#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jj2 n PRO 13 N 0.00 1.28 -0.10 0.38 -0.02 -1.26 -4.85 135.00 130.42 1jj2 n PRO 13 Ca 0.00 0.46 -0.11 0.00 -2.02 0.00 0.00 63.50 61.83 1jj2 n PRO 13 Cb 0.00 -2.13 -0.03 0.00 -0.02 0.00 0.00 33.50 31.32 1jj2 n PRO 13 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1jj2 h GLU 14 N 5.06 0.52 -0.50 -0.52 5.08 -2.06 -2.62 114.58 119.55 1jj2 h GLU 14 Ca -0.47 -0.16 0.12 0.00 -1.00 0.00 0.00 59.36 57.85 1jj2 h GLU 14 Cb 1.32 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.50 1jj2 h GLU 14 CO 0.81 0.66 0.35 0.11 -1.00 0.00 0.00 179.01 179.94 1jj2 h TRP 15 N 0.32 0.12 -0.18 4.33 5.08 -1.99 0.35 115.95 123.98 1jj2 h TRP 15 Ca 0.08 0.00 -0.18 0.00 1.08 0.00 0.00 58.89 59.88 1jj2 h TRP 15 Cb 0.42 -0.04 -0.00 0.00 -3.00 0.00 0.00 29.16 26.54 1jj2 h TRP 15 CO 0.03 0.05 -0.63 0.87 -1.28 0.00 0.00 178.44 177.49 1jj2 h LYS 16 N 0.11 0.64 -0.48 0.12 1.57 -1.86 -2.04 116.57 114.63 1jj2 h LYS 16 Ca 0.24 -0.45 -0.12 0.00 -1.87 0.00 0.00 60.65 58.45 1jj2 h LYS 16 Cb 0.79 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.16 1jj2 h LYS 16 CO -0.03 1.07 -0.16 1.96 -0.57 0.00 0.00 179.45 181.72 1jj2 h GLN 17 N 0.47 0.92 -0.16 3.15 4.20 -0.09 -2.35 115.11 121.26 1jj2 h GLN 17 Ca -0.01 -0.36 -0.13 0.00 0.06 0.00 0.00 58.65 58.22 1jj2 h GLN 17 Cb 1.21 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.93 1jj2 h GLN 17 CO 0.12 1.01 -0.45 0.93 -0.67 0.00 0.00 178.83 179.78 1jj2 h GLU 18 N 0.81 0.39 -0.29 1.46 5.08 -0.72 -3.02 114.58 118.29 1jj2 h GLU 18 Ca 0.12 -0.21 -0.07 0.00 -1.00 0.00 0.00 59.36 58.20 1jj2 h GLU 18 Cb 0.70 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 1jj2 h GLU 18 CO 0.05 0.76 -0.11 1.49 -1.00 0.00 0.00 179.01 180.21 1jj2 h GLU 19 N 0.32 0.59 -0.00 2.33 4.57 -1.21 0.37 114.58 121.55 1jj2 h GLU 19 Ca 0.02 -0.24 0.00 0.00 -1.18 0.00 0.00 59.36 57.96 1jj2 h GLU 19 Cb 0.92 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.48 1jj2 h GLU 19 CO 0.08 0.81 0.00 0.28 -1.18 0.00 0.00 179.01 179.00 1jj2 h VAL 20 N 0.34 0.13 0.00 0.32 2.07 -1.37 0.34 116.25 118.08 1jj2 h VAL 20 Ca 0.07 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.56 1jj2 h VAL 20 Cb 0.61 1.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1jj2 h VAL 20 CO 0.04 0.00 -0.26 0.44 0.02 0.00 0.00 177.57 177.81 1jj2 h ASP 21 N 0.00 0.00 -0.98 0.57 3.32 -1.29 -2.71 116.42 115.33 1jj2 h ASP 21 Ca 0.00 -0.34 0.16 0.00 0.02 0.00 0.00 57.03 56.88 1jj2 h ASP 21 Cb 0.01 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.47 1jj2 h ASP 21 CO -0.00 0.81 0.62 0.00 -1.72 0.00 