#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nla s LYS 2 N 0.00 0.27 0.00 2.12 2.20 -1.26 -4.98 119.74 118.09 1nla s LYS 2 Ca 0.00 0.45 0.00 0.00 -0.36 0.00 0.00 55.97 56.06 1nla s LYS 2 Cb 0.00 0.06 0.00 0.00 -1.51 0.00 0.00 37.83 36.38 1nla s LYS 2 CO 0.00 -0.05 0.00 0.41 -0.36 0.00 0.00 175.35 175.35 1nla n GLY 3 N 3.33 0.89 7.00 5.54 0.00 -1.26 -4.88 105.19 115.82 1nla n GLY 3 Ca -0.17 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.23 1nla n GLY 3 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1nla n MET 4 N -0.54 0.00 -1.09 1.61 1.56 -1.26 -4.77 117.12 112.63 1nla n MET 4 Ca 0.00 0.00 -0.08 0.00 -0.27 0.00 0.00 57.70 57.35 1nla n MET 4 Cb 0.43 0.00 0.05 0.00 2.15 0.00 0.00 33.22 35.85 1nla n MET 4 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 1nla n SER 5 N -3.29 0.33 -3.26 6.12 7.64 -1.26 -5.02 113.62 114.88 1nla n SER 5 Ca 0.00 -1.32 0.00 0.00 1.01 0.00 0.00 58.87 58.56 1nla n SER 5 Cb 0.00 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.95 1nla n SER 5 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1nla n LYS 6 N -1.70 0.35 -1.70 1.43 2.85 -1.26 -4.89 118.16 113.23 1nla n LYS 6 Ca 0.05 0.00 -0.41 0.00 -1.05 0.00 0.00 58.31 56.90 1nla n LYS 6 Cb 0.19 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.58 1nla n LYS 6 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 177.40 176.02 1nla n MET 7 N -0.48 2.02 -1.89 -1.58 2.81 -1.26 -4.96 117.12 111.78 1nla n MET 7 Ca 0.00 0.71 -0.32 0.00 -1.81 0.00 0.00 57.70 56.29 1nla n MET 7 Cb 0.00 -2.37 0.02 0.00 -0.71 0.00 0.00 33.22 30.16 1nla n MET 7 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1nla s PRO 8 N -2.08 3.37 0.00 0.03 0.04 -1.26 -4.94 135.00 130.16 1nla s PRO 8 Ca 0.59 0.95 0.30 0.00 0.04 0.00 0.00 61.00 62.88 1nla s PRO 8 Cb -0.53 -2.05 1.75 0.00 0.04 0.00 0.00 34.50 33.72 1nla s PRO 8 CO 0.60 -0.75 2.14 1.04 0.04 0.00 0.00 177.00 180.06 1nla n GLN 9 N -2.53 1.07 0.07 4.56 3.00 -1.26 -3.28 117.38 119.01 1nla n GLN 9 Ca 0.07 -0.10 0.04 0.00 -0.01 0.00 0.00 57.00 57.01 1nla n GLN 9 Cb 0.54 -1.48 -0.03 0.00 0.00 0.00 0.00 30.24 29.26 1nla n GLN 9 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 1nla h PHE 10 N 0.24 0.00 -0.91 1.08 3.57 -2.02 -3.32 116.94 115.57 1nla h PHE 10 Ca 0.00 0.00 -0.42 0.00 3.53 0.00 0.00 57.97 61.08 1nla h PHE 10 Cb 0.05 0.00 -0.25 0.00 2.79 0.00 0.00 35.95 38.54 1nla h PHE 10 CO 0.00 0.36 0.53 1.28 -2.23 0.00 0.00 178.31 178.25 1nla n LEU 11 N -2.86 6.50 0.22 0.59 4.77 -1.20 -4.40 117.00 120.60 1nla n LEU 11 Ca -0.05 -3.44 0.11 0.00 -0.03 0.00 0.00 56.01 52.59 1nla n LEU 11 Cb 0.72 -0.81 0.33 0.00 -2.33 0.00 0.00 43.42 41.34 1nla n LEU 11 CO 0.41 0.96 0.78 -1.13 -1.33 0.00 0.00 177.39 177.09 1nla h ASN 12 N 1.52 0.00 0.51 -1.43 -0.73 -1.74 -3.00 115.58 110.71 1nla h ASN 12 Ca 0.51 