#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k44 n VAL 2 N 0.00 0.00 -0.05 0.52 0.31 -1.26 -4.81 118.33 113.05 2k44 n VAL 2 Ca 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.34 2k44 n VAL 2 Cb 0.00 -1.10 -0.15 0.00 -0.91 0.00 0.00 33.84 31.68 2k44 n VAL 2 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2k44 n PHE 3 N -2.39 0.00 -0.05 3.52 3.01 -1.26 -4.04 117.46 116.25 2k44 n PHE 3 Ca -0.06 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.20 2k44 n PHE 3 Cb 0.42 -0.68 -0.13 0.00 -0.01 0.00 0.00 39.48 39.09 2k44 n PHE 3 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 2k44 n VAL 4 N -2.43 1.65 0.21 -4.37 0.31 -1.26 -3.57 118.33 108.87 2k44 n VAL 4 Ca -0.16 -0.63 0.05 0.00 -0.01 0.00 0.00 64.34 63.58 2k44 n VAL 4 Cb 0.79 -1.55 0.45 0.00 -0.91 0.00 0.00 33.84 32.63 2k44 n VAL 4 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2k44 h SER 5 N 0.04 0.00 1.52 4.52 0.02 -1.97 0.26 113.55 117.95 2k44 h SER 5 Ca -0.48 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.42 2k44 h SER 5 Cb 1.99 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.52 2k44 h SER 5 CO 0.02 0.28 -0.49 0.58 -1.14 0.00 0.00 176.83 176.08 2k44 h VAL 6 N 0.00 0.29 0.00 2.27 2.07 -1.74 -2.46 116.25 116.69 2k44 h VAL 6 Ca -0.00 -1.44 -0.16 0.00 0.82 0.00 0.00 66.70 65.91 2k44 h VAL 6 Cb 0.53 2.02 -0.03 0.00 -1.52 0.00 0.00 31.29 32.29 2k44 h VAL 6 CO 0.04 0.17 -1.63 -1.22 0.02 0.00 0.00 177.57 174.95 2k44 n TYR 7 N -3.03 0.67 1.06 1.57 4.02 -0.87 -3.71 117.16 116.87 2k44 n TYR 7 Ca 0.01 0.22 0.12 0.00 -0.01 0.00 0.00 57.90 58.24 2k44 n TYR 7 Cb 0.62 -0.97 0.14 0.00 -0.02 0.00 0.00 39.34 39.11 2k44 n TYR 7 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2k44 n LEU 8 N -2.75 1.01 -0.07 7.72 7.99 0.87 -3.51 117.00 128.27 2k44 n LEU 8 Ca -0.12 -0.32 -0.04 0.00 -0.01 0.00 0.00 56.01 55.52 2k44 n LEU 8 Cb 0.82 -0.11 -0.02 0.00 -0.11 0.00 0.00 43.42 44.00 2k44 n LEU 8 CO 0.43 0.22 -0.28 -1.13 -1.51 0.00 0.00 177.39 175.12 2k44 h ASN 9 N 0.69 0.00 0.37 -1.43 -1.24 -1.57 -3.31 115.58 109.09 2k44 h ASN 9 Ca 0.00 -0.03 -0.03 0.00 0.71 0.00 0.00 56.30 56.96 2k44 h ASN 9 Cb 0.54 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.59 2k44 h ASN 9 CO 0.00 0.73 -0.13 0.03 -1.29 0.00 0.00 177.43 176.77 2k44 h ARG 10 N -1.00 0.00 0.00 6.67 3.08 -1.77 -1.45 114.38 119.91 2k44 h ARG 10 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2k44 h ARG 10 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2k44 h ARG 10 CO -0.01 0.13 0.00 1.03 -1.07 0.00 0.00 179.97 180.05 2k44 h SER 11 N 0.00 0.00 -0.53 7.04 0.87 -1.73 0.26 113.55 119.46 2k44 h SER 11 Ca -0.00 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.48 2k44 h SER 11 Cb 0.35 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.29 2k44 h SER 11 CO 0.02 0.00 0.02 -0.25 -0.53 0.00 0.00 176.83 176.09 2k44 h TRP 12 N 0.00 1.03 -0.00 2.24 2.91 -1.34 -2.83 115.95 117.95 2k44 h TRP 12 Ca 0.00 -0.15 0.00 0.00 1.13 0.00 0.00 58.89 59.87 2k44 h TRP 12 Cb 0.62 -0.28 0.00 0.00 -0.51 0.00 0.00 29.16 28.99 2k44 h TRP 12 CO 0.00 0.91 -0.38 1.28 -1.03 0.00 0.00 178.44 179.22 2k44 n LEU 13 N -4.20 0.48 0.17 0.65 4.77 -1.17 -0.25 117.00 117.45 2k44 n LEU 13 Ca 0.03 -0.53 0.12 0.00 -0.03 0.00 0.00 56.01 55.60 2k44 n LEU 13 Cb 0.32 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.58 2k44 n LEU 13 CO 0.43 0.11 0.65 1.23 -1.33 0.00 0.00 177.39 178.48 2k44 h GLY 14 N 1.99 0.00 -3.03 -0.72 0.00 -0.50 -3.36 103.07 97.45 2k44 h GLY 14 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.15 2k44 h GLY 14 CO 0.00 0.00 -0.95 1.04 0.00 0.00 0.00 176.54 