#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 -4.05 -3.63 1.12 0.31 -1.26 -5.07 118.33 105.75 1h7d n VAL 2 Ca 0.00 1.84 -0.01 0.00 -0.01 0.00 0.00 64.34 66.16 1h7d n VAL 2 Cb 0.00 -2.65 -0.06 0.00 -0.91 0.00 0.00 33.84 30.22 1h7d n VAL 2 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1h7d s ALA 3 N -3.91 -2.40 -0.90 3.52 0.00 -1.26 -5.06 121.76 111.74 1h7d s ALA 3 Ca 0.00 2.14 0.00 0.00 0.00 0.00 0.00 51.96 54.10 1h7d s ALA 3 Cb 0.00 -1.80 0.32 0.00 0.00 0.00 0.00 23.12 21.64 1h7d s ALA 3 CO 0.00 -0.37 1.51 0.00 0.00 0.00 0.00 175.76 176.91 1h7d n ALA 4 N 3.60 5.52 0.19 0.00 0.00 -1.26 -4.50 120.51 124.06 1h7d n ALA 4 Ca -0.18 -4.67 0.00 0.00 0.00 0.00 0.00 53.44 48.59 1h7d n ALA 4 Cb 0.57 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 18.24 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 0.11 0.82 -3.84 0.00 0.00 -1.26 -5.04 120.51 111.30 1h7d n ALA 5 Ca 0.40 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.49 1h7d n ALA 5 Cb 0.31 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.78 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 -3.35 -0.89 -4.28 0.00 0.00 -1.26 -0.54 117.12 106.80 1h7d n MET 6 Ca 0.00 0.43 -0.32 0.00 0.00 0.00 0.00 57.70 57.81 1h7d n MET 6 Cb 0.00 -3.04 -0.08 0.00 0.00 0.00 0.00 33.22 30.09 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 -4.00 -0.97 -3.28 -0.89 -0.00 -1.26 -4.89 117.00 101.71 1h7d n LEU 7 Ca -0.16 -1.27 -0.08 0.00 -0.00 0.00 0.00 56.01 54.51 1h7d n LEU 7 Cb 0.60 -1.63 -0.04 0.00 -0.00 0.00 0.00 43.42 42.35 1h7d n LEU 7 CO 0.69 0.50 -0.03 -0.22 -0.00 0.00 0.00 177.39 178.32 1h7d s LEU 8 N -7.37 -0.82 -0.32 1.47 2.96 0.30 -4.99 118.68 109.90 1h7d s LEU 8 Ca 0.04 -1.16 0.02 0.00 -0.22 0.00 0.00 54.13 52.82 1h7d s LEU 8 Cb -0.02 1.28 0.14 0.00 0.50 0.00 0.00 46.19 48.09 1h7d s LEU 8 CO 0.99 -0.22 1.16 -2.11 -1.32 0.00 0.00 176.35 174.85 1h7d n ARG 9 N 4.35 0.22 -0.05 1.98 1.85 -1.26 -4.68 116.66 119.06 1h7d n ARG 9 Ca 0.11 -0.76 -0.10 0.00 -1.00 0.00 0.00 57.85 56.11 1h7d n ARG 9 Cb 0.51 -0.06 -0.03 0.00 -1.05 0.00 0.00 32.46 31.83 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 -0.25 1.51 -3.18 2.89 7.64 -1.26 -5.07 113.62 115.90 1h7d n SER 10 Ca -0.21 0.24 -0.07 0.00 1.01 0.00 0.00 58.87 59.84 1h7d n SER 10 Cb 0.68 -0.57 0.01 0.00 -1.01 0.00 0.00 64.21 63.33 1h7d n SER 10 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1h7d s PRO 12 N -1.40 2.13 -0.11 0.00 0.04 -1.26 -5.00 135.00 129.40 1h7d s PRO 12 Ca 0.08 0.66 0.02 0.00 0.04 0.00 0.00 61.00 61.80 1h7d s PRO 12 Cb -0.01 -1.92 -0.24 0.00 0.04 0.00 0.00 34.50 32.37 1h7d s PRO 12 CO 0.29 -1.59 0.39 0.28 0.04 0.00 0.00 177.00 176.40 1h7d n VAL 13 N -3.41 1.67 -2.53 -0.36 0.31 -1.26 -5.02 118.33 107.73 1h7d n VAL 13 Ca 0.07 -0.71 -0.09 0.00 -0.01 0.00 0.00 64.34 63.60 1h7d n VAL 13 Cb 0.56 -1.38 0.04 0.00 -0.91 