0.00 179.24 178.95 1jj2 h ALA 22 N -0.66 1.69 -0.35 3.45 0.00 -0.37 0.34 119.26 123.35 1jj2 h ALA 22 Ca -0.05 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1jj2 h ALA 22 Cb 0.53 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1jj2 h ALA 22 CO -0.03 0.00 -0.04 0.82 0.00 0.00 0.00 179.25 180.01 1jj2 h ILE 23 N 0.81 1.27 0.00 0.00 2.04 -0.48 -1.95 117.51 119.19 1jj2 h ILE 23 Ca 0.53 -1.06 -0.06 0.00 1.00 0.00 0.00 64.86 65.27 1jj2 h ILE 23 Cb 0.77 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 38.10 1jj2 h ILE 23 CO -0.31 0.35 -0.26 0.58 0.00 0.00 0.00 178.15 178.51 1jj2 h VAL 24 N 0.44 1.05 0.14 1.67 2.07 -0.69 -1.00 116.25 119.93 1jj2 h VAL 24 Ca 0.09 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 1jj2 h VAL 24 Cb 0.52 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.82 1jj2 h VAL 24 CO 0.03 0.26 -0.07 -0.33 0.02 0.00 0.00 177.57 177.47 1jj2 h GLU 25 N 0.00 -0.19 0.00 1.57 5.08 -0.00 -0.13 114.58 120.91 1jj2 h GLU 25 Ca -0.00 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1jj2 h GLU 25 Cb 0.51 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 1jj2 h GLU 25 CO 0.03 0.14 -0.16 0.52 -1.00 0.00 0.00 179.01 178.55 1jj2 h MET 26 N -0.54 0.00 0.00 2.33 2.86 -1.19 -0.40 114.93 117.99 1jj2 h MET 26 Ca -0.02 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.53 1jj2 h MET 26 Cb 0.42 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 1jj2 h MET 26 CO 0.03 0.16 -0.45 0.82 1.06 0.00 0.00 176.91 178.53 1jj2 h ILE 27 N 0.00 0.91 0.16 -1.22 2.04 -0.97 -3.18 117.51 115.25 1jj2 h ILE 27 Ca -0.00 -1.86 -0.30 0.00 1.00 0.00 0.00 64.86 63.70 1jj2 h ILE 27 Cb 0.42 2.15 0.02 0.00 -0.74 0.00 0.00 36.82 38.67 1jj2 h ILE 27 CO 0.02 0.44 -1.29 -0.33 0.00 0.00 0.00 178.15 176.99 1jj2 h GLU 28 N 0.00 0.48 0.02 2.37 5.08 0.59 -3.50 114.58 119.60 1jj2 h GLU 28 Ca -0.00 -0.72 -0.38 0.00 -1.00 0.00 0.00 59.36 57.25 1jj2 h GLU 28 Cb 1.11 0.26 -0.06 0.00 0.50 0.00 0.00 28.75 30.55 1jj2 h GLU 28 CO 0.06 1.33 -2.39 -1.13 -1.00 0.00 0.00 179.01 175.88 1jj2 n SER 29 N -3.69 1.70 0.00 1.42 3.41 -0.55 -5.10 113.62 110.81 1jj2 n SER 29 Ca -0.13 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 1jj2 n SER 29 Cb 1.02 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.71 1jj2 n SER 29 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1jj2 n ARG 63 N -3.21 0.00 -0.07 4.33 1.74 -1.26 -5.04 116.66 113.15 1jj2 n ARG 63 Ca -0.42 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.55 1jj2 n ARG 63 Cb 1.02 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 32.42 1jj2 n ARG 63 