#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n8r n PRO 13 N 0.00 0.78 -0.08 0.38 -0.02 -1.26 -4.85 135.00 129.95 1n8r n PRO 13 Ca 0.00 0.28 -0.13 0.00 -2.02 0.00 0.00 63.50 61.63 1n8r n PRO 13 Cb 0.00 -1.73 -0.05 0.00 -0.02 0.00 0.00 33.50 31.70 1n8r n PRO 13 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1n8r h GLU 14 N 3.11 0.57 -0.43 -0.52 5.08 -2.06 -3.05 114.58 117.29 1n8r h GLU 14 Ca -0.43 -0.30 0.12 0.00 -1.00 0.00 0.00 59.36 57.75 1n8r h GLU 14 Cb 1.37 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.61 1n8r h GLU 14 CO 0.68 0.89 0.37 0.11 -1.00 0.00 0.00 179.01 180.06 1n8r h TRP 15 N 0.28 0.00 -0.00 4.33 5.08 -2.00 0.30 115.95 123.93 1n8r h TRP 15 Ca 0.04 0.00 -0.21 0.00 1.08 0.00 0.00 58.89 59.80 1n8r h TRP 15 Cb 0.78 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.93 1n8r h TRP 15 CO 0.08 0.00 -0.89 0.87 -1.28 0.00 0.00 178.44 177.21 1n8r h LYS 16 N 0.00 0.30 -0.29 0.12 1.57 -1.90 -2.16 116.57 114.21 1n8r h LYS 16 Ca 0.20 -0.32 -0.10 0.00 -1.87 0.00 0.00 60.65 58.56 1n8r h LYS 16 Cb 0.93 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.33 1n8r h LYS 16 CO -0.00 1.02 -0.22 1.96 -0.57 0.00 0.00 179.45 181.64 1n8r h GLN 17 N 0.17 0.66 -0.50 3.15 4.20 -0.40 -2.05 115.11 120.34 1n8r h GLN 17 Ca -0.06 -0.32 -0.03 0.00 0.06 0.00 0.00 58.65 58.30 1n8r h GLN 17 Cb 1.52 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.27 1n8r h GLN 17 CO 0.15 0.92 0.19 0.93 -0.67 0.00 0.00 178.83 180.35 1n8r h GLU 18 N 0.41 0.76 -0.03 1.46 5.08 -1.14 -2.55 114.58 118.56 1n8r h GLU 18 Ca 0.06 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1n8r h GLU 18 Cb 0.77 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 1n8r h GLU 18 CO 0.06 0.68 -0.02 1.49 -1.00 0.00 0.00 179.01 180.22 1n8r h GLU 19 N 0.67 -0.03 -0.80 2.33 4.57 -1.34 0.20 114.58 120.18 1n8r h GLU 19 Ca 0.17 0.00 0.23 0.00 -1.18 0.00 0.00 59.36 58.58 1n8r h GLU 19 Cb 0.21 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.78 1n8r h GLU 19 CO -0.01 -0.02 0.59 0.28 -1.18 0.00 0.00 179.01 178.68 1n8r h VAL 20 N -0.03 0.56 0.22 0.32 2.07 -1.13 0.45 116.25 118.71 1n8r h VAL 20 Ca 0.02 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 1n8r h VAL 20 Cb 0.06 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1n8r h VAL 20 CO -0.05 0.00 -0.10 0.44 0.02 0.00 0.00 177.57 177.88 1n8r h ASP 21 N 0.00 -0.25 -0.95 0.57 3.32 -0.56 -2.24 116.42 116.31 1n8r h ASP 21 Ca 0.38 0.01 0.25 0.00 0.02 0.00 0.00 57.03 57.69 1n8r h ASP 21 Cb 1.57 0.06 -0.13 0.00 0.22 0.00 0.00 39.33 41.05 1n8r h ASP 21 CO -0.00 0.19 0.49 0.00 -1.72 0.00 0.00 179.24 178.20 1n8r h ALA 22 N -1.13 1.65 -0.38 3.45 0.00 0.53 0.38 119.26 123.75 1n8r h ALA 22 Ca -0.03 0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1n8r h ALA 22 Cb 0.22 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1n8r h ALA 22 CO 0.05 -0.37 0.16 0.82 0.00 0.00 0.00 179.25 179.91 1n8r h ILE 23 N 0.44 1.19 -0.03 0.00 2.04 -0.23 -1.72 117.51 119.19 1n8r h ILE 23 Ca 0.62 -0.57 -0.07 0.00 1.00 0.00 0.00 64.86 65.85 1n8r h ILE 23 Cb 1.24 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 1n8r h ILE 23 CO -0.53 0.21 -0.29 0.58 0.00 0.00 0.00 178.15 178.12 1n8r h VAL 24 N 0.47 1.22 0.34 1.67 2.07 0.14 -0.60 116.25 121.56 1n8r h VAL 24 Ca 0.13 -1.05 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 1n8r h VAL 24 Cb 0.18 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1n8r h VAL 24 CO -0.01 0.30 -0.16 -0.33 0.02 0.00 0.00 177.57 177.39 1n8r h GLU 25 N 0.06 -0.44 0.00 1.57 5.08 0.13 0.13 114.58 121.11 1n8r h GLU 25 Ca 0.01 0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1n8r h GLU 25 Cb 0.54 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1n8r h GLU 25 CO 0.04 -0.18 -0.18 0.52 -1.00 0.00 0.00 179.01 178.21 1n8r h MET 26 N -0.65 0.00 0.00 2.33 2.86 -1.20 0.49 114.93 118.77 1n8r h MET 26 Ca -0.05 