0.00 0.00 33.84 32.15 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 -3.26 -4.13 -2.99 7.52 4.32 -1.26 -4.86 117.00 112.34 1h7d n LEU 14 Ca -0.28 -0.41 -0.27 0.00 -0.02 0.00 0.00 56.01 55.02 1h7d n LEU 14 Cb 1.05 -2.09 -0.05 0.00 -1.62 0.00 0.00 43.42 40.71 1h7d n LEU 14 CO 0.42 0.06 2.66 -1.20 -1.22 0.00 0.00 177.39 178.11 1h7d n SER 15 N -2.51 6.65 -2.41 -1.43 7.64 -1.26 -3.50 113.62 116.80 1h7d n SER 15 Ca -0.04 -2.44 -0.02 0.00 1.01 0.00 0.00 58.87 57.38 1h7d n SER 15 Cb 0.57 -1.34 0.10 0.00 -1.01 0.00 0.00 64.21 62.53 1h7d n SER 15 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1h7d n GLN 16 N 3.54 1.11 0.06 1.43 7.27 -1.26 -5.01 117.38 124.52 1h7d n GLN 16 Ca 0.59 -1.04 0.00 0.00 0.07 0.00 0.00 57.00 56.62 1h7d n GLN 16 Cb 0.32 0.38 0.00 0.00 2.41 0.00 0.00 30.24 33.35 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 -1.27 -1.85 3.78 1.69 0.00 -1.23 -5.15 105.19 101.17 1h7d n GLY 17 Ca -0.16 0.48 -0.29 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.31 0.85 -0.10 1.61 0.04 -1.26 -5.03 135.00 129.80 1h7d s PRO 18 Ca 0.00 0.18 -0.01 0.00 0.04 0.00 0.00 61.00 61.21 1h7d s PRO 18 Cb 0.00 -1.82 -0.00 0.00 0.04 0.00 0.00 34.50 32.72 1h7d s PRO 18 CO 0.00 -2.37 -0.01 1.15 0.04 0.00 0.00 177.00 175.80 1h7d h THR 19 N -1.62 0.00 0.00 1.26 2.02 -2.01 -3.49 112.91 109.07 1h7d h THR 19 Ca -0.49 -0.96 0.00 0.00 0.77 0.00 0.00 66.41 65.72 1h7d h THR 19 Cb 1.32 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1h7d h THR 19 CO 0.56 0.00 0.00 0.61 0.37 0.00 0.00 175.52 177.06 1h7d n GLY 20 N 1.77 2.37 3.87 2.16 0.00 -1.26 -5.01 105.19 109.09 1h7d n GLY 20 Ca -0.01 0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.47 0.05 0.99 -0.00 -1.26 -4.88 117.00 110.43 1h7d n LEU 21 Ca 0.00 -1.06 0.00 0.00 -0.00 0.00 0.00 56.01 54.95 1h7d n LEU 21 Cb 0.00 -1.64 0.00 0.00 -0.00 0.00 0.00 43.42 41.78 1h7d n LEU 21 CO 0.00 0.50 -0.08 -0.11 -0.00 0.00 0.00 177.39 177.69 1h7d n LEU 22 N -3.30 0.74 -0.05 1.47 0.00 -1.26 -4.63 117.00 109.97 1h7d n LEU 22 Ca -0.26 0.16 0.23 0.00 0.00 0.00 0.00 56.01 56.13 1h7d n LEU 22 Cb 0.66 -0.18 0.70 0.00 0.00 0.00 0.00 43.42 44.60 1h7d n LEU 22 CO 0.67 -0.63 1.21 1.23 0.00 0.00 0.00 177.39 179.86 1h7d h GLY 23 N 0.00 0.01 2.00 -3.96 0.00 -1.90 1.75 103.07 100.97 1h7d h GLY 23 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1h7d h GLY 23 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 176.54 176.61 1h7d h LYS 24 N 0.01 0.00 0.00 4.80 2.10 -1.97 -2.70 116.57 118.80 1h7d h LYS 24 Ca 0.30 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 58.72 1h7d h LYS 24 Cb 1.21 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.49 1h7d h LYS 24 CO -0.01 0.00 -1.87 0.28 -2.00 0.00 0.00 179.45 175.86 1h7d n VAL 25 N -2.33 0.87 -2.07 0.07 0.31 0.44 -3.74 118.33 111.88 1h7d n VAL 25 Ca 0.03 -0.49 -0.38 0.00 -0.01 