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.68 1nla h ASN 12 Cb 2.68 0.00 0.00 0.00 0.27 0.00 0.00 38.32 41.27 1nla h ASN 12 CO 0.98 0.16 -0.52 -1.14 -0.37 0.00 0.00 177.43 176.54 1nla n ARG 13 N -3.21 0.02 -2.55 6.67 0.63 -1.26 -4.89 116.66 112.07 1nla n ARG 13 Ca 0.02 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.56 1nla n ARG 13 Cb 0.49 -1.51 -0.04 0.00 0.45 0.00 0.00 32.46 31.85 1nla n ARG 13 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 1nla s TRP 14 N -3.01 3.52 1.11 -0.14 0.52 -1.14 -5.03 118.94 114.77 1nla s TRP 14 Ca 0.11 1.71 -0.17 0.00 0.02 0.00 0.00 56.10 57.76 1nla s TRP 14 Cb 0.17 -3.17 0.25 0.00 -1.15 0.00 0.00 33.47 29.57 1nla s TRP 14 CO 0.70 -0.42 1.15 -1.25 0.02 0.00 0.00 176.95 177.15 1nla s PRO 15 N -1.83 -0.50 0.31 4.98 0.04 -1.26 -4.84 135.00 131.89 1nla s PRO 15 Ca 0.49 -0.04 0.18 0.00 0.04 0.00 0.00 61.00 61.67 1nla s PRO 15 Cb -0.27 -1.68 0.13 0.00 0.04 0.00 0.00 34.50 32.73 1nla s PRO 15 CO 0.34 -3.24 1.44 -0.09 0.04 0.00 0.00 177.00 175.49 1nla h ARG 16 N -2.24 0.00 0.00 4.56 2.43 -1.98 -2.43 114.38 114.71 1nla h ARG 16 Ca -0.46 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 58.63 1nla h ARG 16 Cb 1.29 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.83 1nla h ARG 16 CO 0.40 0.31 -0.38 0.93 -1.51 0.00 0.00 179.97 179.72 1nla h GLU 17 N 0.00 0.00 0.05 0.20 5.08 -1.99 -1.73 114.58 116.19 1nla h GLU 17 Ca -0.01 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.00 1nla h GLU 17 Cb 1.26 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.48 1nla h GLU 17 CO 0.04 0.38 -1.97 0.28 -1.00 0.00 0.00 179.01 176.74 1nla n VAL 18 N -3.72 1.63 0.13 3.13 0.31 -1.21 -4.00 118.33 114.61 1nla n VAL 18 Ca -0.01 -0.45 0.03 0.00 -0.01 0.00 0.00 64.34 63.91 1nla n VAL 18 Cb 0.47 -1.77 0.42 0.00 -0.91 0.00 0.00 33.84 32.04 1nla n VAL 18 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1nla h LEU 19 N -0.35 0.21 -1.22 7.52 3.38 -1.48 -1.91 115.31 121.46 1nla h LEU 19 Ca -0.47 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.39 1nla h LEU 19 Cb 1.77 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 42.46 1nla h LEU 19 CO -0.09 0.34 -0.31 -0.78 0.09 0.00 0.00 178.44 177.69 1nla h ASP 20 N 0.21 0.13 0.25 -0.43 1.82 -1.49 -2.91 116.42 114.01 1nla h ASP 20 Ca 0.05 -0.04 -0.33 0.00 -0.39 0.00 0.00 57.03 56.31 1nla h ASP 20 Cb 0.32 -0.03 0.04 0.00 0.68 0.00 0.00 39.33 40.34 1nla h ASP 20 CO 0.02 0.44 -1.45 0.25 -1.61 0.00 0.00 179.24 176.90 1nla h LEU 21 N 0.11 0.84 -0.27 2.28 5.85 -1.51 -3.17 115.31 119.45 1nla h LEU 21 Ca 0.02 -0.92 0.05 0.00 0.84 0.00 0.00 57.88 57.87 1nla h LEU 21 Cb 0.62 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 1nla h LEU 21 CO 0.05 1.70 -0.08 0.58 -0.34 0.00 0.00 178.44 180.35 1nla h VAL 22 N 0.13 0.71 -0.15 1.05 2.07 -1.25 -0.53 116.25 118.28 1nla h VAL 22 Ca -0.25 