#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 -3.53 2.03 0.24 -1.26 -5.13 118.33 110.68 1h7d n VAL 2 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.29 1h7d n VAL 2 Cb 0.00 -0.94 -0.05 0.00 -1.47 0.00 0.00 33.84 31.39 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 -3.38 -2.40 -0.54 2.33 0.00 -1.26 -5.09 121.76 111.42 1h7d s ALA 3 Ca 0.00 2.18 0.06 0.00 0.00 0.00 0.00 51.96 54.20 1h7d s ALA 3 Cb 0.00 -1.86 0.22 0.00 0.00 0.00 0.00 23.12 21.48 1h7d s ALA 3 CO 0.00 -0.75 0.56 0.00 0.00 0.00 0.00 175.76 175.57 1h7d n ALA 4 N 4.70 3.27 -0.08 0.00 0.00 -1.26 -4.85 120.51 122.28 1h7d n ALA 4 Ca -0.13 -4.05 0.00 0.00 0.00 0.00 0.00 53.44 49.26 1h7d n ALA 4 Cb 0.54 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 19.11 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 1.56 0.80 -3.81 0.00 0.00 -1.26 -5.02 120.51 112.78 1h7d n ALA 5 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.37 1h7d n ALA 5 Cb 0.44 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.92 1h7d n ALA 5 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1h7d n MET 6 N -2.37 -1.49 0.00 0.00 0.00 -1.26 -0.60 117.12 111.40 1h7d n MET 6 Ca 0.00 0.38 0.00 0.00 -0.00 0.00 0.00 57.70 58.08 1h7d n MET 6 Cb 0.00 -3.94 0.00 0.00 0.00 0.00 0.00 33.22 29.28 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 -4.38 0.00 0.00 -0.89 4.77 -1.26 -4.69 117.00 110.55 1h7d n LEU 7 Ca -0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1h7d n LEU 7 Cb 0.61 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 1h7d n LEU 7 CO 0.70 0.00 0.00 -0.11 -1.33 0.00 0.00 177.39 176.65 1h7d n LEU 8 N 0.00 0.00 0.00 2.23 -0.00 0.24 -3.30 117.00 116.17 1h7d n LEU 8 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1h7d n LEU 8 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1h7d n LEU 8 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.39 177.93 1h7d n ARG 9 N 0.00 0.00 -3.45 1.96 5.12 -1.26 -5.05 116.66 113.97 1h7d n ARG 9 Ca 0.00 0.00 -0.19 0.00 -1.93 0.00 0.00 57.85 55.73 1h7d n ARG 9 Cb 0.00 -0.06 0.09 0.00 -1.16 0.00 0.00 32.46 31.33 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 -2.21 -3.24 -4.76 0.55 2.88 -1.21 -4.95 113.62 100.68 1h7d n SER 10 Ca 0.00 -0.59 -0.35 0.00 -1.33 0.00 0.00 58.87 56.60 1h7d n SER 10 Cb 0.00 -5.02 0.02 0.00 -0.75 0.00 0.00 64.21 58.47 1h7d n SER 10 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h7d n PRO 12 N -1.55 0.11 -2.97 0.00 -0.04 -1.26 -4.89 135.00 124.41 1h7d n PRO 12 Ca 0.13 0.22 -0.21 0.00 -0.04 0.00 0.00 63.50 63.59 1h7d n PRO 12 Cb 0.50 -1.66 0.03 0.00 -0.04 0.00 0.00 33.50 32.34 1h7d n PRO 12 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1h7d n VAL 13 N -1.86 -1.89 -0.21 0.52 0.31 -1.26 -4.88 118.33 109.06 1h7d n VAL 13 Ca 0.05 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.29 