0.00 0.00 64.34 63.49 1h7d n VAL 25 Cb 0.31 -0.76 0.03 0.00 -0.91 0.00 0.00 33.84 32.51 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 -2.57 6.29 0.00 3.52 0.00 0.49 -3.85 120.51 124.39 1h7d n ALA 26 Ca -0.22 -4.20 0.00 0.00 0.00 0.00 0.00 53.44 49.01 1h7d n ALA 26 Cb 0.88 -1.84 0.00 0.00 0.00 0.00 0.00 19.45 18.49 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 -0.48 0.00 -0.05 0.00 0.00 -1.03 -4.78 118.16 111.82 1h7d n LYS 27 Ca 0.51 0.00 -0.14 0.00 0.00 0.00 0.00 58.31 58.68 1h7d n LYS 27 Cb 0.28 0.00 -0.07 0.00 0.00 0.00 0.00 35.03 35.24 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 1.36 -0.53 3.15 2.02 -1.68 -3.20 112.91 114.03 1h7d h THR 28 Ca 0.00 -1.53 -0.09 0.00 0.77 0.00 0.00 66.41 65.55 1h7d h THR 28 Cb 0.00 1.96 -0.02 0.00 -1.74 0.00 0.00 68.15 68.35 1h7d h THR 28 CO 0.00 0.46 -0.04 0.22 0.37 0.00 0.00 175.52 176.53 1h7d h TYR 29 N 0.10 1.01 0.00 3.16 3.20 -1.80 0.42 116.97 123.06 1h7d h TYR 29 Ca 0.01 -0.17 0.00 0.00 3.14 0.00 0.00 58.73 61.70 1h7d h TYR 29 Cb 0.88 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.88 1h7d h TYR 29 CO 0.10 0.93 0.26 0.37 -1.64 0.00 0.00 178.16 178.18 1h7d h GLN 30 N 0.85 0.00 0.00 1.82 5.75 -1.81 0.12 115.11 121.84 1h7d h GLN 30 Ca 0.15 0.00 -0.22 0.00 -0.15 0.00 0.00 58.65 58.43 1h7d h GLN 30 Cb 0.56 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.07 1h7d h GLN 30 CO 0.03 0.00 -1.79 0.34 -2.65 0.00 0.00 178.83 174.76 1h7d n PHE 31 N -2.79 0.00 0.27 3.99 -0.00 -0.81 -4.46 117.46 113.66 1h7d n PHE 31 Ca -0.02 0.00 0.16 0.00 -0.00 0.00 0.00 57.45 57.59 1h7d n PHE 31 Cb 0.31 -0.53 0.87 0.00 -0.00 0.00 0.00 39.48 40.13 1h7d n PHE 31 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 1h7d h LEU 32 N -0.21 0.00 -0.17 -2.13 6.46 0.39 0.17 115.31 119.82 1h7d h LEU 32 Ca -0.33 0.00 -0.15 0.00 -0.12 0.00 0.00 57.88 57.28 1h7d h LEU 32 Cb 1.41 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.35 1h7d h LEU 32 CO -0.12 0.00 -0.48 0.15 -0.62 0.00 0.00 178.44 177.37 1h7d h PHE 33 N 0.00 0.81 0.00 1.25 3.57 -0.99 -3.42 116.94 118.16 1h7d h PHE 33 Ca 0.00 -0.32 0.00 0.00 3.53 0.00 0.00 57.97 61.18 1h7d h PHE 33 Cb 0.18 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.78 1h7d h PHE 33 CO 0.00 1.10 0.00 -1.13 -2.23 0.00 0.00 178.31 176.05 1h7d n SER 34 N -4.19 0.00 -3.07 0.41 3.41 0.02 -5.01 113.62 105.19 1h7d n SER 34 Ca -0.07 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.54 1h7d n SER 34 Cb 0.58 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.53 1h7d n SER 34 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1h7d n ILE 35 N 0.00 -3.76 -3.73 -1.33 -5.35 -1.06 -5.01 119.36 99.12 1h7d n ILE 35 Ca 0.00 0.70 -0.13 0.00 -0.27 0.00 0.00 62.75 63.04 1h7d n ILE 35 Cb 0.00 -3.62 -0.10 0.00 -1.74 0.00 0.00 39.64 34.19 1h7d n ILE 35 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1h7d