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 1jj2 h ASN 64 N 0.00 0.33 -0.79 0.55 -0.26 -2.05 -2.59 115.58 110.78 1jj2 h ASN 64 Ca 0.00 -0.25 0.14 0.00 -0.56 0.00 0.00 56.30 55.63 1jj2 h ASN 64 Cb 0.00 -0.09 -0.05 0.00 -1.06 0.00 0.00 38.32 37.12 1jj2 h ASN 64 CO 0.00 0.49 0.52 0.71 -1.06 0.00 0.00 177.43 178.09 1jj2 h THR 65 N 0.14 0.83 -0.01 2.81 1.35 -2.04 0.38 112.91 116.37 1jj2 h THR 65 Ca 0.06 -0.18 -0.16 0.00 -0.55 0.00 0.00 66.41 65.58 1jj2 h THR 65 Cb 0.31 0.26 -0.02 0.00 -1.73 0.00 0.00 68.15 66.97 1jj2 h THR 65 CO 0.00 0.09 -0.75 -0.07 -0.25 0.00 0.00 175.52 174.55 1jj2 h LEU 66 N 0.52 0.12 -0.02 3.87 3.38 -1.94 -0.82 115.31 120.42 1jj2 h LEU 66 Ca 0.38 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.24 1jj2 h LEU 66 Cb 0.76 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1jj2 h LEU 66 CO -0.14 0.82 -0.10 -0.07 0.09 0.00 0.00 178.44 179.04 1jj2 h LEU 67 N 0.06 0.12 -2.35 1.67 3.38 -0.54 -1.38 115.31 116.27 1jj2 h LEU 67 Ca -0.02 -0.68 0.01 0.00 0.09 0.00 0.00 57.88 57.28 1jj2 h LEU 67 Cb 1.32 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 1jj2 h LEU 67 CO 0.11 0.78 0.03 -0.33 0.09 0.00 0.00 178.44 179.12 1jj2 h GLU 68 N -0.53 0.00 0.46 1.13 5.08 -0.36 0.92 114.58 121.28 1jj2 h GLU 68 Ca -0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1jj2 h GLU 68 Cb 0.78 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1jj2 h GLU 68 CO 0.02 0.00 -0.22 -0.09 -1.00 0.00 0.00 179.01 177.72 1jj2 h ARG 69 N 0.00 -0.60 -0.58 2.33 9.65 -0.92 -2.22 114.38 122.05 1jj2 h ARG 69 Ca 0.02 0.04 0.07 0.00 -1.10 0.00 0.00 59.98 59.01 1jj2 h ARG 69 Cb 0.08 0.14 -0.06 0.00 -1.39 0.00 0.00 29.97 28.74 1jj2 h ARG 69 CO -0.00 -0.30 0.25 0.00 2.80 0.00 0.00 179.97 182.72 1jj2 h ALA 70 N -0.81 0.75 -0.93 2.80 0.00 -0.37 -0.57 119.26 120.13 1jj2 h ALA 70 Ca -0.06 0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.01 1jj2 h ALA 70 Cb 0.57 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.27 1jj2 h ALA 70 CO 0.10 -0.13 0.57 -0.07 0.00 0.00 0.00 179.25 179.72 1jj2 h LEU 71 N 0.47 0.82 0.00 0.00 3.38 -0.87 0.61 115.31 119.72 1jj2 h LEU 71 Ca 0.28 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1jj2 h LEU 71 Cb 0.28 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1jj2 h LEU 71 CO -0.24 0.44 0.00 0.47 0.09 0.00 0.00 178.44 179.20 1jj2 n ASP 72 N -4.68 0.00 -0.22 -0.43 8.00 -0.23 -5.09 116.55 113.91 1jj2 n ASP 72 Ca 0.17 -0.13 0.03 0.00 0.71 0.00 0.00 54.79 55.56 1jj2 n ASP 72 Cb 0.33 -0.06 0.02 0.00 -0.02 0.00 0.00 41.12 41.40 1jj2 n ASP 72 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28