176.63 2k44 n LEU 15 N -2.86 0.77 -3.12 3.11 7.99 -1.07 -4.98 117.00 116.84 2k44 n LEU 15 Ca 0.03 -2.07 -0.22 0.00 -0.01 0.00 0.00 56.01 53.75 2k44 n LEU 15 Cb 0.52 0.03 0.02 0.00 -0.11 0.00 0.00 43.42 43.87 2k44 n LEU 15 CO 0.35 0.66 -0.03 0.54 -1.51 0.00 0.00 177.39 177.40 2k44 n ARG 16 N 0.36 -4.10 -3.11 3.23 1.74 -1.25 -0.93 116.66 112.61 2k44 n ARG 16 Ca 0.02 0.72 -0.18 0.00 -0.77 0.00 0.00 57.85 57.64 2k44 n ARG 16 Cb 1.07 -5.50 0.05 0.00 -1.02 0.00 0.00 32.46 27.06 2k44 n ARG 16 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2k44 n PHE 17 N -4.21 -1.88 -0.07 -1.55 7.35 0.65 -4.92 117.46 112.83 2k44 n PHE 17 Ca -0.08 0.60 -0.12 0.00 -0.76 0.00 0.00 57.45 57.10 2k44 n PHE 17 Cb 0.59 -3.90 -0.07 0.00 0.35 0.00 0.00 39.48 36.46 2k44 n PHE 17 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 2k44 n LEU 18 N -3.57 2.58 0.23 -2.13 7.94 -0.10 -3.54 117.00 118.41 2k44 n LEU 18 Ca -0.04 -0.02 0.15 0.00 -1.11 0.00 0.00 56.01 55.00 2k44 n LEU 18 Cb 0.57 -0.50 0.53 0.00 0.53 0.00 0.00 43.42 44.55 2k44 n LEU 18 CO 0.43 0.66 0.93 0.03 -1.11 0.00 0.00 177.39 178.33 2k44 h ARG 19 N -0.12 0.00 0.00 1.96 2.47 -1.76 -2.80 114.38 114.12 2k44 h ARG 19 Ca -0.34 0.00 -0.42 0.00 -1.26 0.00 0.00 59.98 57.96 2k44 h ARG 19 Cb 1.47 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 29.73 2k44 h ARG 19 CO -0.09 0.00 -2.47 0.00 0.56 0.00 0.00 179.97 177.96 2k44 n ALA 20 N -2.02 1.32 0.27 0.04 0.00 -1.26 -3.91 120.51 114.95 2k44 n ALA 20 Ca 0.02 -1.08 0.17 0.00 0.00 0.00 0.00 53.44 52.54 2k44 n ALA 20 Cb 0.34 -0.04 0.85 0.00 0.00 0.00 0.00 19.45 20.61 2k44 n ALA 20 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2k44 h LEU 21 N -0.39 0.00 -0.00 0.00 5.85 -1.61 0.16 115.31 119.31 2k44 h LEU 21 Ca -0.62 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.10 2k44 h LEU 21 Cb 1.79 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.82 2k44 h LEU 21 CO -0.21 0.00 -0.86 -1.14 -0.34 0.00 0.00 178.44 175.89 2k44 n ARG 22 N -2.68 0.00 -0.02 1.25 0.00 -1.06 -3.29 116.66 110.86 2k44 n ARG 22 Ca -0.01 -0.00 0.04 0.00 -0.00 0.00 0.00 57.85 57.88 2k44 n ARG 22 Cb 0.10 -1.50 -0.13 0.00 0.00 0.00 0.00 32.46 30.93 2k44 n ARG 22 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 2k44 n LEU 23 N -1.49 0.00 0.03 6.15 0.00 0.17 -3.54 117.00 118.32 2k44 n LEU 23 Ca 0.04 0.00 0.11 0.00 0.00 0.00 0.00 56.01 56.17 2k44 n LEU 23 Cb 0.33 0.09 -0.06 0.00 0.00 0.00 0.00 43.42 43.79 2k44 n LEU 23 CO 0.41 0.09 -0.27 0.00 0.00 0.00 0.00 177.39 177.62 2k44 n ILE 24 N -2.20 0.22 0.45 1.96 0.13 0.30 -4.16 119.36 116.06 2k44 n ILE 24 Ca -0.08 -0.40 0.09 0.00 -1.10 0.00 0.00 62.75 61.25 2k44 n ILE 24 Cb 0.57 0.03 -0.12 0.00 -0.84 0.00 0.00 39.64 39.29 2k44 n ILE 24 CO 0.00 0.00 0.00 1.67 2.80 0.00 0.00 176.55 181.02 2k44 n GLN 25 N -2.24 0.96 -0.12 9.51 0.00 -1.21 -3.13 117.38 121.16 2k44 n GLN 25 Ca -0.01 -0.07 0.01 0.00 -0.00 0.00 0.00 57.00 56.93 2k44 n GLN 25 Cb 0.51 -1.36 0.29 0.00 0.00 0.00 0.00 30.24 29.67 2k44 n GLN 25 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 2k44 h PHE 26 N 0.00 0.77 0.00 3.69 3.57 -1.72 -3.31 116.94 119.94 2k44 h PHE 26 Ca 0.00 -0.01 -0.16 0.00 3.53 0.00 0.00 57.97 61.33 2k44 h PHE 26 Cb 0.59 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 2k44 h PHE 26 CO 0.00 0.54 -1.62 0.45 -2.23 0.00 0.00 178.31 175.46 2k44 n SER 27 N -4.39 3.02 -0.24 0.41 2.88 -1.26 -5.11 113.62 108.93 2k44 n SER 27 Ca 0.05 -0.05 0.03 0.00 -1.33 0.00 0.00 58.87 57.58 2k44 n SER 27 Cb 0.10 -0.18 0.02 0.00 -0.75 0.00 0.00 64.21 63.40 2k44 n SER 27 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02