#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zxw s PRO 7 N 0.00 4.16 0.24 0.00 0.04 -1.26 -5.05 135.00 133.13 2zxw s PRO 7 Ca 0.00 2.51 -0.01 0.00 0.04 0.00 0.00 61.00 63.55 2zxw s PRO 7 Cb 0.00 -3.46 0.05 0.00 0.04 0.00 0.00 34.50 31.13 2zxw s PRO 7 CO 0.00 -0.78 0.33 -0.40 0.04 0.00 0.00 177.00 176.19 2zxw n ASP 8 N 5.20 0.36 -0.23 6.66 3.85 -1.26 -4.86 116.55 126.27 2zxw n ASP 8 Ca 0.17 -1.32 0.03 0.00 -0.71 0.00 0.00 54.79 52.95 2zxw n ASP 8 Cb 0.38 -0.22 0.15 0.00 -1.35 0.00 0.00 41.12 40.09 2zxw n ASP 8 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.20 176.34 2zxw h PHE 9 N -0.57 0.38 0.00 2.11 3.57 -1.99 -2.31 116.94 118.12 2zxw h PHE 9 Ca -0.11 0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.34 2zxw h PHE 9 Cb 0.38 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 2zxw h PHE 9 CO 0.00 0.02 -0.41 0.45 -2.23 0.00 0.00 178.31 176.14 2zxw h HIS 10 N 0.37 0.00 -0.04 0.41 -0.00 -1.94 0.10 115.15 114.05 2zxw h HIS 10 Ca 0.37 0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.67 2zxw h HIS 10 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.98 2zxw h HIS 10 CO -0.20 0.41 -0.26 -0.44 -0.00 0.00 0.00 177.93 177.44 2zxw h ASP 11 N 0.00 0.29 -0.24 2.45 3.32 -1.80 0.54 116.42 120.98 2zxw h ASP 11 Ca -0.00 -0.69 -0.04 0.00 0.02 0.00 0.00 57.03 56.32 2zxw h ASP 11 Cb 0.82 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.28 2zxw h ASP 11 CO 0.05 0.93 -0.01 0.11 -1.72 0.00 0.00 179.24 178.60 2zxw h LYS 12 N -0.33 0.42 -0.00 3.56 1.57 -1.23 -3.39 116.57 117.18 2zxw h LYS 12 Ca -0.02 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2zxw h LYS 12 Cb 0.94 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.22 2zxw h LYS 12 CO 0.05 0.62 -0.04 0.66 -0.57 0.00 0.00 179.45 180.17 2zxw n TYR 13 N -4.63 0.00 -0.19 -1.35 4.01 0.34 -4.77 117.16 110.57 2zxw n TYR 13 Ca -0.04 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.61 2zxw n TYR 13 Cb 0.25 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.24 2zxw n TYR 13 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2zxw h GLY 14 N 0.54 -0.53 1.83 2.72 0.00 -0.93 -1.71 103.07 105.00 2zxw h GLY 14 Ca 0.00 0.58 -0.08 0.00 0.00 0.00 0.00 47.33 47.84 2zxw h GLY 14 CO 0.00 -0.15 -0.27 3.43 0.00 0.00 0.00 176.54 179.54 2zxw h ASN 15 N -0.25 0.20 0.11 0.19 2.35 -1.86 -1.26 115.58 115.06 2zxw h ASN 15 Ca 0.16 -0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 2zxw h ASN 15 Cb 0.57 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.88 2zxw h ASN 15 CO -0.67 0.48 -0.06 0.00 -1.65 0.00 0.00 177.43 175.53 2zxw h ALA 16 N 1.54 -0.15 -0.57 -0.83 0.00 -1.78 -2.26 119.26 115.22 2zxw h ALA 16 Ca 0.03 -0.23 0.12 0.00 0.00 0.00 0.00 54.91 54.82 2zxw h ALA 16 Cb 0.58 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.33 2zxw h ALA 16 CO 0.04 -0.33 -0.04 0.28 0.00 0.00 0.00 179.25 179.20 2zxw h VAL 17 N -0.67 0.50 0.03 0.00 2.07 -1.04 0.27 116.25 117.41 2zxw h VAL 17 Ca -0.02 -0.03 0.01 0.00 0.82 0.00 0.00 66.70 67.49 2zxw h VAL 17 Cb 0.51 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 2zxw h VAL 17 CO 0.03 0.01 -0.09 0.25 0.02 0.00 0.00 177.57 177.79 2zxw h LEU 18 N 0.08 -0.25 -0.10 2.57 5.85 -1.28 0.18 115.31 122.35 2zxw h LEU 18 Ca 0.29 0.03 -0.24 0.00 0.84 0.00 0.00 57.88 58.80 2zxw h LEU 18 Cb 0.45 0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.59 2zxw h LEU 18 CO -0.52 -0.13 -1.02 0.00 -0.34 0.00 0.00 178.44 176.43 2zxw h ALA 19 N 0.79 0.30 -0.17 1.25 0.00 -0.77 -1.67 119.26 118.99 2zxw h ALA 19 Ca 0.02 -0.75 -0.14 0.00 0.00 0.00 0.00 54.91 54.05 2zxw h ALA 19 Cb 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2zxw h ALA 19 CO -0.07 0.85 -0.43 0.77 0.00 0.00 0.00 179.25 180.37 2zxw h SER 20 N 0.19 0.66 0.21 0.00 0.02 -0.51 -1.37 113.55 112.75 2zxw h SER 20 Ca -0.09 -0.58 0.01 0.00 -0.84 0.00 0.00 61.79 60.29 2zxw h SER 20 Cb 1.67 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 63.99 2zxw h SER 20 CO 0.17 1.12 -0.29 1.23 -1.14 0.00 0.00 176.83 177.92 2zxw h GLY 21 N 0.24 -0.61 1.29 -3.77 0.00 -0.95 0.33 103.07 99.60 2zxw h GLY 21 Ca -0.01 0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.66 2zxw h GLY 21 CO 0.09 -0.25 0.39 0.00 0.00 0.00 0.00 176.54 176.78 2zxw h ALA 22 N 0.07 1.40 0.53 3.60 0.00 -1.31 0.18 119.26 123.73 2zxw h ALA 22 Ca 0.01 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2zxw h ALA 22 Cb 0.55 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.07 2zxw h ALA 22 CO -0.12 0.50 -0.25 1.15 0.00 0.00 0.00 179.25 180.53 2zxw h THR 23 N 0.95 0.18 -0.71 0.00 2.02 -0.98 -2.43 112.91 111.94 2zxw h THR 23 Ca 0.25 -0.48 0.16 0.00 0.77 0.00 0.00 66.41 67.10 2zxw h THR 23 Cb -0.01 0.27 -0.11 0.00 -1.74 0.00 0.00 68.15 66.56 2zxw h THR 23 CO -0.04 0.03 0.10 0.15 0.37 0.00 0.00 175.52 176.13 2zxw h PHE 24 N -1.11 0.13 -0.22 3.16 3.57 -0.71 -1.38 116.94 120.39 2zxw h PHE 24 Ca -0.07 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2zxw h PHE 24 Cb 0.60 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.38 2zxw h PHE 24 CO 0.01 -0.14 0.14 0.00 -2.23 0.00 0.00 178.31 176.09 2zxw