#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nlq h HIS 2 N 0.00 0.19 0.14 2.11 -0.00 -1.92 -0.47 115.15 115.21 2nlq h HIS 2 Ca 0.00 0.03 0.02 0.00 -0.00 0.00 0.00 60.37 60.42 2nlq h HIS 2 Cb 0.00 -0.01 -0.04 0.00 -0.00 0.00 0.00 27.41 27.37 2nlq h HIS 2 CO 0.00 0.00 -0.31 -0.92 -0.00 0.00 0.00 177.93 176.70 2nlq h TYR 3 N 0.26 -0.84 -0.05 5.26 3.20 -1.99 -1.40 116.97 121.41 2nlq h TYR 3 Ca 0.27 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 62.01 2nlq h TYR 3 Cb 0.37 0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 2nlq h TYR 3 CO -0.23 -0.42 -0.62 -0.91 -1.64 0.00 0.00 178.16 174.34 2nlq h ASN 4 N -0.55 0.20 0.42 -2.11 2.35 -1.94 0.21 115.58 114.16 2nlq h ASN 4 Ca 0.02 -0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.64 2nlq h ASN 4 Cb 0.56 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.86 2nlq h ASN 4 CO -0.17 0.77 -0.38 0.00 -1.65 0.00 0.00 177.43 176.01 2nlq h VAL 6 N -0.79 1.23 -0.76 0.00 2.07 -1.21 0.33 116.25 117.12 2nlq h VAL 6 Ca -0.05 -0.90 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 2nlq h VAL 6 Cb 0.68 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 2nlq h VAL 6 CO -0.03 0.33 0.45 0.28 0.02 0.00 0.00 177.57 178.62 2nlq h SER 7 N 0.77 0.92 -0.20 0.57 0.02 -0.80 -2.39 113.55 112.44 2nlq h SER 7 Ca 0.16 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 2nlq h SER 7 Cb 0.37 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.68 2nlq h SER 7 CO 0.01 0.71 0.00 -1.54 -1.14 0.00 0.00 176.83 174.87 2nlq n SER 8 N -4.38 1.05 0.00 3.07 3.41 0.21 -4.89 113.62 112.10 2nlq n SER 8 Ca 0.08 -2.00 0.00 0.00 -0.26 0.00 0.00 58.87 56.69 2nlq n SER 8 Cb 0.08 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 2nlq n SER 8 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2nlq n GLY 9 N 0.81 0.77 2.93 5.00 0.00 -0.90 -5.04 105.19 108.76 2nlq n GLY 9 Ca 0.07 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.92 2nlq n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nlq n GLY 10 N -2.22 2.28 3.14 -0.02 0.00 0.08 -4.90 105.19 103.56 2nlq n GLY 10 Ca 0.00 -2.23 -0.13 0.00 0.00 0.00 0.00 46.02 43.66 2nlq n GLY 10 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2nlq s GLN 11 N -3.88 0.75 -0.16 1.61 -2.07 -0.02 -3.78 119.66 112.11 2nlq s GLN 11 Ca 0.38 -1.08 -0.16 0.00 -1.82 0.00 0.00 55.36 52.67 2nlq s GLN 11 Cb -0.03 -0.39 -0.04 0.00 -1.09 0.00 0.00 33.01 31.46 2nlq s GLN 11 CO 0.24 0.05 0.40 0.00 -1.32 0.00 0.00 175.29 174.66 2nlq s LEU 13 N 0.89 1.60 0.12 0.00 1.43 0.64 -4.96 118.68 118.39 2nlq s LEU 13 Ca 0.21 0.06 0.06 0.00 -1.03 0.00 0.00 54.13 53.43 2nlq s LEU 13 Cb -0.14 0.06 -0.21 0.00 0.03 0.00 0.00 46.19 45.92 2nlq s LEU 13 CO 0.08 -0.05 1.27 1.88 0.23 0.00 0.00 176.35 179.75 2nlq h TYR 14 N 6.51 0.03 -2.32 0.29 -1.99 -1.89 -0.49 116.97 117.11 2nlq h TYR 14 Ca -0.31 -0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.39 2nlq h TYR 14 Cb 1.18 -0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.91 2nlq h TYR 14 CO 0.44 1.02 0.00 -1.13 -0.00 0.00 0.00 178.16 178.49 2nlq n SER 15 N -3.36 0.00 -4.75 3.88 3.41 -1.26 -4.84 113.62 106.71 2nlq n SER 15 Ca -0.01 -0.84 -0.34 0.00 -0.26 0.00 0.00 58.87 57.42 2nlq n SER 15 Cb 0.95 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.96 2nlq n SER 15 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nlq s ALA 16 N -3.52 2.34 0.33 7.33 0.00 -1.26 -4.89 121.76 122.10 2nlq s ALA 16 Ca 0.00 0.82 -0.29 0.00 0.00 0.00 0.00 51.96 52.49 2nlq s ALA 16 Cb 0.00 -3.42 -0.11 0.00 0.00 0.00 0.00 23.12 19.59 2nlq s ALA 16 CO 0.00 -1.49 1.50 0.00 0.00 0.00 0.00 175.76 175.78 2nlq s PRO 18 N -1.29 0.30 0.24 0.00 0.04 -1.26 -4.89 135.00 128.13 2nlq s PRO 18 Ca 0.57 0.43 -0.31 0.00 0.04 0.00 0.00 61.00 61.73 2nlq s PRO 18 Cb -0.46 -1.73 -0.14 0.00 0.04 0.00 0.00 34.50 32.21 2nlq s PRO 18 CO 0.54 -2.80 1.32 1.51 0.04 0.00 0.00 177.00 177.62 2nlq n ILE 19 N -4.21 1.12 -1.03 0.56 3.06 -1.26 -1.92 119.36 115.68 2nlq n ILE 19 Ca 0.06 -0.28 -0.01 0.00 -2.50 0.00 0.00 62.75 60.02 2nlq n ILE 19 Cb 0.58 -1.33 -0.00 0.00 0.54 0.00 0.00 39.64 39.42 2nlq n ILE 19 CO 0.00 0.00 0.00 0.49 -2.50 0.00 0.00 176.55 174.54 2nlq n PHE 20 N 1.55 0.00 -4.19 9.51 0.99 -1.26 -5.03 117.46 119.03 2nlq n PHE 20 Ca 0.11 0.00 -0.12 0.00 -0.00 0.00 0.00 57.45 57.45 2nlq n PHE 20 Cb 0.31 -0.55 -0.10 0.00 -1.00 0.00 0.00 39.48 38.14 2nlq n PHE 20 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 2nlq s THR 21 N -2.02 0.67 0.13 4.37 -4.23 -0.81 -4.97 115.64 108.79 2nlq s THR 21 Ca 0.00 -1.95 0.02 0.00 -1.18 0.00 0.00 61.69 58.58 2nlq s THR 21 Cb 0.00 -1.84 -0.04 0.00 1.34 0.00 0.00 72.50 71.95 2nlq s THR 21 CO 0.00 -0.73 -0.03 -1.59 -0.54 0.00 0.00 174.62 171.73 2nlq s LYS 22 N -3.87 0.97 0.14 3.99 -2.85 -1.26 -4.73 119.74 112.13 2nlq s LYS 22 Ca 0.16 -1.43 -0.31 0.00 -1.00 0.00 0.00 55.97 53.39 2nlq s LYS 22 Cb 0.06 -0.22 -0.10 0.00 -2.06 0.00 0.00 37.83 35.50 2nlq s LYS 22 CO -0.02 -0.08 1.73 0.42 0.10 0.00 0.00 175.35 177.51 2nlq s ILE 23 N -3.65 2.54 -0.46 3.79 1.01 -1.26 -1.19 121.20 121.98 