#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 0.04 0.52 0.31 -1.26 -4.30 118.33 113.64 2k44 n VAL 2 Ca 0.00 -0.13 0.03 0.00 -0.01 0.00 0.00 64.34 64.23 2k44 n VAL 2 Cb 0.00 1.09 0.39 0.00 -0.91 0.00 0.00 33.84 34.41 2k44 n VAL 2 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2k44 h PHE 3 N 0.82 0.43 0.11 3.52 -1.00 -2.05 -0.58 116.94 118.18 2k44 h PHE 3 Ca 0.00 -0.02 -0.31 0.00 2.81 0.00 0.00 57.97 60.45 2k44 h PHE 3 Cb 0.55 -0.13 -0.01 0.00 3.61 0.00 0.00 35.95 39.96 2k44 h PHE 3 CO 0.00 0.38 -1.57 0.28 -1.61 0.00 0.00 178.31 175.79 2k44 h VAL 4 N 0.43 1.10 -0.03 -0.55 2.07 -1.99 -3.13 116.25 114.14 2k44 h VAL 4 Ca 0.10 -2.77 -0.08 0.00 0.82 0.00 0.00 66.70 64.78 2k44 h VAL 4 Cb 0.16 2.71 -0.01 0.00 -1.52 0.00 0.00 31.29 32.63 2k44 h VAL 4 CO -0.00 0.80 -0.35 -1.28 0.02 0.00 0.00 177.57 176.76 2k44 h SER 5 N 0.06 0.06 1.59 0.57 0.87 -1.67 0.25 113.55 115.27 2k44 h SER 5 Ca -0.25 -0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.23 2k44 h SER 5 Cb 2.01 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 63.94 2k44 h SER 5 CO 0.15 0.40 -0.42 0.58 -0.53 0.00 0.00 176.83 177.01 2k44 h VAL 6 N 0.05 0.43 0.00 2.23 2.07 -1.22 -2.72 116.25 117.10 2k44 h VAL 6 Ca 0.00 -1.63 -0.15 0.00 0.82 0.00 0.00 66.70 65.74 2k44 h VAL 6 Cb 0.64 2.16 -0.03 0.00 -1.52 0.00 0.00 31.29 32.54 2k44 h VAL 6 CO 0.05 0.25 -1.58 0.00 0.02 0.00 0.00 177.57 176.30 2k44 n TYR 7 N -3.11 0.71 0.55 1.57 4.19 -0.95 -3.73 117.16 116.39 2k44 n TYR 7 Ca 0.02 0.23 0.12 0.00 3.31 0.00 0.00 57.90 61.58 2k44 n TYR 7 Cb 0.65 -0.98 0.18 0.00 0.49 0.00 0.00 39.34 39.69 2k44 n TYR 7 CO 0.00 0.00 0.00 1.25 0.91 0.00 0.00 176.86 179.02 2k44 h LEU 8 N 0.00 0.00 0.00 2.98 5.85 -0.58 -3.14 115.31 120.42 2k44 h LEU 8 Ca -0.17 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.37 2k44 h LEU 8 Cb 1.52 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.55 2k44 h LEU 8 CO 0.03 0.09 -0.08 -1.13 -0.34 0.00 0.00 178.44 177.01 2k44 h ASN 9 N 0.00 0.00 0.10 1.25 -0.00 -1.61 -3.14 115.58 112.18 2k44 h ASN 9 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.29 2k44 h ASN 9 Cb 0.76 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.08 2k44 h ASN 9 CO 0.00 0.47 -0.04 -0.09 -0.00 0.00 0.00 177.43 177.77 2k44 h ARG 10 N -0.85 0.00 0.00 6.67 1.12 -1.75 -0.50 114.38 119.08 2k44 h ARG 10 Ca 0.00 0.00 -0.04 0.00 -1.11 0.00 0.00 59.98 58.83 2k44 h ARG 10 Cb 0.08 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.04 2k44 h ARG 10 CO 0.00 0.04 -0.18 1.03 -3.11 0.00 0.00 179.97 177.75 2k44 h SER 11 N 0.00 0.00 -0.58 -3.80 0.87 -1.68 0.25 113.55 108.60 2k44 h SER 11 Ca -0.00 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.52 2k44 h SER 11 Cb 0.11 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.04 2k44 h SER 11 CO 0.01 0.18 0.22 -0.25 -0.53 0.00 0.00 176.83 176.46 2k44 h TRP 12 N 0.00 0.93 0.00 2.24 2.91 -1.02 -2.82 115.95 118.18 2k44 h TRP 12 Ca -0.00 -0.06 0.00 0.00 1.13 0.00 0.00 58.89 59.95 2k44 h TRP 12 Cb 0.90 -0.28 0.00 0.00 -0.51 0.00 0.00 29.16 29.27 2k44 h TRP 12 CO 0.00 0.73 -0.50 1.28 -1.03 0.00 0.00 178.44 178.92 2k44 n LEU 13 N -4.30 0.49 0.18 0.65 4.32 -1.19 -0.06 117.00 117.08 2k44 n LEU 13 Ca 0.05 -0.49 0.06 0.00 -0.02 0.00 0.00 