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.49 1n8r h MET 26 Cb 0.46 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.11 1n8r h MET 26 CO 0.08 0.18 -0.51 0.82 1.06 0.00 0.00 176.91 178.54 1n8r h ILE 27 N 0.00 1.21 0.02 -1.22 2.04 -0.76 -3.16 117.51 115.63 1n8r h ILE 27 Ca -0.00 -1.83 -0.24 0.00 1.00 0.00 0.00 64.86 63.80 1n8r h ILE 27 Cb 0.40 2.03 0.00 0.00 -0.74 0.00 0.00 36.82 38.52 1n8r h ILE 27 CO 0.02 0.50 -0.99 -0.33 0.00 0.00 0.00 178.15 177.35 1n8r h GLU 28 N 0.00 0.42 0.00 2.37 5.08 0.14 -3.50 114.58 119.09 1n8r h GLU 28 Ca -0.01 -0.47 -0.38 0.00 -1.00 0.00 0.00 59.36 57.50 1n8r h GLU 28 Cb 0.99 0.14 -0.07 0.00 0.50 0.00 0.00 28.75 30.31 1n8r h GLU 28 CO 0.07 1.14 -2.43 -1.13 -1.00 0.00 0.00 179.01 175.66 1n8r n SER 29 N -3.73 1.40 0.00 1.42 3.41 -0.65 -5.10 113.62 110.37 1n8r n SER 29 Ca -0.07 -0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.46 1n8r n SER 29 Cb 0.86 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.80 1n8r n SER 29 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1n8r n ARG 63 N -3.12 0.00 -0.15 4.33 1.74 -1.26 -5.05 116.66 113.16 1n8r n ARG 63 Ca -0.41 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 56.59 1n8r n ARG 63 Cb 1.04 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 32.49 1n8r n ARG 63 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 1n8r h ASN 64 N 0.00 0.54 -0.65 0.55 -0.26 -2.05 -1.85 115.58 111.87 1n8r h ASN 64 Ca 0.00 -0.05 0.08 0.00 -0.56 0.00 0.00 56.30 55.77 1n8r h ASN 64 Cb 0.00 -0.14 -0.04 0.00 -1.06 0.00 0.00 38.32 37.08 1n8r h ASN 64 CO 0.00 0.43 0.43 0.71 -1.06 0.00 0.00 177.43 177.94 1n8r h THR 65 N 0.60 0.96 0.00 2.81 1.35 -2.04 0.18 112.91 116.77 1n8r h THR 65 Ca 0.16 -0.20 -0.12 0.00 -0.55 0.00 0.00 66.41 65.70 1n8r h THR 65 Cb -0.01 0.33 -0.02 0.00 -1.73 0.00 0.00 68.15 66.72 1n8r h THR 65 CO -0.03 0.11 -0.58 -0.07 -0.25 0.00 0.00 175.52 174.69 1n8r h LEU 66 N 0.58 0.00 0.00 3.87 3.38 -1.79 -1.14 115.31 120.21 1n8r h LEU 66 Ca 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 1n8r h LEU 66 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1n8r h LEU 66 CO -0.09 0.58 -0.03 -0.07 0.09 0.00 0.00 178.44 178.92 1n8r h LEU 67 N 0.00 0.02 -1.95 1.67 3.38 -0.39 -1.88 115.31 116.16 1n8r h LEU 67 Ca -0.01 -0.88 0.17 0.00 0.09 0.00 0.00 57.88 57.25 1n8r h LEU 67 Cb 1.16 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 1n8r h LEU 67 CO 0.08 0.90 0.43 -0.33 0.09 0.00 0.00 178.44 179.61 1n8r h GLU 68 N -0.86 0.05 0.58 1.13 5.08 -0.73 0.34 114.58 120.17 1n8r h GLU 68 Ca -0.00 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1n8r h GLU 68 Cb 0.91 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 30.15 1n8r h GLU 68 CO 0.01 0.03 -0.28 -0.09 -1.00 0.00 0.00 179.01 177.68 1n8r h ARG 69 N 0.05 -0.75 -0.56 2.33 9.65 -1.11 -1.52 114.38 122.47 1n8r h ARG 69 Ca 0.29 0.05 0.11 0.00 -1.10 0.00 0.00 59.98 59.33 1n8r h ARG 69 Cb 1.09 0.17 -0.09 0.00 -1.39 0.00 0.00 29.97 29.75 1n8r h ARG 69 CO -0.02 -0.50 0.01 0.00 2.80 0.00 0.00 179.97 182.27 1n8r h ALA 70 N -1.41 0.55 -0.44 2.80 0.00 -0.33 0.14 119.26 120.57 1n8r h ALA 70 Ca -0.08 0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.09 1n8r h ALA 70 Cb 0.59 0.28 -0.09 0.00 0.00 0.00 0.00 17.79 18.57 1n8r h ALA 70 CO 0.13 -0.38 -0.20 -0.07 0.00 0.00 0.00 179.25 178.73 1n8r h LEU 71 N 0.13 -0.67 0.00 0.00 3.38 -0.38 0.70 115.31 118.46 1n8r h LEU 71 Ca 0.29 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.42 1n8r h LEU 71 Cb 0.45 0.37 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1n8r h LEU 71 CO -0.46 -0.23 0.01 0.47 0.09 0.00 0.00 178.44 178.32 1n8r n ASP 72 N -5.38 0.00 -0.26 -0.43 8.00 0.49 -5.09 116.55 113.88 1n8r n ASP 72 Ca 0.03 0.05 0.03 0.00 0.71 0.00 0.00 54.79 55.61 1n8r n ASP 72 Cb 0.29 -0.05 0.03 0.00 -0.02 0.00 0.00 41.12 41.37 1n8r n ASP 72 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28