h VAL 26 N 0.28 1.28 0.07 0.00 2.07 -1.14 -2.34 116.25 116.46 2zxw h VAL 26 Ca 0.08 -1.49 -0.00 0.00 0.82 0.00 0.00 66.70 66.11 2zxw h VAL 26 Cb -0.02 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2zxw h VAL 26 CO -0.03 0.50 -0.03 0.00 0.02 0.00 0.00 177.57 178.03 2zxw h ALA 27 N 0.90 -0.10 -0.03 1.67 0.00 -0.80 -2.45 119.26 118.46 2zxw h ALA 27 Ca 0.07 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 2zxw h ALA 27 Cb 0.89 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2zxw h ALA 27 CO 0.08 -0.40 -0.51 -0.24 0.00 0.00 0.00 179.25 178.17 2zxw h VAL 28 N -0.40 1.36 -0.10 0.00 3.04 -1.12 -2.26 116.25 116.77 2zxw h VAL 28 Ca -0.01 -1.76 -0.04 0.00 -1.01 0.00 0.00 66.70 63.88 2zxw h VAL 28 Cb 0.34 1.91 -0.00 0.00 -2.01 0.00 0.00 31.29 31.54 2zxw h VAL 28 CO 0.02 0.51 -0.08 -0.50 -1.01 0.00 0.00 177.57 176.51 2zxw h TRP 29 N 0.07 0.28 -0.61 3.17 4.06 -1.36 -1.37 115.95 120.19 2zxw h TRP 29 Ca -0.00 -0.08 0.08 0.00 2.06 0.00 0.00 58.89 60.95 2zxw h TRP 29 Cb 0.93 -0.06 -0.07 0.00 -1.00 0.00 0.00 29.16 28.96 2zxw h TRP 29 CO 0.01 0.62 0.26 0.28 -3.56 0.00 0.00 178.44 176.05 2zxw h VAL 30 N -0.15 0.83 -0.27 1.49 2.07 -1.44 0.19 116.25 118.97 2zxw h VAL 30 Ca 0.02 -0.16 0.02 0.00 0.82 0.00 0.00 66.70 67.40 2zxw h VAL 30 Cb 0.56 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 2zxw h VAL 30 CO 0.02 0.09 0.12 0.22 0.02 0.00 0.00 177.57 178.04 2zxw h TYR 31 N 0.47 0.22 -0.58 1.57 5.03 -1.24 -1.08 116.97 121.37 2zxw h TYR 31 Ca 0.30 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.60 2zxw h TYR 31 Cb 0.32 -0.06 -0.03 0.00 1.55 0.00 0.00 36.73 38.51 2zxw h TYR 31 CO -0.14 0.11 0.29 1.98 -1.32 0.00 0.00 178.16 179.09 2zxw h MET 32 N 0.26 0.83 0.00 1.82 4.05 -0.73 -0.20 114.93 120.95 2zxw h MET 32 Ca 0.12 -0.11 -0.04 0.00 -0.28 0.00 0.00 59.70 59.38 2zxw h MET 32 Cb 0.06 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 30.70 2zxw h MET 32 CO -0.10 0.66 -0.19 0.00 0.23 0.00 0.00 176.91 177.52 2zxw h ALA 33 N 1.12 1.14 0.00 0.39 0.00 -0.15 -3.38 119.26 118.39 2zxw h ALA 33 Ca 0.20 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2zxw h ALA 33 Cb 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2zxw h ALA 33 CO -0.03 0.23 -0.09 0.25 0.00 0.00 0.00 179.25 179.62 2zxw n THR 34 N -3.52 0.00 0.06 0.00 -2.24 -0.45 -4.81 114.28 103.31 2zxw n THR 34 Ca -0.01 -0.19 0.02 0.00 -2.27 0.00 0.00 64.05 61.60 2zxw n THR 34 Cb 0.34 0.86 0.02 0.00 -2.10 0.00 0.00 70.33 69.45 2zxw n THR 34 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2zxw n