1h7d n VAL 13 Cb 0.29 -3.34 0.02 0.00 -0.91 0.00 0.00 33.84 29.90 1h7d n VAL 13 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1h7d h LEU 14 N -1.30 1.01 -2.76 7.52 3.38 -2.02 -3.48 115.31 117.65 1h7d h LEU 14 Ca -0.50 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.18 1h7d h LEU 14 Cb 1.34 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1h7d h LEU 14 CO 0.53 1.06 -0.96 -1.54 0.09 0.00 0.00 178.44 177.62 1h7d n SER 15 N -4.23 -6.73 -1.90 -0.43 3.41 -1.26 -4.64 113.62 97.84 1h7d n SER 15 Ca 0.03 0.94 -0.01 0.00 -0.26 0.00 0.00 58.87 59.57 1h7d n SER 15 Cb 0.33 -3.35 0.00 0.00 -0.26 0.00 0.00 64.21 60.93 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 1.22 -0.99 0.00 4.33 6.02 -1.26 -5.08 117.38 121.61 1h7d n GLN 16 Ca -0.04 1.16 0.00 0.00 -0.01 0.00 0.00 57.00 58.11 1h7d n GLN 16 Cb 0.27 -2.55 0.00 0.00 1.02 0.00 0.00 30.24 28.98 1h7d n GLN 16 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1h7d n GLY 17 N -0.01 -0.05 0.00 1.08 0.00 -1.26 -5.09 105.19 99.86 1h7d n GLY 17 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.55 -0.47 0.03 1.61 -0.04 -1.26 -5.06 135.00 128.27 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 0.01 0.00 0.52 -2.24 -1.26 -5.07 114.28 104.04 1h7d n THR 19 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1h7d n THR 19 Cb 0.00 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 67.69 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 1.56 2.90 2.26 3.38 0.00 -1.26 -4.77 105.19 109.26 1h7d n GLY 20 Ca 0.00 -0.75 -0.23 0.00 0.00 0.00 0.00 46.02 45.04 1h7d n GLY 20 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1h7d n LEU 21 N 0.00 -0.16 0.10 0.99 -0.00 -1.26 -4.87 117.00 111.80 1h7d n LEU 21 Ca 0.00 -4.54 0.00 0.00 -0.00 0.00 0.00 56.01 51.47 1h7d n LEU 21 Cb 0.00 0.64 0.00 0.00 -0.00 0.00 0.00 43.42 44.06 1h7d n LEU 21 CO 0.00 2.03 0.00 -0.11 -0.00 0.00 0.00 177.39 179.31 1h7d n LEU 22 N 1.68 -1.79 0.02 1.47 7.94 -1.26 -4.92 117.00 120.14 1h7d n LEU 22 Ca 0.22 0.46 0.22 0.00 -1.11 0.00 0.00 56.01 55.80 1h7d n LEU 22 Cb 0.53 1.89 0.73 0.00 0.53 0.00 0.00 43.42 47.09 1h7d n LEU 22 CO 0.15 -0.02 1.20 1.23 -1.11 0.00 0.00 177.39 178.84 1h7d h GLY 23 N 0.00 0.00 1.04 -3.96 0.00 -1.90 0.33 103.07 98.57 1h7d h GLY 23 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.19 1h7d h GLY 23 CO 0.00 0.00 -0.32 0.50 0.00 0.00 0.00 176.54 176.72 1h7d h LYS 24 N 0.00 0.81 0.00 4.80 6.56 -1.91 -1.09 116.57 125.74 1h7d h LYS 24 Ca 0.25 -0.42 0.00 0.00 -1.06 0.00 0.00 60.65 59.42 1h7d h LYS 24 Cb 1.17 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.84 1h7d h LYS 24 CO -0.00 1.06 0.00 0.28 -2.06 0.00 0.00 179.45 178.72 1h7d n VAL 25 N -4.18 0.49 -2.49 0.50 0.31 0.10 -0.37 118.33 112.69 1h7d n VAL 25 Ca -0.03 0.12 -0.16 0.00 -0.01 0.00 0.00 64.34 