s GLY 36 N -0.82 -0.27 -0.07 3.28 0.00 -1.26 -5.04 107.32 103.14 1h7d s GLY 36 Ca -0.02 0.94 0.06 0.00 0.00 0.00 0.00 44.72 45.71 1h7d s GLY 36 CO 0.15 0.77 0.03 0.54 0.00 0.00 0.00 173.10 174.59 1h7d n ARG 37 N 2.42 2.79 0.00 2.90 1.74 -1.26 -5.03 116.66 120.21 1h7d n ARG 37 Ca -0.15 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.92 1h7d n ARG 37 Cb 0.57 -1.18 0.00 0.00 -1.02 0.00 0.00 32.46 30.83 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 0.00 3.09 0.00 0.00 0.04 -1.26 -4.51 135.00 132.36 1h7d s PRO 39 Ca 0.00 0.38 0.00 0.00 0.04 0.00 0.00 61.00 61.42 1h7d s PRO 39 Cb 0.00 -4.21 0.00 0.00 0.04 0.00 0.00 34.50 30.33 1h7d s PRO 39 CO 0.00 -2.21 0.00 1.51 0.04 0.00 0.00 177.00 176.34 1h7d n ILE 40 N 6.87 0.00 -2.70 0.56 0.13 -1.26 -5.01 119.36 117.95 1h7d n ILE 40 Ca 0.13 0.00 -0.06 0.00 -1.10 0.00 0.00 62.75 61.72 1h7d n ILE 40 Cb 0.50 -0.33 0.09 0.00 -0.84 0.00 0.00 39.64 39.06 1h7d n ILE 40 CO 0.00 0.00 0.00 -0.11 2.80 0.00 0.00 176.55 179.24 1h7d n LEU 41 N -2.23 -1.86 -2.66 9.51 0.00 -1.26 -5.03 117.00 113.47 1h7d n LEU 41 Ca 0.00 -2.68 -0.04 0.00 0.00 0.00 0.00 56.01 53.29 1h7d n LEU 41 Cb 0.00 0.88 0.10 0.00 0.00 0.00 0.00 43.42 44.40 1h7d n LEU 41 CO 0.00 1.81 0.70 0.00 0.00 0.00 0.00 177.39 179.90 1h7d n ALA 42 N 0.77 -3.36 -0.04 1.96 0.00 -1.26 -5.04 120.51 113.55 1h7d n ALA 42 Ca 0.01 -0.34 -0.13 0.00 0.00 0.00 0.00 53.44 52.98 1h7d n ALA 42 Cb 0.71 -3.21 -0.11 0.00 0.00 0.00 0.00 19.45 16.84 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 0.73 1.56 0.00 0.00 1.03 -1.95 -3.46 112.91 110.81 1h7d h THR 43 Ca -0.29 -1.63 0.00 0.00 -0.01 0.00 0.00 66.41 64.47 1h7d h THR 43 Cb 1.22 2.67 0.00 0.00 -1.07 0.00 0.00 68.15 70.97 1h7d h THR 43 CO -0.09 0.42 0.00 1.67 -0.01 0.00 0.00 175.52 177.51 1h7d n GLN 44 N -4.76 0.00 0.00 0.00 0.00 -1.26 -5.15 117.38 106.21 1h7d n GLN 44 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.91 1h7d n GLN 44 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.58 1h7d n GLN 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1h7d n GLY 45 N 0.00 -2.09 0.10 1.69 0.00 -1.26 -4.68 105.19 98.94 1h7d n GLY 45 Ca 0.00 -1.99 -0.15 0.00 0.00 0.00 0.00 46.02 43.88 1h7d n GLY 45 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1h7d h PRO 46 N 0.00 0.18 0.00 1.61 0.13 -2.02 -3.49 132.00 128.41 1h7d h PRO 46 Ca 0.00 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1h7d h PRO 46 Cb 0.00 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.18 1h7d h PRO 46 CO 0.00 0.88 0.00 0.25 -0.23 0.00 0.00 178.00 178.90 1h7d n THR 47 N -4.53 0.00 0.16 1.56 -2.24 -1.26 -4.93 114.28 103.03 1h7d n THR 47 Ca -0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1h7d n THR 47 Cb 0.48 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1h7d n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50