 19 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h7d n GLY 20 N 1.70 -2.16 1.79 3.38 0.00 -1.26 -5.08 105.19 103.55 1h7d n GLY 20 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.06 0.00 0.00 0.99 4.77 -1.26 -5.03 117.00 116.41 1h7d n LEU 21 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1h7d n LEU 21 Cb 0.00 0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1h7d n LEU 21 CO 0.00 -0.45 0.00 -0.11 -1.33 0.00 0.00 177.39 175.50 1h7d n LEU 22 N -2.34 0.00 0.19 2.23 0.00 -1.26 -4.37 117.00 111.45 1h7d n LEU 22 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 56.01 56.06 1h7d n LEU 22 Cb 0.00 0.00 0.51 0.00 0.00 0.00 0.00 43.42 43.93 1h7d n LEU 22 CO 0.00 0.00 0.96 1.23 0.00 0.00 0.00 177.39 179.58 1h7d h GLY 23 N 0.00 0.10 2.00 -3.96 0.00 -1.99 0.23 103.07 99.45 1h7d h GLY 23 Ca 0.00 -0.05 -0.06 0.00 0.00 0.00 0.00 47.33 47.22 1h7d h GLY 23 CO 0.00 0.05 -0.29 1.70 0.00 0.00 0.00 176.54 177.99 1h7d h LYS 24 N 0.09 0.00 0.00 4.80 3.64 -1.99 -2.54 116.57 120.58 1h7d h LYS 24 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1h7d h LYS 24 Cb 0.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1h7d h LYS 24 CO 0.01 0.29 -0.97 0.28 -2.27 0.00 0.00 179.45 176.79 1h7d n VAL 25 N -3.38 0.29 0.16 2.00 0.31 -0.14 -3.91 118.33 113.67 1h7d n VAL 25 Ca 0.00 -0.32 -0.11 0.00 -0.01 0.00 0.00 64.34 63.91 1h7d n VAL 25 Cb 0.50 0.01 -0.06 0.00 -0.91 0.00 0.00 33.84 33.38 1h7d n VAL 25 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1h7d h ALA 26 N 2.40 -0.48 -0.68 3.52 0.00 -0.21 -2.24 119.26 121.57 1h7d h ALA 26 Ca 0.00 -0.17 0.20 0.00 0.00 0.00 0.00 54.91 54.94 1h7d h ALA 26 Cb 0.80 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 1h7d h ALA 26 CO 0.00 -0.50 0.54 1.57 0.00 0.00 0.00 179.25 180.86 1h7d h LYS 27 N -1.02 0.00 -0.10 0.00 2.10 -1.68 0.23 116.57 116.10 1h7d h LYS 27 Ca -0.05 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.57 1h7d h LYS 27 Cb 0.50 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.83 1h7d h LYS 27 CO 0.08 0.00 -0.06 1.15 -2.00 0.00 0.00 179.45 178.62 1h7d h THR 28 N 0.00 1.33 -0.67 0.07 2.02 -1.65 -3.08 112.91 110.94 1h7d h THR 28 Ca 0.32 -1.12 -0.06 0.00 0.77 0.00 0.00 66.41 66.31 1h7d h THR 28 Cb 1.40 1.86 -0.03 0.00 -1.74 0.00 0.00 68.15 69.64 1h7d h THR 28 CO -0.00 0.32 0.16 0.22 0.37 0.00 0.00 175.52 176.59 1h7d h TYR 29 N -0.15 1.12 0.00 3.16 5.03 -0.03 0.77 116.97 126.86 1h7d h TYR 29 Ca 0.02 -0.13 0.00 0.00 2.58 0.00 0.00 58.73 61.20 1h7d h TYR 29 Cb 0.54 -0.32 0.00 0.00 1.55 0.00 0.00 36.73 38.50 1h7d h TYR 29 CO 0.07 0.92 0.14 0.37 -1.32 0.00 0.00 178.16 178.34 1h7d h GLN 30 N 0.99 0.00 0.00 1.82 5.75 -0.94 0.20 115.11 122.93 1h7d h GLN 30 Ca 0.21 0.00 -0.21 0.00 -0.15 0.00 0.00 58.65 58.50 1h7d h GLN 30 Cb 0.36 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.88 1h7d h GLN 30 CO 0.00 0.00 -1.79 0.34 -2.65 0.00 0.00 178.83 174.74 1h7d n PHE 31 N -2.61 0.00 0.03 3.99 7.35 -0.66 -4.61 117.46 120.95 1h7d n PHE 31 Ca -0.02 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.55 1h7d n PHE 31 Cb 0.19 -0.54 -0.07 0.00 0.35 0.00 0.00 39.48 39.41 1h7d n PHE 31 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 1h7d h LEU 32 N 0.00 0.00 -0.90 -2.13 5.85 0.13 -1.19 115.31 117.07 1h7d h LEU 32 Ca -0.31 -0.05 0.20 0.00 0.84 0.00 0.00 57.88 58.56 1h7d h LEU 32 Cb 1.51 -0.00 -0.17 0.00 0.37 0.00 0.00 40.66 42.37 1h7d h LEU 32 CO -0.04 0.05 -0.17 0.33 -0.34 0.00 0.00 178.44 178.28 1h7d n PHE 33 N -5.06 0.38 -3.39 1.25 -0.00 0.63 -3.12 117.46 108.14 1h7d n PHE 33 Ca -0.07 1.10 -0.27 0.00 -0.00 0.00 0.00 57.45 58.21 