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.29 1nla h VAL 22 Cb 2.14 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 32.60 1nla h VAL 22 CO 0.27 0.00 0.03 0.03 0.02 0.00 0.00 177.57 177.92 1nla h ARG 23 N -0.01 0.08 0.00 1.57 2.47 -1.63 -0.86 114.38 116.01 1nla h ARG 23 Ca 0.13 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.85 1nla h ARG 23 Cb 0.21 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.51 1nla h ARG 23 CO -0.28 0.06 0.00 -0.22 0.56 0.00 0.00 179.97 180.08 1nla h LYS 24 N 0.09 0.00 0.00 0.04 3.64 -1.40 -1.92 116.57 117.01 1nla h LYS 24 Ca 0.07 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.19 1nla h LYS 24 Cb 0.06 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 1nla h LYS 24 CO -0.09 0.00 -1.56 0.28 -2.27 0.00 0.00 179.45 175.81 1nla h VAL 25 N 0.00 0.88 0.00 2.00 2.07 0.21 -2.99 116.25 118.41 1nla h VAL 25 Ca 0.00 -2.65 -0.15 0.00 0.82 0.00 0.00 66.70 64.72 1nla h VAL 25 Cb 0.14 2.40 -0.02 0.00 -1.52 0.00 0.00 31.29 32.29 1nla h VAL 25 CO 0.00 0.50 -0.78 0.00 0.02 0.00 0.00 177.57 177.31 1nla h ALA 26 N 1.08 0.56 0.00 1.67 0.00 -0.57 -3.03 119.26 118.97 1nla h ALA 26 Ca -0.23 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.00 1nla h ALA 26 Cb 1.91 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1nla h ALA 26 CO 0.08 0.90 -0.75 1.49 0.00 0.00 0.00 179.25 180.96 1nla h GLU 27 N 0.00 0.00 0.00 0.00 4.81 -1.50 -1.22 114.58 116.67 1nla h GLU 27 Ca -0.03 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 58.96 1nla h GLU 27 Cb 1.55 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.89 1nla h GLU 27 CO 0.09 0.00 -1.62 -0.85 -0.73 0.00 0.00 179.01 175.90 1nla n GLU 28 N -2.20 0.63 0.08 1.92 0.28 -1.13 -4.09 120.64 116.13 1nla n GLU 28 Ca 0.02 0.25 0.12 0.00 -0.16 0.00 0.00 57.16 57.39 1nla n GLU 28 Cb 0.46 -1.79 0.01 0.00 1.43 0.00 0.00 31.44 31.56 1nla n GLU 28 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1nla n ASN 29 N -2.96 0.75 0.00 -1.84 3.02 -1.14 -4.95 115.26 108.13 1nla n ASN 29 Ca -0.14 0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 1nla n ASN 29 Cb 0.97 0.55 0.00 0.00 -0.61 0.00 0.00 39.78 40.68 1nla n ASN 29 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1nla n GLY 30 N 1.23 1.06 0.00 7.41 0.00 -1.17 -5.08 105.19 108.64 1nla n GLY 30 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1nla n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nla n ARG 31 N -1.83 2.90 -3.63 1.61 1.74 -0.47 -5.04 116.66 111.96 1nla n ARG 31 Ca 0.00 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.87 1nla n ARG 31 Cb 0.06 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.46 1nla n ARG 31 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1nla s SER 32 N 0.08 5.12 0.43 0.55 0.01 -1.26 -4.34 113.70 114.28 1nla s SER 32 Ca 0.00 -0.67 0.23 0.00 1.31 0.00 0.00 55.95 