#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 0.30 -3.65 2.03 0.24 -1.26 -5.05 118.33 110.94 1h7d n VAL 2 Ca 0.00 -4.72 0.01 0.00 -2.04 0.00 0.00 64.34 57.59 1h7d n VAL 2 Cb 0.00 -0.47 -0.06 0.00 -1.47 0.00 0.00 33.84 31.84 1h7d n VAL 2 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1h7d s ALA 3 N -2.55 -2.57 -0.66 2.33 0.00 -1.26 -5.07 121.76 111.98 1h7d s ALA 3 Ca 0.41 1.88 0.05 0.00 0.00 0.00 0.00 51.96 54.30 1h7d s ALA 3 Cb 0.34 -1.95 0.30 0.00 0.00 0.00 0.00 23.12 21.80 1h7d s ALA 3 CO -0.09 -0.25 0.95 0.00 0.00 0.00 0.00 175.76 176.37 1h7d n ALA 4 N 2.61 4.54 0.37 0.00 0.00 -1.26 -4.89 120.51 121.88 1h7d n ALA 4 Ca -0.15 -4.74 -0.17 0.00 0.00 0.00 0.00 53.44 48.38 1h7d n ALA 4 Cb 0.56 -0.98 -0.08 0.00 0.00 0.00 0.00 19.45 18.95 1h7d n ALA 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h7d h ALA 5 N 3.70 -1.22 -4.90 0.00 0.00 -2.05 -3.48 119.26 111.30 1h7d h ALA 5 Ca 0.19 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1h7d h ALA 5 Cb 0.56 0.54 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1h7d h ALA 5 CO 0.88 -1.18 -0.41 -1.33 0.00 0.00 0.00 179.25 177.20 1h7d n MET 6 N -5.07 -1.99 0.00 0.00 0.00 -1.26 -4.98 117.12 103.83 1h7d n MET 6 Ca -0.13 1.86 0.00 0.00 0.00 0.00 0.00 57.70 59.43 1h7d n MET 6 Cb 0.43 -4.99 0.00 0.00 0.00 0.00 0.00 33.22 28.66 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 -0.34 0.00 -3.21 4.03 4.77 -1.26 -5.10 117.00 115.88 1h7d n LEU 7 Ca 0.10 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.92 1h7d n LEU 7 Cb 0.38 0.41 0.02 0.00 -2.33 0.00 0.00 43.42 41.90 1h7d n LEU 7 CO 0.40 -0.41 -0.36 0.18 -1.33 0.00 0.00 177.39 175.87 1h7d n LEU 8 N -2.30 -4.22 0.00 2.23 4.32 -1.26 -4.93 117.00 110.84 1h7d n LEU 8 Ca 0.00 0.34 0.00 0.00 -0.02 0.00 0.00 56.01 56.33 1h7d n LEU 8 Cb 0.00 -2.01 0.00 0.00 -1.62 0.00 0.00 43.42 39.79 1h7d n LEU 8 CO 0.00 -1.23 0.00 0.54 -1.22 0.00 0.00 177.39 175.48 1h7d n ARG 9 N 0.50 0.00 -0.10 3.23 5.12 -1.26 -5.01 116.66 119.13 1h7d n ARG 9 Ca -0.02 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.90 1h7d n ARG 9 Cb 0.50 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.80 1h7d n ARG 9 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1h7d n SER 10 N -2.06 0.00 -2.83 0.55 2.88 -1.26 -4.41 113.62 106.49 1h7d n SER 10 Ca 0.00 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.50 1h7d n SER 10 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 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 2.82 0.00 0.00 0.00 0.13 -2.03 -2.81 132.00 130.11 1h7d h PRO 12 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1h7d h PRO 12 Cb 0.41 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.54 1h7d h PRO 12 CO 0.12 0.17 -0.97 1.55 -0.23 0.00 0.00 178.00 178.64 1h7d n VAL 13 N -3.22 0.33 0.00 1.56 3.14 -1.26 -4.96 118.33 113.92 1h7d n VAL 13 Ca 0.02 -0.35 0.00 0.00 -2.96 0.00 0.00 64.34 61.05 1h7d n VAL 13 Cb 0.49 -0.04 0.00 0.00 -1.06 0.00 0.00 33.84 33.23 1h7d n VAL 13 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 1h7d n LEU 14 N -2.21 0.00 -3.40 6.55 7.94 -1.06 -4.74 117.00 120.09 1h7d n LEU 14 Ca 0.01 0.00 -0.32 0.00 -1.11 0.00 0.00 56.01 54.59 1h7d n LEU 14 Cb 0.47 0.00 0.03 0.00 0.53 0.00 0.00 43.42 44.46 1h7d n LEU 14 CO 0.39 0.00 -0.20 -0.24 -1.11 0.00 0.00 177.39 176.23 1h7d n SER 15 N 2.51 -5.95 0.00 1.96 2.88 -1.26 -4.87 113.62 108.89 1h7d n SER 15 Ca 0.00 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1h7d n SER 15 Cb 0.00 -2.40 0.00 0.00 -0.75 0.00 0.00 64.21 61.06 1h7d n SER 15 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h7d n GLN 16 N -0.36 0.00 -0.04 -1.46 6.02 -1.26 -4.97 117.38 115.30 1h7d n GLN 16 Ca -0.06 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.92 1h7d n GLN 16 Cb 0.64 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 31.90 1h7d n GLN 16 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1h7d h GLY 17 N 0.00 0.00 0.00 1.08 0.00 -1.93 -3.45 103.07 98.77 1h7d h GLY 17 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1h7d h GLY 17 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 176.54 174.99 1h7d n PRO 18 N -3.86 0.00 0.00 4.80 -0.04 -1.26 -4.85 135.00 129.79 1h7d n PRO 18 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 1h7d n PRO 18 Cb 0.06 -0.16 0.00 0.00 -0.04 0.00 0.00 33.50 33.36 1h7d n PRO 18 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1h7d n THR 19 N -0.03 0.00 0.00 0.52 -1.04 -1.26 -3.26 114.28 109.21 1h7d n THR 19 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1h7d n THR 19 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 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 -0.08 2.23 3.41 0.00 -1.26 -5.09 105.19 104.40 1h7d n GLY 20 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.01 -5.11 0.07 0.99 4.77 -1.20 -4.79 117.00 109.73 1h7d n LEU 21 Ca 0.00 1.27 -0.03 0.00 -0.03 0.00 0.00 56.01 57.23 1h7d n LEU 21 Cb 0.00 -2.48 0.21 0.00 -2.33 0.00 0.00 43.42 38.82 1h7d n LEU 21 CO 0.00 -2.40 0.65 0.17 -1.33 0.00 0.00 177.39 174.48 1h7d h LEU 22 N 2.36 0.31 -1.84 2.23 -0.00 -1.99 -2.34 115.31 114.05 1h7d h LEU 22 Ca -0.23 -0.13 0.00 0.00 -0.00 0.00 0.00 57.88 57.52 1h7d h LEU 22 Cb 0.52 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 41.09 1h7d h LEU 22 CO 0.03 0.68 0.16 1.23 -0.00 0.00 0.00 178.44 180.54 1h7d h GLY 23 N 1.18 0.00 0.84 0.17 0.00 -2.00 0.63 103.07 103.89 1h7d h GLY 23 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.27 1h7d h GLY 23 CO 0.06 0.00 -0.21 1.70 0.00 0.00 0.00 176.54 178.09 1h7d h LYS 24 N 0.00 0.51 0.00 4.80 1.63 -1.72 -2.36 116.57 119.43 1h7d h LYS 24 Ca 0.00 -0.27 0.00 0.00 -0.85 0.00 0.00 60.65 59.53 1h7d h LYS 24 Cb 0.31 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.95 1h7d h LYS 24 CO 0.00 0.85 0.00 0.28 -3.45 0.00 0.00 179.45 177.13 1h7d n VAL 25 N -4.42 0.03 0.00 2.00 