64.26 1h7d n VAL 25 Cb 0.50 -0.76 0.02 0.00 -0.91 0.00 0.00 33.84 32.70 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 -1.47 4.13 0.00 3.52 0.00 -0.44 -4.67 120.51 121.58 1h7d n ALA 26 Ca 0.06 -3.57 0.00 0.00 0.00 0.00 0.00 53.44 49.93 1h7d n ALA 26 Cb 0.24 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.03 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 -0.45 0.00 -0.09 0.00 0.00 -0.47 -4.86 118.16 112.29 1h7d n LYS 27 Ca 0.26 0.00 -0.10 0.00 0.00 0.00 0.00 58.31 58.46 1h7d n LYS 27 Cb 0.80 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.80 1h7d n LYS 27 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1h7d h THR 28 N 0.00 1.21 -0.74 3.15 2.02 -0.87 -2.89 112.91 114.79 1h7d h THR 28 Ca 0.00 -0.68 -0.06 0.00 0.77 0.00 0.00 66.41 66.44 1h7d h THR 28 Cb 0.00 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 1h7d h THR 28 CO 0.00 0.23 0.24 0.22 0.37 0.00 0.00 175.52 176.58 1h7d h TYR 29 N 0.29 1.17 0.00 3.16 3.20 -1.83 0.70 116.97 123.66 1h7d h TYR 29 Ca 0.09 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1h7d h TYR 29 Cb 0.27 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.20 1h7d h TYR 29 CO 0.01 0.92 0.00 0.94 -1.64 0.00 0.00 178.16 178.39 1h7d n GLN 30 N -4.26 0.14 -0.08 1.82 -0.06 -1.11 -1.50 117.38 112.34 1h7d n GLN 30 Ca 0.06 0.64 -0.13 0.00 -2.00 0.00 0.00 57.00 55.57 1h7d n GLN 30 Cb 0.22 -1.97 -0.06 0.00 -4.06 0.00 0.00 30.24 24.37 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 -2.27 0.00 0.22 3.69 7.35 -0.50 -4.02 117.46 121.93 1h7d n PHE 31 Ca -0.01 0.00 0.18 0.00 -0.76 0.00 0.00 57.45 56.86 1h7d n PHE 31 Cb 0.04 -0.56 0.82 0.00 0.35 0.00 0.00 39.48 40.13 1h7d n PHE 31 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1h7d h LEU 32 N -0.25 0.00 0.10 -2.13 3.38 0.70 -0.05 115.31 117.05 1h7d h LEU 32 Ca -0.36 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.38 1h7d h LEU 32 Cb 1.43 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.18 1h7d h LEU 32 CO -0.14 0.00 -1.18 0.15 0.09 0.00 0.00 178.44 177.36 1h7d h PHE 33 N 0.00 0.38 -0.66 1.13 3.04 -1.49 -3.38 116.94 115.96 1h7d h PHE 33 Ca 0.09 -0.28 -0.72 0.00 3.98 0.00 0.00 57.97 61.04 1h7d h PHE 33 Cb 0.73 -0.02 -0.07 0.00 2.56 0.00 0.00 35.95 39.15 1h7d h PHE 33 CO 0.00 1.46 2.91 0.43 -2.02 0.00 0.00 178.31 181.09 1h7d n SER 34 N -4.06 7.15 -0.06 0.41 7.64 -0.04 -4.18 113.62 120.49 1h7d n SER 34 Ca -0.23 -2.91 -0.06 0.00 1.01 0.00 0.00 58.87 56.68 1h7d n SER 34 Cb 0.83 -1.49 -0.08 0.00 -1.01 0.00 0.00 64.21 62.46 1h7d n SER 34 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1h7d n ILE 35 N 3.08 0.75 0.00 0.44 -5.35 -1.22 -4.91 119.36 112.15 1h7d n ILE 35 Ca 0.62 -0.44 0.00 0.00 -0.27 0.00 0.00 62.75 62.66 1h7d n ILE 35 Cb 0.28 -0.74 0.00 0.00 -1.74 0.00 0.00 39.64 37.44 1h7d n ILE 35 