56.82 1nla s SER 32 Cb 0.00 -0.68 0.75 0.00 0.21 0.00 0.00 66.02 66.30 1nla s SER 32 CO 0.00 -0.57 1.75 0.58 0.41 0.00 0.00 173.24 175.41 1nla h VAL 33 N 1.09 0.48 0.00 3.43 2.07 -1.89 -1.50 116.25 119.93 1nla h VAL 33 Ca -0.42 -1.23 -0.14 0.00 0.82 0.00 0.00 66.70 65.72 1nla h VAL 33 Cb 1.26 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 32.89 1nla h VAL 33 CO 0.57 0.22 -0.68 0.78 0.02 0.00 0.00 177.57 178.48 1nla h ASN 34 N 0.00 0.00 0.89 0.57 4.21 -1.97 -2.54 115.58 116.74 1nla h ASN 34 Ca -0.00 0.00 -0.20 0.00 1.21 0.00 0.00 56.30 57.31 1nla h ASN 34 Cb 0.86 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 38.03 1nla h ASN 34 CO 0.03 0.68 -1.20 0.28 -1.29 0.00 0.00 177.43 175.93 1nla h SER 35 N 0.00 0.00 -0.18 5.81 0.02 -1.89 -2.49 113.55 114.81 1nla h SER 35 Ca -0.01 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.77 1nla h SER 35 Cb 1.28 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.82 1nla h SER 35 CO 0.09 0.78 -0.52 -0.08 -1.14 0.00 0.00 176.83 175.96 1nla h GLU 36 N 0.00 0.76 0.00 3.45 4.57 -1.21 -1.96 114.58 120.19 1nla h GLU 36 Ca -0.12 -0.47 -0.11 0.00 -1.18 0.00 0.00 59.36 57.48 1nla h GLU 36 Cb 1.71 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 30.33 1nla h GLU 36 CO 0.08 1.09 -0.53 0.82 -1.18 0.00 0.00 179.01 179.30 1nla h ILE 37 N 0.59 0.88 -0.15 2.32 1.08 -1.55 -2.99 117.51 117.69 1nla h ILE 37 Ca 0.02 -2.25 -0.20 0.00 -0.39 0.00 0.00 64.86 62.04 1nla h ILE 37 Cb 1.10 2.43 0.00 0.00 -3.07 0.00 0.00 36.82 37.29 1nla h ILE 37 CO 0.11 0.50 -0.72 0.22 -0.69 0.00 0.00 178.15 177.57 1nla h TYR 38 N 0.00 0.90 -0.16 1.37 3.20 -1.29 -2.26 116.97 118.73 1nla h TYR 38 Ca -0.01 -0.38 -0.15 0.00 3.14 0.00 0.00 58.73 61.33 1nla h TYR 38 Cb 1.40 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 39.53 1nla h TYR 38 CO 0.00 1.19 -0.49 1.96 -1.64 0.00 0.00 178.16 179.18 1nla h GLN 39 N 0.48 0.62 0.00 1.82 7.50 -1.41 -0.79 115.11 123.33 1nla h GLN 39 Ca -0.03 -0.45 -0.03 0.00 0.50 0.00 0.00 58.65 58.64 1nla h GLN 39 Cb 1.32 0.07 -0.00 0.00 0.05 0.00 0.00 27.48 28.92 1nla h GLN 39 CO 0.14 1.07 -0.16 0.00 -1.50 0.00 0.00 178.83 178.37 1nla h ARG 40 N 0.28 0.00 0.00 1.46 3.08 -1.56 -1.48 114.38 116.16 1nla h ARG 40 Ca -0.01 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.87 1nla h ARG 40 Cb 1.11 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.13 1nla h ARG 40 CO 0.10 0.16 -0.91 0.28 -1.07 0.00 0.00 179.97 178.54 1nla h VAL 41 N 0.00 1.04 -0.19 2.04 2.07 -1.24 -3.22 116.25 116.75 1nla h VAL 41 Ca -0.00 -2.56 -0.20 0.00 0.82 0.00 0.00 66.70 64.75 1nla h VAL 41 Cb 0.36 2.47 0.01 0.00 -1.52 0.00 0.00 31.29 32.61 1nla h VAL 41 CO 0.02 0.59 -0.68 -0.03 0.02 0.00 0.00 177.57 177.50 1nla h MET 42 N 0.00 0.79 0.00 1.57 4.05 -0.13 -3.11 114.93 118.10 1nla h MET 42 Ca -0.06 -0.60 -0.01 0.00 -0.28 0.00 0.00 