#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h7d s VAL 2 N 0.00 1.52 -0.30 2.03 1.01 -1.26 -5.02 120.40 118.38 1h7d s VAL 2 Ca 0.00 -2.70 -0.15 0.00 0.00 0.00 0.00 61.98 59.13 1h7d s VAL 2 Cb 0.00 -2.06 0.18 0.00 0.00 0.00 0.00 36.38 34.50 1h7d s VAL 2 CO 0.00 -0.91 1.15 0.00 0.00 0.00 0.00 175.10 175.34 1h7d s ALA 3 N 0.20 -3.88 -0.91 5.51 0.00 -1.26 -5.06 121.76 116.37 1h7d s ALA 3 Ca 0.19 1.35 0.00 0.00 0.00 0.00 0.00 51.96 53.50 1h7d s ALA 3 Cb -0.22 -2.66 0.32 0.00 0.00 0.00 0.00 23.12 20.56 1h7d s ALA 3 CO -0.01 -1.66 1.51 0.00 0.00 0.00 0.00 175.76 175.59 1h7d n ALA 4 N 5.38 5.51 -3.24 0.00 0.00 -1.26 -4.85 120.51 122.05 1h7d n ALA 4 Ca -0.04 -4.67 -0.16 0.00 0.00 0.00 0.00 53.44 48.57 1h7d n ALA 4 Cb 0.55 -1.78 0.01 0.00 0.00 0.00 0.00 19.45 18.23 1h7d n ALA 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h7d n ALA 5 N 0.13 -2.68 -2.69 0.00 0.00 -1.26 -4.97 120.51 109.04 1h7d n ALA 5 Ca 0.39 0.38 -0.07 0.00 0.00 0.00 0.00 53.44 54.15 1h7d n ALA 5 Cb 0.31 -2.21 0.09 0.00 0.00 0.00 0.00 19.45 17.64 1h7d n ALA 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h7d n MET 6 N -1.15 1.24 -2.70 0.00 -0.00 -1.26 -4.96 117.12 108.28 1h7d n MET 6 Ca -0.05 -2.33 -0.06 0.00 -0.00 0.00 0.00 57.70 55.25 1h7d n MET 6 Cb 0.57 -0.49 0.10 0.00 -0.00 0.00 0.00 33.22 33.40 1h7d n MET 6 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 175.97 177.44 1h7d n LEU 7 N -0.53 -1.87 -3.15 3.17 -0.00 -1.26 -5.09 117.00 108.28 1h7d n LEU 7 Ca -0.00 -2.89 0.05 0.00 -0.00 0.00 0.00 56.01 53.18 1h7d n LEU 7 Cb 0.84 0.95 -0.00 0.00 -0.00 0.00 0.00 43.42 45.21 1h7d n LEU 7 CO 0.04 1.86 0.50 -0.22 -0.00 0.00 0.00 177.39 179.57 1h7d s LEU 8 N -1.76 -0.50 -0.23 1.47 0.20 -1.26 -5.05 118.68 111.55 1h7d s LEU 8 Ca 0.22 0.08 0.02 0.00 0.69 0.00 0.00 54.13 55.14 1h7d s LEU 8 Cb 0.29 1.33 0.08 0.00 -0.43 0.00 0.00 46.19 47.46 1h7d s LEU 8 CO -0.12 -0.09 0.94 -2.11 -0.29 0.00 0.00 176.35 174.68 1h7d n ARG 9 N 5.17 0.25 -1.26 1.98 1.85 -1.26 -5.00 116.66 118.40 1h7d n ARG 9 Ca 0.07 -0.58 -0.27 0.00 -1.00 0.00 0.00 57.85 56.08 1h7d n ARG 9 Cb 0.57 0.02 0.15 0.00 -1.05 0.00 0.00 32.46 32.16 1h7d n ARG 9 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1h7d n SER 10 N -0.44 4.86 -3.58 2.89 7.64 -1.26 -4.93 113.62 118.79 1h7d n SER 10 Ca -0.18 -3.66 -0.25 0.00 1.01 0.00 0.00 58.87 55.78 1h7d n SER 10 Cb 0.63 -0.87 0.01 0.00 -1.01 0.00 0.00 64.21 62.97 1h7d n SER 10 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1h7d h PRO 12 N 0.60 -0.16 0.00 0.00 0.13 -2.00 -3.47 132.00 127.10 1h7d h PRO 12 Ca -0.51 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1h7d h PRO 12 Cb 1.34 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1h7d h PRO 12 CO 0.31 0.29 0.00 1.55 -0.23 0.00 0.00 178.00 179.93 1h7d n VAL 13 N -4.86 0.00 -1.90 1.56 3.14 -1.26 -5.01 118.33 109.99 1h7d n VAL 13 Ca -0.07 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.23 