GLN 35 N -0.50 0.79 -0.01 -0.78 1.13 -0.10 -4.68 117.38 113.22 2zxw n GLN 35 Ca 0.00 -1.05 0.00 0.00 -1.94 0.00 0.00 57.00 54.01 2zxw n GLN 35 Cb 0.00 -1.06 0.01 0.00 0.11 0.00 0.00 30.24 29.30 2zxw n GLN 35 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 2zxw n ILE 36 N 0.02 0.49 -2.49 5.09 -5.35 -1.26 -5.02 119.36 110.84 2zxw n ILE 36 Ca 0.02 -0.75 -0.04 0.00 -0.27 0.00 0.00 62.75 61.72 2zxw n ILE 36 Cb 0.16 0.76 0.02 0.00 -1.74 0.00 0.00 39.64 38.84 2zxw n ILE 36 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2zxw n GLY 37 N -0.17 0.48 3.74 3.28 0.00 -1.26 -5.04 105.19 106.21 2zxw n GLY 37 Ca 0.01 -0.43 -0.40 0.00 0.00 0.00 0.00 46.02 45.19 2zxw n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2zxw s ILE 38 N -3.07 4.59 -0.48 -0.61 1.01 -1.26 -5.02 121.20 116.37 2zxw s ILE 38 Ca 0.06 1.83 -0.23 0.00 0.00 0.00 0.00 60.65 62.30 2zxw s ILE 38 Cb -0.02 -4.21 0.03 0.00 0.01 0.00 0.00 42.46 38.27 2zxw s ILE 38 CO 0.14 0.36 0.81 -0.70 0.00 0.00 0.00 174.94 175.55 2zxw s GLU 39 N -0.16 3.37 0.32 2.79 2.56 -1.26 -4.89 118.70 121.43 2zxw s GLU 39 Ca 0.42 -0.19 0.24 0.00 0.00 0.00 0.00 54.97 55.44 2zxw s GLU 39 Cb -0.22 -3.97 0.53 0.00 2.00 0.00 0.00 34.13 32.47 2zxw s GLU 39 CO 0.26 -1.20 1.65 -1.49 -0.56 0.00 0.00 175.26 173.92 2zxw h TRP 40 N 9.05 0.00 -6.17 5.30 4.06 -1.95 -3.48 115.95 122.75 2zxw h TRP 40 Ca -0.25 0.00 -0.38 0.00 2.06 0.00 0.00 58.89 60.32 2zxw h TRP 40 Cb 1.08 0.00 0.07 0.00 -1.00 0.00 0.00 29.16 29.31 2zxw h TRP 40 CO 0.82 0.00 -0.83 -1.71 -3.56 0.00 0.00 178.44 173.16 2zxw n ASN 41 N -2.69 -5.64 -4.61 -3.49 5.15 -1.26 -4.98 115.26 97.74 2zxw n ASN 41 Ca 0.05 -0.88 -0.29 0.00 -0.60 0.00 0.00 54.58 52.86 2zxw n ASN 41 Cb 0.48 -3.42 0.15 0.00 -0.53 0.00 0.00 39.78 36.46 2zxw n ASN 41 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2zxw s PRO 42 N -5.40 0.95 0.30 1.20 0.04 -1.26 -4.97 135.00 125.86 2zxw s PRO 42 Ca 0.35 0.13 -0.30 0.00 0.04 0.00 0.00 61.00 61.22 2zxw s PRO 42 Cb -0.12 -1.83 -0.11 0.00 0.04 0.00 0.00 34.50 32.48 2zxw s PRO 42 CO 0.85 -2.29 1.53 0.45 0.04 0.00 0.00 177.00 177.57 2zxw s SER 43 N -4.22 6.45 0.55 6.66 0.15 -1.26 -4.90 113.70 117.13 2zxw s SER 43 Ca 0.66 2.90 0.32 0.00 0.70 0.00 0.00 55.95 60.52 2zxw s SER 43 Cb -0.12 -2.64 1.52 0.00 -1.71 0.00 0.00 66.02 63.07 2zxw s SER 43 CO 0.53 -0.84 2.06 -0.65 1.20 0.00 0.00 173.24 175.54 2zxw h PRO 44 N 4.46 0.00 -6.19 5.44 0.11 -1.96 -3.42 132.00 130.44 2zxw h PRO 44 Ca -0.48 0.00 -0.67 0.00 0.11 0.00 0.00 66.00 64.97 2zxw h PRO 44 Cb 1.22 