59.70 58.75 1nla h MET 42 Cb 1.58 0.11 -0.00 0.00 -0.80 0.00 0.00 31.60 32.49 1nla h MET 42 CO 0.08 1.22 -0.06 0.93 0.23 0.00 0.00 176.91 179.31 1nla h GLU 43 N 0.54 0.00 0.24 0.39 4.39 -1.49 -3.20 114.58 115.45 1nla h GLU 43 Ca -0.03 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1nla h GLU 43 Cb 1.30 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 1nla h GLU 43 CO 0.14 0.06 -0.12 1.03 -1.16 0.00 0.00 179.01 178.97 1nla h SER 44 N 0.00 -0.27 0.16 1.42 0.87 -1.55 -2.86 113.55 111.32 1nla h SER 44 Ca -0.00 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.38 1nla h SER 44 Cb 0.64 0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.67 1nla h SER 44 CO 0.01 0.01 -0.09 -0.26 -0.53 0.00 0.00 176.83 175.97 1nla h PHE 45 N -0.57 0.00 -0.04 2.24 0.04 -1.63 -2.17 116.94 114.81 1nla h PHE 45 Ca -0.03 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.66 1nla h PHE 45 Cb 0.42 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.56 1nla h PHE 45 CO 0.01 0.09 -0.35 -0.22 -0.60 0.00 0.00 178.31 177.24 1nla h LYS 46 N 0.00 0.08 -0.62 1.51 3.64 -1.51 -2.17 116.57 117.51 1nla h LYS 46 Ca -0.00 -0.03 0.18 0.00 -1.27 0.00 0.00 60.65 59.53 1nla h LYS 46 Cb 0.20 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1nla h LYS 46 CO 0.01 0.42 0.45 0.87 -2.27 0.00 0.00 179.45 178.93 1nla h LYS 47 N 0.07 0.00 0.00 1.90 1.57 -1.23 -1.20 116.57 117.68 1nla h LYS 47 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1nla h LYS 47 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.96 1nla h LYS 47 CO 0.05 0.00 -1.17 0.39 -0.57 0.00 0.00 179.45 178.15 1nla n GLU 48 N -4.33 1.28 -0.66 3.15 1.02 -1.04 -4.98 120.64 115.08 1nla n GLU 48 Ca 0.12 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1nla n GLU 48 Cb 0.70 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.82 1nla n GLU 48 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nla n GLY 49 N 1.47 0.66 0.28 0.62 0.00 -0.45 -4.96 105.19 102.81 1nla n GLY 49 Ca 0.00 -0.65 -0.02 0.00 0.00 0.00 0.00 46.02 45.35 1nla n GLY 49 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1nla h ARG 50 N 0.00 0.84 -6.93 1.61 3.08 -1.69 -3.42 114.38 107.86 1nla h ARG 50 Ca 0.00 -0.05 -0.45 0.00 0.07 0.00 0.00 59.98 59.55 1nla h ARG 50 Cb 0.05 -0.19 0.05 0.00 0.08 0.00 0.00 29.97 29.97 1nla h ARG 50 CO 0.00 0.55 0.02 0.96 -1.07 0.00 0.00 179.97 180.44 1nla s ILE 51 N -6.10 2.81 -0.55 2.04 -4.36 -1.26 -5.05 121.20 108.72 1nla s ILE 51 Ca -0.13 -0.53 0.07 0.00 -0.26 0.00 0.00 60.65 59.80 1nla s ILE 51 Cb 0.16 -3.08 0.28 0.00 1.25 0.00 0.00 42.46 41.07 1nla s ILE 51 CO 0.77 -0.07 0.75 0.61 0.24 0.00 0.00 174.94 177.25 1nla n GLY 52 N -2.44 4.54 0.00 6.27 0.00 -1.26 -4.99 105.19 107.31 1nla n GLY 52 Ca 0.07 -2.45 0.08 0.00 0.00 0.00 0.00 46.02 43.72 1nla n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32