1h7d n VAL 13 Cb 0.26 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 33.03 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 -1.57 -1.15 0.00 6.55 7.99 -1.26 -0.82 117.00 126.73 1h7d n LEU 14 Ca 0.00 0.05 0.00 0.00 -0.01 0.00 0.00 56.01 56.05 1h7d n LEU 14 Cb 0.00 -1.42 0.00 0.00 -0.11 0.00 0.00 43.42 41.89 1h7d n LEU 14 CO 0.00 -0.17 0.00 -0.24 -1.51 0.00 0.00 177.39 175.47 1h7d n SER 15 N 0.55 0.00 -3.40 -1.43 2.88 -1.26 -4.37 113.62 106.59 1h7d n SER 15 Ca -0.09 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.19 1h7d n SER 15 Cb 0.49 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.86 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 0.00 1.33 -0.03 -1.46 6.02 -1.25 -4.95 117.38 117.05 1h7d n GLN 16 Ca 0.00 -3.84 -0.01 0.00 -0.01 0.00 0.00 57.00 53.14 1h7d n GLN 16 Cb 0.00 -1.76 -0.00 0.00 1.02 0.00 0.00 30.24 29.49 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 4.54 0.00 -0.13 1.08 0.00 -1.18 -3.49 103.07 103.89 1h7d h GLY 17 Ca 0.16 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.42 1h7d h GLY 17 CO 0.60 0.00 0.04 -1.55 0.00 0.00 0.00 176.54 175.63 1h7d n PRO 18 N -3.33 -0.75 -2.52 4.80 -0.04 -1.26 -4.36 135.00 127.54 1h7d n PRO 18 Ca -0.02 -0.28 -0.19 0.00 -0.04 0.00 0.00 63.50 62.98 1h7d n PRO 18 Cb 0.06 -0.22 0.00 0.00 -0.04 0.00 0.00 33.50 33.30 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 -2.56 -1.14 -3.37 0.52 -1.04 -1.26 -4.93 114.28 100.50 1h7d n THR 19 Ca 0.02 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.76 1h7d n THR 19 Cb 0.09 -2.83 -0.08 0.00 -1.82 0.00 0.00 70.33 65.69 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 -1.14 4.92 1.94 3.41 0.00 -1.26 -4.91 105.19 108.13 1h7d n GLY 20 Ca -0.18 -2.78 -0.00 0.00 0.00 0.00 0.00 46.02 43.05 1h7d n GLY 20 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1h7d n LEU 21 N 0.72 -4.13 0.12 0.99 0.00 -1.26 -5.05 117.00 108.39 1h7d n LEU 21 Ca 0.30 0.46 0.00 0.00 0.00 0.00 0.00 56.01 56.77 1h7d n LEU 21 Cb 0.41 -1.83 0.00 0.00 0.00 0.00 0.00 43.42 41.99 1h7d n LEU 21 CO 0.40 -1.09 0.00 -0.11 0.00 0.00 0.00 177.39 176.59 1h7d n LEU 22 N 0.15 -0.02 -0.09 -1.96 0.00 -1.26 -4.76 117.00 109.06 1h7d n LEU 22 Ca 0.01 0.40 0.26 0.00 0.00 0.00 0.00 56.01 56.68 1h7d n LEU 22 Cb 0.02 0.29 0.66 0.00 0.00 0.00 0.00 43.42 44.39 1h7d n LEU 22 CO 0.16 -0.76 1.24 1.23 0.00 0.00 0.00 177.39 179.26 1h7d h GLY 23 N 0.00 0.00 0.94 -3.96 0.00 -1.97 0.96 103.07 99.04 1h7d h GLY 23 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 1h7d h GLY 23 CO 0.00 0.00 -0.34 1.70 0.00 0.00 0.00 176.54 177.90 1h7d h LYS 24 N 0.00 0.64 0.00 4.80 3.64 -2.00 -2.69 116.57 120.96 1h7d h LYS 24 Ca 0.37 -0.38 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1h7d h LYS 24 Cb 1.92 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.77 1h7d h LYS 24 CO -0.00 0.99 0.00 0.28 -2.27 0.00 0.00 179.45 178.44 1h7d h VAL 