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.35 2zxw h PRO 44 CO 0.75 0.07 1.07 0.28 -0.21 0.00 0.00 178.00 179.97 2zxw n VAL 45 N -3.32 0.44 -0.71 3.15 0.31 -1.26 -0.65 118.33 116.29 2zxw n VAL 45 Ca -0.01 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2zxw n VAL 45 Cb 0.26 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.56 2zxw n VAL 45 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2zxw n GLY 46 N 4.57 1.01 0.02 2.92 0.00 -1.26 -4.74 105.19 107.72 2zxw n GLY 46 Ca 0.26 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.26 2zxw n GLY 46 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2zxw n ARG 47 N -2.00 2.68 -3.84 1.61 1.85 0.17 -5.04 116.66 112.10 2zxw n ARG 47 Ca 0.00 0.00 -0.37 0.00 -1.00 0.00 0.00 57.85 56.49 2zxw n ARG 47 Cb 0.00 -1.11 -0.06 0.00 -1.05 0.00 0.00 32.46 30.24 2zxw n ARG 47 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2zxw s VAL 48 N -2.10 5.47 -0.35 8.89 1.01 -0.16 -5.07 120.40 128.09 2zxw s VAL 48 Ca -0.03 0.24 -0.19 0.00 0.00 0.00 0.00 61.98 62.00 2zxw s VAL 48 Cb 0.01 -3.43 -0.00 0.00 0.00 0.00 0.00 36.38 32.96 2zxw s VAL 48 CO 0.16 0.59 0.55 -0.89 0.00 0.00 0.00 175.10 175.51 2zxw s THR 49 N -0.78 4.98 0.33 3.92 2.01 -1.26 -4.90 115.64 119.94 2zxw s THR 49 Ca 0.14 0.44 -0.29 0.00 0.31 0.00 0.00 61.69 62.29 2zxw s THR 49 Cb -0.12 -3.99 -0.12 0.00 0.01 0.00 0.00 72.50 68.28 2zxw s THR 49 CO 0.03 -0.23 1.46 -2.65 -0.69 0.00 0.00 174.62 172.55 2zxw n PRO 50 N 5.82 2.49 -4.59 4.92 -0.02 -1.26 -5.00 135.00 137.36 2zxw n PRO 50 Ca -0.04 0.88 -0.27 0.00 -2.02 0.00 0.00 63.50 62.05 2zxw n PRO 50 Cb 0.49 -2.58 -0.14 0.00 -0.02 0.00 0.00 33.50 31.25 2zxw n PRO 50 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2zxw s LYS 51 N -1.45 1.44 0.24 -0.52 2.20 -1.26 -5.10 119.74 115.29 2zxw s LYS 51 Ca 0.58 -1.11 -0.31 0.00 -0.36 0.00 0.00 55.97 54.77 2zxw s LYS 51 Cb -0.52 -1.68 -0.13 0.00 -1.51 0.00 0.00 37.83 34.00 2zxw s LYS 51 CO 0.58 0.42 1.55 0.39 -0.36 0.00 0.00 175.35 177.93 2zxw n GLU 52 N 1.50 2.41 0.00 4.03 -0.58 -1.26 -4.91 120.64 121.83 2zxw n GLU 52 Ca -0.18 0.86 0.00 0.00 -0.42 0.00 0.00 57.16 57.43 2zxw n GLU 52 Cb 0.53 -2.61 0.00 0.00 -0.57 0.00 0.00 31.44 28.78 2zxw n GLU 52 CO 0.00 0.00 0.00 -2.67 -0.48 0.00 0.00 177.13 173.98 2zxw n TRP 53 N 2.57 0.00 1.05 -0.32 4.27 -1.26 -5.33 117.44 118.42 2zxw n TRP 53 Ca 0.12 0.00 0.08 0.00 -3.89 0.00 0.00 57.50 53.82 2zxw n TRP 53 Cb 0.33 0.00 0.50 0.00 -1.36 0.00 0.00 31.31 30.79 2zxw n TRP 53 CO 0.00 0.00 0.00 -2.13 -2.29 0.00 0.00 177.69 173.27