2nlq s ILE 23 Ca 0.18 0.20 0.06 0.00 0.00 0.00 0.00 60.65 61.09 2nlq s ILE 23 Cb 0.06 -3.13 0.21 0.00 0.01 0.00 0.00 42.46 39.61 2nlq s ILE 23 CO -0.00 0.01 0.65 0.00 0.00 0.00 0.00 174.94 175.59 2nlq n GLN 24 N 5.01 0.56 0.00 2.79 6.02 0.75 -4.92 117.38 127.59 2nlq n GLN 24 Ca 0.16 -2.42 0.00 0.00 -0.01 0.00 0.00 57.00 54.73 2nlq n GLN 24 Cb 0.38 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.17 2nlq n GLN 24 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nlq n GLY 25 N 2.28 -2.69 3.36 1.08 0.00 -1.26 -4.60 105.19 103.36 2nlq n GLY 25 Ca 0.19 -2.14 -0.18 0.00 0.00 0.00 0.00 46.02 43.88 2nlq n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2nlq s THR 26 N -0.68 0.82 0.06 2.61 -4.23 -1.26 -1.04 115.64 111.92 2nlq s THR 26 Ca 0.00 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.46 2nlq s THR 26 Cb 0.00 -2.62 -0.02 0.00 1.34 0.00 0.00 72.50 71.20 2nlq s THR 26 CO 0.00 -0.06 0.08 0.00 -0.54 0.00 0.00 174.62 174.09 2nlq n TYR 28 N 0.24 -1.81 -3.90 0.00 0.53 -1.26 -1.24 117.16 109.71 2nlq n TYR 28 Ca -0.16 0.67 -0.29 0.00 -1.02 0.00 0.00 57.90 57.10 2nlq n TYR 28 Cb 0.61 -3.90 0.03 0.00 -1.03 0.00 0.00 39.34 35.05 2nlq n TYR 28 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38 2nlq n ARG 29 N -2.96 -5.42 -0.92 -0.72 5.12 -1.26 -1.91 116.66 108.59 2nlq n ARG 29 Ca -0.10 0.59 0.00 0.00 -1.93 0.00 0.00 57.85 56.42 2nlq n ARG 29 Cb 0.60 -5.44 0.00 0.00 -1.16 0.00 0.00 32.46 26.46 2nlq n ARG 29 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2nlq n GLY 30 N -1.68 0.95 0.04 -0.13 0.00 -1.04 -4.89 105.19 98.44 2nlq n GLY 30 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2nlq n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nlq n ALA 31 N 0.76 2.74 -2.34 4.61 0.00 -0.80 -4.80 120.51 120.67 2nlq n ALA 31 Ca 0.00 -0.18 -0.18 0.00 0.00 0.00 0.00 53.44 53.09 2nlq n ALA 31 Cb 0.00 -1.32 -0.10 0.00 0.00 0.00 0.00 19.45 18.02 2nlq n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2nlq s ALA 32 N -3.06 1.88 -0.00 0.00 0.00 -0.37 -4.87 121.76 115.34 2nlq s ALA 32 Ca 0.11 -1.81 -0.06 0.00 0.00 0.00 0.00 51.96 50.21 2nlq s ALA 32 Cb 0.16 0.52 -0.05 0.00 0.00 0.00 0.00 23.12 23.76 2nlq s ALA 32 CO 0.63 -0.26 0.24 0.15 0.00 0.00 0.00 175.76 176.52 2nlq s LYS 33 N -3.87 3.54 -0.29 0.00 1.02 -0.19 -1.17 119.74 118.77 2nlq s LYS 33 Ca 0.30 -0.14 -0.19 0.00 0.02 0.00 0.00 55.97 55.96 2nlq s LYS 33 Cb 0.06 -3.09 -0.02 0.00 -0.52 0.00 0.00 37.83 34.26 2nlq s LYS 33 CO 0.10 0.66 0.54 0.00 -0.92 0.00 0.00 175.35 175.73