1h7d n PHE 33 Cb 0.05 -1.06 -0.10 0.00 -0.00 0.00 0.00 39.48 38.37 1h7d n PHE 33 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.76 175.64 1h7d s SER 34 N -5.18 1.74 0.00 -2.13 0.01 -1.05 -5.06 113.70 102.04 1h7d s SER 34 Ca -0.13 -2.74 0.00 0.00 1.31 0.00 0.00 55.95 54.39 1h7d s SER 34 Cb 0.25 -0.32 0.00 0.00 0.21 0.00 0.00 66.02 66.16 1h7d s SER 34 CO 0.70 -0.21 0.00 -0.38 0.41 0.00 0.00 173.24 173.77 1h7d n ILE 35 N 3.22 0.00 -4.14 1.44 5.41 -0.47 -4.85 119.36 119.98 1h7d n ILE 35 Ca 0.24 0.19 -0.12 0.00 1.00 0.00 0.00 62.75 64.06 1h7d n ILE 35 Cb 0.45 -0.96 -0.11 0.00 -0.71 0.00 0.00 39.64 38.31 1h7d n ILE 35 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1h7d s GLY 36 N 0.00 0.70 -0.06 7.39 0.00 -1.26 -5.04 107.32 109.04 1h7d s GLY 36 Ca 0.00 -1.14 0.07 0.00 0.00 0.00 0.00 44.72 43.65 1h7d s GLY 36 CO 0.00 -1.23 0.07 0.54 0.00 0.00 0.00 173.10 172.48 1h7d n ARG 37 N 0.51 2.10 -1.15 2.90 1.74 -1.26 -5.13 116.66 116.37 1h7d n ARG 37 Ca -0.16 -0.02 0.01 0.00 -0.77 0.00 0.00 57.85 56.91 1h7d n ARG 37 Cb 0.58 -1.20 -0.00 0.00 -1.02 0.00 0.00 32.46 30.82 1h7d n ARG 37 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1h7d n PRO 39 N -2.42 0.00 0.00 0.00 -0.04 -1.26 -4.84 135.00 126.44 1h7d n PRO 39 Ca -0.00 0.41 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 1h7d n PRO 39 Cb 0.37 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 32.79 1h7d n PRO 39 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1h7d n ILE 40 N -1.72 0.00 -2.53 0.52 5.41 -1.26 -3.56 119.36 116.22 1h7d n ILE 40 Ca 0.00 0.00 -0.19 0.00 1.00 0.00 0.00 62.75 63.56 1h7d n ILE 40 Cb 0.00 0.00 0.02 0.00 -0.71 0.00 0.00 39.64 38.95 1h7d n ILE 40 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1h7d n LEU 41 N 0.00 3.36 -0.07 1.39 4.77 -1.26 -3.48 117.00 121.72 1h7d n LEU 41 Ca 0.00 -4.52 -0.06 0.00 -0.03 0.00 0.00 56.01 51.40 1h7d n LEU 41 Cb 0.00 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 1h7d n LEU 41 CO 0.00 1.92 -0.48 0.00 -1.33 0.00 0.00 177.39 177.50 1h7d n ALA 42 N -0.35 0.62 -2.98 -1.18 0.00 -1.23 -4.89 120.51 110.49 1h7d n ALA 42 Ca 0.27 -0.64 -0.15 0.00 0.00 0.00 0.00 53.44 52.92 1h7d n ALA 42 Cb 0.75 0.02 0.00 0.00 0.00 0.00 0.00 19.45 20.22 1h7d n ALA 42 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1h7d n THR 43 N -3.97 -0.25 0.04 0.00 -1.04 -1.26 -4.93 114.28 102.86 1h7d n THR 43 Ca -0.10 -2.99 0.00 0.00 -2.04 0.00 0.00 64.05 58.92 1h7d n THR 43 Cb 0.37 0.04 0.00 0.00 -1.82 0.00 0.00 70.33 68.92 1h7d n THR 43 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 1h7d n GLN 44 N 0.99 0.00 -0.11 -2.82 0.00 -1.26 -5.01 117.38 109.17 1h7d n GLN 44 Ca 0.16 0.00 -0.04 0.00 -0.00 0.00 0.00 57.00 57.12 1h7d n GLN 44 Cb 0.62 0.00 -0.03 0.00 0.00 0.00 0.00 30.24 30.83 1h7d n GLN 44 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.06 177.84 1h7d h GLY 45 N 0.00 -1.91 -3.11 1.69 0.00 -1.90 -3.40 103.07 94.43 1h7d h GLY 45 Ca 0.00 0.95 -0.49 0.00 0.00 0.00 0.00 47.33 47.79 1h7d h GLY 45 CO 0.00 -0.62 0.43 2.56 0.00 0.00 0.00 176.54 178.91 1h7d s PRO 46 N -3.88 4.33 1.02 4.80 0.04 -1.26 -5.01 135.00 135.03 1h7d s PRO 46 Ca -0.04 1.60 -0.12 0.00 0.04 0.00 0.00 61.00 62.48 1h7d s PRO 46 Cb 0.03 -2.76 0.17 0.00 0.04 0.00 0.00 34.50 31.99 1h7d s PRO 46 CO 0.21 -0.02 0.92 0.25 0.04 0.00 0.00 177.00 178.40 1h7d n THR 47 N 0.36 0.00 -2.59 1.26 -2.24 -1.26 -4.95 114.28 104.86 1h7d n THR 47 Ca 0.03 -0.18 -0.35 0.00 -2.27 0.00 0.00 64.05 61.28 1h7d n THR 47 Cb 0.48 -0.91 -0.04 0.00 -2.10 0.00 0.00 70.33 67.75 1h7d n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50