0.31 0.19 -3.02 118.33 113.41 1h7d n VAL 25 Ca -0.05 0.01 -0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1h7d n VAL 25 Cb 0.41 -0.57 -0.00 0.00 -0.91 0.00 0.00 33.84 32.77 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 3.63 -0.09 -0.68 3.52 0.00 -1.09 -3.29 119.26 121.26 1h7d h ALA 26 Ca 0.00 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.01 1h7d h ALA 26 Cb 0.05 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.78 1h7d h ALA 26 CO 0.00 -0.09 0.29 0.87 0.00 0.00 0.00 179.25 180.32 1h7d h LYS 27 N -0.27 0.48 -0.94 0.00 6.56 -1.61 -1.03 116.57 119.76 1h7d h LYS 27 Ca -0.00 -0.03 0.25 0.00 -1.06 0.00 0.00 60.65 59.81 1h7d h LYS 27 Cb 0.02 -0.11 -0.18 0.00 -0.57 0.00 0.00 32.23 31.40 1h7d h LYS 27 CO 0.01 0.32 0.00 0.25 -2.06 0.00 0.00 179.45 177.97 1h7d n THR 28 N -4.94 -0.39 -0.12 -0.16 -2.24 -1.17 0.15 114.28 105.40 1h7d n THR 28 Ca 0.11 2.07 -0.10 0.00 -2.27 0.00 0.00 64.05 63.85 1h7d n THR 28 Cb 0.30 -3.01 -0.02 0.00 -2.10 0.00 0.00 70.33 65.50 1h7d n THR 28 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1h7d h TYR 29 N 0.00 0.65 -0.00 4.78 3.20 -1.25 0.60 116.97 124.94 1h7d h TYR 29 Ca 0.56 -0.10 0.00 0.00 3.14 0.00 0.00 58.73 62.33 1h7d h TYR 29 Cb 1.15 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 39.24 1h7d h TYR 29 CO -0.49 0.68 0.33 1.96 -1.64 0.00 0.00 178.16 179.00 1h7d h GLN 30 N 0.43 0.00 0.00 1.82 4.20 0.16 0.36 115.11 122.07 1h7d h GLN 30 Ca 0.10 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 1h7d h GLN 30 Cb 0.40 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1h7d h GLN 30 CO 0.01 0.00 -1.59 0.34 -0.67 0.00 0.00 178.83 176.92 1h7d n PHE 31 N -2.89 0.00 -0.34 2.96 7.35 -0.60 -4.39 117.46 119.54 1h7d n PHE 31 Ca -0.02 0.00 0.06 0.00 -0.76 0.00 0.00 57.45 56.73 1h7d n PHE 31 Cb 0.38 -0.34 0.30 0.00 0.35 0.00 0.00 39.48 40.17 1h7d n PHE 31 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 1h7d n LEU 32 N -2.04 4.35 0.09 -2.13 7.99 0.20 -2.42 117.00 123.05 1h7d n LEU 32 Ca -0.06 -2.20 0.11 0.00 -0.01 0.00 0.00 56.01 53.85 1h7d n LEU 32 Cb 0.46 -0.59 -0.02 0.00 -0.11 0.00 0.00 43.42 43.16 1h7d n LEU 32 CO 0.24 0.60 -0.06 0.33 -1.51 0.00 0.00 177.39 176.99 1h7d n PHE 33 N 0.66 0.87 0.00 -1.77 7.35 0.91 -4.79 117.46 120.69 1h7d n PHE 33 Ca 0.21 0.25 0.00 0.00 -0.76 0.00 0.00 57.45 57.16 1h7d n PHE 33 Cb 0.88 -0.91 0.00 0.00 0.35 0.00 0.00 39.48 39.79 1h7d n PHE 33 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1h7d n SER 34 N -2.63 0.00 -0.59 -2.13 7.64 -1.25 -5.01 113.62 109.64 1h7d n SER 34 Ca -0.01 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 1h7d n SER 34 Cb 0.55 0.20 -0.03 0.00 -1.01 0.00 0.00 64.21 63.92 1h7d n SER 34 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1h7d n ILE 35 N -2.05 0.00 -1.31 0.44 2.08 -1.01 -4.86 119.36 112.64 1h7d n ILE 35 Ca 0.00 0.00 -0.42 0.00 0.56 0.00 0.00 62.75 62.89 1h7d n ILE 35 Cb 0.00 -1.11 -0.04 0.00 -0.75 0.00 0.00 39.64 37.74 1h7d n ILE 35 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1h7d n GLY 36 N -0.99 3.16 2.70 7.39 0.00 -1.26 -4.61 105.19 111.58 1h7d n GLY 36 Ca -0.08 -1.36 -0.14 0.00 0.00 0.00 0.00 46.02 44.44 1h7d n GLY 36 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1h7d s ARG 37 N 4.38 0.87 0.01 1.61 6.06 -1.26 -5.13 118.95 125.49 1h7d s ARG 37 Ca 0.54 -1.22 -0.05 0.00 -2.50 0.00 0.00 55.73 52.49 1h7d s ARG 37 Cb 0.14 -0.63 -0.01 0.00 0.06 0.00 0.00 34.95 34.52 1h7d s ARG 37 CO 0.05 -1.29 0.10 0.00 -2.50 0.00 0.00 175.30 171.65 1h7d s PRO 39 N -1.57 4.28 -1.35 0.00 0.04 -1.26 -4.93 135.00 130.20 1h7d s PRO 39 Ca -0.14 1.69 -0.09 0.00 0.04 0.00 0.00 61.00 62.50 1h7d s PRO 39 Cb -0.07 -3.69 0.11 0.00 0.04 0.00 0.00 34.50 30.89 1h7d s PRO 39 CO 0.00 -0.61 2.19 0.44 0.04 0.00 0.00 177.00 179.06 1h7d n ILE 40 N 5.07 4.52 -2.34 0.56 -5.35 -1.26 -4.47 119.36 116.09 1h7d n ILE 40 Ca 0.13 -4.02 -0.05 0.00 -0.27 0.00 0.00 62.75 58.55 1h7d n ILE 40 Cb 0.45 -2.33 0.02 0.00 -1.74 0.00 0.00 39.64 36.05 1h7d n ILE 40 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1h7d n LEU 41 N 3.43 -4.02 -3.08 7.28 4.32 -1.26 -5.02 117.00 118.66 1h7d n LEU 41 Ca 0.52 -0.24 -0.17 0.00 -0.02 0.00 0.00 56.01 56.10 1h7d n LEU 41 Cb 0.32 -1.96 -0.01 0.00 -1.62 0.00 0.00 43.42 40.15 1h7d n LEU 41 CO 0.79 -0.17 -0.12 0.00 -1.22 0.00 0.00 177.39 176.68 1h7d n ALA 42 N -2.01 1.36 0.00 -1.18 0.00 -1.26 -4.95 120.51 112.47 1h7d n ALA 42 Ca -0.02 -2.92 -0.17 0.00 0.00 0.00 0.00 53.44 50.33 1h7d n ALA 42 Cb 0.54 -0.97 -0.12 0.00 0.00 0.00 0.00 19.45 18.89 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 1.72 1.53 0.00 0.00 1.03 -1.95 -3.47 112.91 111.78 1h7d h THR 43 Ca 0.04 -2.20 0.00 0.00 -0.01 0.00 0.00 66.41 64.24 1h7d h THR 43 Cb 0.98 2.91 0.00 0.00 -1.07 0.00 0.00 68.15 70.97 1h7d h THR 43 CO 0.41 0.62 0.00 0.00 -0.01 0.00 0.00 175.52 176.54 1h7d n GLN 44 N -4.32 0.00 0.00 0.00 6.02 -1.26 -5.10 117.38 112.72 1h7d n GLN 44 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 1h7d n GLN 44 Cb 0.64 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.90 1h7d n GLN 44 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1h7d n GLY 45 N 0.05 2.21 3.79 1.08 0.00 -1.26 -5.06 105.19 106.00 1h7d n GLY 45 Ca 0.00 -0.77 -0.29 0.00 0.00 0.00 0.00 46.02 44.96 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 0.00 1.24 -0.23 1.61 0.04 -1.26 -5.06 135.00 131.34 1h7d s PRO 46 Ca 0.00 0.32 0.02 0.00 0.04 0.00 0.00 61.00 61.38 1h7d s PRO 46 Cb 0.00 -1.85 0.05 0.00 0.04 0.00 0.00 34.50 32.74 1h7d s PRO 46 CO 0.00 -2.14 -0.13 0.95 0.04 0.00 0.00 177.00 175.72 1h7d s THR 47 N -3.27 2.08 -0.65 1.26 -4.23 -1.26 -4.76 115.64 104.81 1h7d s THR 47 Ca 0.63 -1.39 -0.02 0.00 -1.18 0.00 0.00 61.69 59.73 1h7d s THR 47 Cb -0.15 -2.11 -0.02 0.00 1.34 0.00 0.00 72.50 71.56 1h7d s THR 47 CO 0.53 0.14 0.60 0.00 -0.54 0.00 0.00 174.62 175.35