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1h7d n GLY 36 N 2.39 -0.36 0.00 3.28 0.00 -1.26 -4.98 105.19 104.26 1h7d n GLY 36 Ca -0.18 0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.30 1.61 5.12 -1.26 -5.06 116.66 113.77 1h7d n ARG 37 Ca 0.00 0.00 -0.16 0.00 -1.93 0.00 0.00 57.85 55.76 1h7d n ARG 37 Cb 0.00 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.23 1h7d n ARG 37 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1h7d s PRO 39 N 1.21 3.23 -0.08 0.00 0.04 -1.26 -4.60 135.00 133.54 1h7d s PRO 39 Ca 0.20 -1.44 0.09 0.00 0.04 0.00 0.00 61.00 59.90 1h7d s PRO 39 Cb -0.11 -5.36 -0.24 0.00 0.04 0.00 0.00 34.50 28.83 1h7d s PRO 39 CO -0.05 -3.04 0.52 0.44 0.04 0.00 0.00 177.00 174.91 1h7d n ILE 40 N 7.13 1.62 0.06 0.56 -6.64 -1.26 -4.24 119.36 116.59 1h7d n ILE 40 Ca 0.45 -0.77 -0.21 0.00 -1.77 0.00 0.00 62.75 60.45 1h7d n ILE 40 Cb 0.47 -1.11 -0.15 0.00 -1.44 0.00 0.00 39.64 37.41 1h7d n ILE 40 CO 0.00 0.00 0.00 0.17 -1.77 0.00 0.00 176.55 174.95 1h7d h LEU 41 N 0.01 0.53 -5.66 7.28 8.10 -2.07 -3.38 115.31 120.13 1h7d h LEU 41 Ca -0.35 -0.83 -0.57 0.00 0.11 0.00 0.00 57.88 56.24 1h7d h LEU 41 Cb 2.04 -0.17 0.02 0.00 -0.44 0.00 0.00 40.66 42.11 1h7d h LEU 41 CO 0.07 1.70 2.95 0.00 -4.11 0.00 0.00 178.44 179.06 1h7d n ALA 42 N -2.83 5.27 -2.68 0.17 0.00 -1.26 -3.93 120.51 115.24 1h7d n ALA 42 Ca -0.24 -3.00 -0.05 0.00 0.00 0.00 0.00 53.44 50.15 1h7d n ALA 42 Cb 1.07 -3.33 0.09 0.00 0.00 0.00 0.00 19.45 17.27 1h7d n ALA 42 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1h7d n THR 43 N 4.60 0.00 0.03 0.00 5.66 -1.26 -4.94 114.28 118.37 1h7d n THR 43 Ca 0.55 -0.96 0.00 0.00 -3.05 0.00 0.00 64.05 60.60 1h7d n THR 43 Cb 0.26 1.11 0.00 0.00 -1.55 0.00 0.00 70.33 70.15 1h7d n THR 43 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 175.07 173.69 1h7d n GLN 44 N 0.21 0.00 -0.19 1.09 -0.06 -1.25 -5.10 117.38 112.08 1h7d n GLN 44 Ca -0.06 0.00 0.03 0.00 -2.00 0.00 0.00 57.00 54.97 1h7d n GLN 44 Cb 0.73 0.00 -0.01 0.00 -4.06 0.00 0.00 30.24 26.91 1h7d n GLN 44 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1h7d n GLY 45 N -1.06 -1.44 3.73 1.69 0.00 -1.26 -4.75 105.19 102.10 1h7d n GLY 45 Ca 0.00 -1.16 -0.41 0.00 0.00 0.00 0.00 46.02 44.45 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 -0.34 4.55 0.22 1.61 0.04 -1.26 -4.98 135.00 134.83 1h7d s PRO 46 Ca 0.00 1.74 -0.31 0.00 0.04 0.00 0.00 61.00 62.47 1h7d s PRO 46 Cb 0.00 -3.29 -0.10 0.00 0.04 0.00 0.00 34.50 31.14 1h7d s PRO 46 CO 0.00 -0.02 1.52 -0.08 0.04 0.00 0.00 177.00 178.46 1h7d s THR 47 N 0.09 2.55 -0.14 1.26 -1.32 -1.26 -4.96 115.64 111.85 1h7d s THR 47 Ca 0.52 0.43 -0.24 0.00 -1.21 0.00 0.00 61.69 61.19 1h7d s THR 47 Cb -0.29 -3.28 -0.02 0.00 -1.51 0.00 0.00 72.50 67.40 1h7d s THR 47 CO 0.34 0.05 0.78 0.00 -2.21 0.00 0.00 174.62 173.58