25 N 0.34 0.00 -1.89 2.00 2.07 0.55 0.13 116.25 119.44 1h7d h VAL 25 Ca 0.02 -0.48 -0.73 0.00 0.82 0.00 0.00 66.70 66.33 1h7d h VAL 25 Cb 0.92 1.39 -0.30 0.00 -1.52 0.00 0.00 31.29 31.78 1h7d h VAL 25 CO 0.08 0.00 0.72 0.00 0.02 0.00 0.00 177.57 178.39 1h7d n ALA 26 N -1.93 6.25 0.00 1.67 0.00 -0.05 -4.16 120.51 122.29 1h7d n ALA 26 Ca 0.03 -4.15 0.00 0.00 0.00 0.00 0.00 53.44 49.32 1h7d n ALA 26 Cb 0.33 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 18.07 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 -0.54 0.00 0.06 0.00 4.81 -1.17 -4.90 118.16 116.43 1h7d n LYS 27 Ca 0.51 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.84 1h7d n LYS 27 Cb 0.32 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.32 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 0.50 -0.10 3.15 2.02 -0.97 -1.37 112.91 116.14 1h7d h THR 28 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1h7d h THR 28 Cb 0.00 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 1h7d h THR 28 CO 0.00 0.00 -0.12 0.22 0.37 0.00 0.00 175.52 175.99 1h7d h TYR 29 N -0.35 0.16 0.00 3.16 3.20 -1.72 -0.96 116.97 120.47 1h7d h TYR 29 Ca 0.06 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1h7d h TYR 29 Cb 0.42 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.64 1h7d h TYR 29 CO -0.25 0.29 0.17 0.37 -1.64 0.00 0.00 178.16 177.09 1h7d h GLN 30 N 0.15 0.00 0.00 1.82 4.15 -1.51 0.88 115.11 120.61 1h7d h GLN 30 Ca 0.03 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 59.25 1h7d h GLN 30 Cb 0.32 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.97 1h7d h GLN 30 CO 0.02 0.00 -1.75 0.34 -1.93 0.00 0.00 178.83 175.51 1h7d n PHE 31 N -2.72 0.00 -0.55 3.99 -0.00 -0.56 -4.47 117.46 113.15 1h7d n PHE 31 Ca -0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 57.45 57.41 1h7d n PHE 31 Cb 0.22 -0.53 0.27 0.00 -0.00 0.00 0.00 39.48 39.43 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 -2.60 5.04 0.04 -2.13 4.77 -0.47 -4.35 117.00 117.30 1h7d n LEU 32 Ca -0.20 -2.60 -0.12 0.00 -0.03 0.00 0.00 56.01 53.06 1h7d n LEU 32 Cb 0.81 -0.68 -0.09 0.00 -2.33 0.00 0.00 43.42 41.13 1h7d n LEU 32 CO 0.19 0.65 0.49 0.15 -1.33 0.00 0.00 177.39 177.54 1h7d h PHE 33 N 2.44 -0.16 -2.56 -1.77 3.57 0.52 -3.42 116.94 115.58 1h7d h PHE 33 Ca 0.14 -0.00 -0.59 0.00 3.53 0.00 0.00 57.97 61.05 1h7d h PHE 33 Cb 1.89 0.05 -0.39 0.00 2.79 0.00 0.00 35.95 40.29 1h7d h PHE 33 CO 0.97 0.31 -0.87 0.45 -2.23 0.00 0.00 178.31 176.94 1h7d s SER 34 N -5.53 2.62 0.00 0.41 0.15 -1.26 -5.05 113.70 105.05 1h7d s SER 34 Ca -0.14 -2.46 0.00 0.00 0.70 0.00 0.00 55.95 54.05 1h7d s SER 34 Cb 0.01 -0.46 0.00 0.00 -1.71 0.00 0.00 66.02 63.86 1h7d s SER 34 CO 0.55 -0.27 0.00 -0.38 1.20 0.00 0.00 173.24 174.35 1h7d n ILE 35 N 3.68 0.00 0.00 6.45 2.08 -1.26 -5.07 119.36 125.23 1h7d n ILE 35 Ca 0.17 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.48 1h7d n ILE 35 Cb 0.40 -0.02 0.00 0.00 -0.75 0.00 0.00 39.64 39.26 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 3.62 0.20 2.65 7.39 0.00 -1.26 -4.99 105.19 112.80 1h7d n GLY 36 Ca 0.00 0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1h7d n GLY 36 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1h7d n ARG 37 N 0.00 3.71 -1.29 1.61 0.63 -1.26 -5.01 116.66 115.05 1h7d n ARG 37 Ca 0.00 -3.49 -0.38 0.00 -0.92 0.00 0.00 57.85 53.05 1h7d n ARG 37 Cb 0.00 -2.36 0.02 0.00 0.45 0.00 0.00 32.46 30.57 1h7d n ARG 37 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1h7d s PRO 39 N -1.51 4.49 -0.15 0.00 0.04 -1.26 -4.92 135.00 131.69 1h7d s PRO 39 Ca 0.60 1.73 0.12 0.00 0.04 0.00 0.00 61.00 63.48 1h7d s PRO 39 Cb -0.45 -3.33 -0.17 0.00 0.04 0.00 0.00 34.50 30.58 1h7d s PRO 39 CO 0.63 -0.14 0.03 1.51 0.04 0.00 0.00 177.00 179.07 1h7d n ILE 40 N 3.42 1.01 0.16 0.56 3.06 -1.26 -4.62 119.36 121.68 1h7d n ILE 40 Ca 0.07 -0.59 -0.10 0.00 -2.50 0.00 0.00 62.75 59.62 1h7d n ILE 40 Cb 0.47 -0.67 -0.06 0.00 0.54 0.00 0.00 39.64 39.91 1h7d n ILE 40 CO 0.00 0.00 0.00 -0.07 -2.50 0.00 0.00 176.55 173.98 1h7d h LEU 41 N 0.00 -0.39 -1.65 9.51 -0.00 -2.01 -3.50 115.31 117.28 1h7d h LEU 41 Ca -0.40 -0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.37 1h7d h LEU 41 Cb 1.87 0.10 0.00 0.00 -0.00 0.00 0.00 40.66 42.63 1h7d h LEU 41 CO 0.01 0.07 -0.83 0.00 -0.00 0.00 0.00 178.44 177.68 1h7d n ALA 42 N -2.65 -2.17 -2.88 1.53 0.00 -1.26 -4.77 120.51 108.31 1h7d n ALA 42 Ca -0.08 0.42 -0.07 0.00 0.00 0.00 0.00 53.44 53.71 1h7d n ALA 42 Cb 0.25 -1.28 0.03 0.00 0.00 0.00 0.00 19.45 18.45 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 1.60 -8.19 -0.02 0.00 -1.04 -1.26 -4.97 114.28 100.40 1h7d n THR 43 Ca 0.00 -0.72 0.01 0.00 -2.04 0.00 0.00 64.05 61.30 1h7d n THR 43 Cb 0.00 -6.13 -0.07 0.00 -1.82 0.00 0.00 70.33 62.31 1h7d n THR 43 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1h7d n GLN 44 N -2.37 1.23 0.00 -2.82 10.64 -1.26 -5.03 117.38 117.78 1h7d n GLN 44 Ca -0.03 -0.05 0.00 0.00 -1.83 0.00 0.00 57.00 55.09 1h7d n GLN 44 Cb 0.56 -1.21 0.00 0.00 -0.86 0.00 0.00 30.24 28.73 1h7d n GLN 44 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1h7d n GLY 45 N 2.20 -0.34 3.82 2.61 0.00 -1.26 -5.05 105.19 107.17 1h7d n GLY 45 Ca -0.06 -1.65 -0.31 0.00 0.00 0.00 0.00 46.02 44.00 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 0.28 2.88 0.34 1.61 0.04 -1.26 -4.95 135.00 133.94 1h7d s PRO 46 Ca 0.00 0.93 0.06 0.00 0.04 0.00 0.00 61.00 62.03 1h7d s PRO 46 Cb 0.00 -1.98 0.63 0.00 0.04 0.00 0.00 34.50 33.18 1h7d s PRO 46 CO 0.00 -1.14 1.86 0.00 0.04 0.00 0.00 177.00 177.77 1h7d h THR 47 N -0.74 1.20 -3.95 1.26 1.03 -1.99 -3.43 112.91 106.28 1h7d h THR 47 Ca -0.44 -0.86 -0.29 0.00 -0.01 0.00 0.00 66.41 64.81 1h7d h THR 47 Cb 1.21 1.09 -0.23 0.00 -1.07 0.00 0.00 68.15 69.16 1h7d h THR 47 CO 0.57 0.28 -0.74 0.00 -0.01 0.00 0.00 175.52 175.62