56.01 55.61 2k44 n LEU 13 Cb 0.19 0.00 0.19 0.00 -1.62 0.00 0.00 43.42 42.17 2k44 n LEU 13 CO 0.39 0.12 0.63 1.23 -1.22 0.00 0.00 177.39 178.54 2k44 h GLY 14 N 2.45 0.00 -4.02 -0.72 0.00 -0.42 -3.35 103.07 97.01 2k44 h GLY 14 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.13 2k44 h GLY 14 CO 0.00 0.00 -0.96 1.04 0.00 0.00 0.00 176.54 176.62 2k44 n LEU 15 N -3.27 0.89 -3.51 3.11 7.99 -1.07 -4.98 117.00 116.15 2k44 n LEU 15 Ca 0.02 -2.49 -0.26 0.00 -0.01 0.00 0.00 56.01 53.27 2k44 n LEU 15 Cb 0.61 0.20 0.01 0.00 -0.11 0.00 0.00 43.42 44.13 2k44 n LEU 15 CO 0.37 0.88 0.02 -1.14 -1.51 0.00 0.00 177.39 176.02 2k44 n ARG 16 N -0.12 -4.45 -3.18 3.23 0.63 -1.24 -0.67 116.66 110.85 2k44 n ARG 16 Ca 0.02 0.60 -0.18 0.00 -0.92 0.00 0.00 57.85 57.37 2k44 n ARG 16 Cb 0.96 -5.41 0.05 0.00 0.45 0.00 0.00 32.46 28.51 2k44 n ARG 16 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2k44 n PHE 17 N -4.33 -1.97 -0.03 -0.14 7.35 0.91 -4.91 117.46 114.33 2k44 n PHE 17 Ca -0.01 0.66 -0.04 0.00 -0.76 0.00 0.00 57.45 57.30 2k44 n PHE 17 Cb 0.55 -3.90 -0.04 0.00 0.35 0.00 0.00 39.48 36.44 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 -3.64 1.95 0.24 -2.13 0.00 0.16 -3.74 117.00 109.83 2k44 n LEU 18 Ca -0.02 -0.03 0.13 0.00 0.00 0.00 0.00 56.01 56.10 2k44 n LEU 18 Cb 0.56 -0.12 0.34 0.00 0.00 0.00 0.00 43.42 44.20 2k44 n LEU 18 CO 0.45 0.46 0.86 -0.09 0.00 0.00 0.00 177.39 179.06 2k44 h ARG 19 N 0.00 0.00 0.00 1.96 2.43 -1.76 -3.11 114.38 113.89 2k44 h ARG 19 Ca -0.16 0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 58.66 2k44 h ARG 19 Cb 1.29 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.78 2k44 h ARG 19 CO -0.01 0.02 -2.32 0.00 -1.51 0.00 0.00 179.97 176.15 2k44 n ALA 20 N -2.10 1.50 0.26 2.80 0.00 -1.26 -4.17 120.51 117.54 2k44 n ALA 20 Ca 0.03 -0.99 0.16 0.00 0.00 0.00 0.00 53.44 52.65 2k44 n ALA 20 Cb 0.46 -0.03 0.85 0.00 0.00 0.00 0.00 19.45 20.73 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 -0.00 0.00 0.00 0.00 6.46 -1.66 0.15 115.31 120.26 2k44 h LEU 21 Ca -0.52 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.24 2k44 h LEU 21 Cb 1.80 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.73 2k44 h LEU 21 CO -0.08 0.00 -0.82 -1.14 -0.62 0.00 0.00 178.44 175.77 2k44 n ARG 22 N -2.66 0.10 -0.04 1.25 3.00 -1.18 -3.08 116.66 114.05 2k44 n ARG 22 Ca -0.02 -0.00 0.02 0.00 -0.00 0.00 0.00 57.85 57.86 2k44 n ARG 22 Cb 0.09 -1.53 -0.14 0.00 0.00 0.00 0.00 32.46 30.88 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 -1.65 0.00 0.05 6.15 0.00 0.33 -3.45 117.00 118.42 2k44 n LEU 23 Ca 0.04 0.00 0.11 0.00 0.00 0.00 0.00 56.01 56.16 2k44 n LEU 23 Cb 0.37 0.16 -0.02 0.00 0.00 0.00 0.00 43.42 43.92 2k44 n LEU 23 CO 0.39 0.16 -0.15 -0.38 0.00 0.00 0.00 177.39 177.41 2k44 n ILE 24 N -2.33 0.30 0.45 1.96 2.08 0.01 -4.10 119.36 117.73 2k44 n ILE 24 Ca -0.13 -0.41 0.09 0.00 0.56 0.00 0.00 62.75 62.86 2k44 n ILE 24 Cb 0.70 -0.04 -0.12 0.00 -0.75 0.00 0.00 39.64 39.43 2k44 n ILE 24 CO 0.00 0.00 0.00 1.67 0.56 0.00 0.00 176.55 178.78 2k44 n GLN 25 N -2.29 0.84 -0.05 0.38 -0.06 -1.18 -4.38 117.38 110.64 2k44 n GLN 25 Ca -0.00 -0.08 0.03 0.00 -2.00 0.00 0.00 57.00 54.95 2k44 n GLN 25 Cb 0.51 -1.39 0.36 0.00 -4.06 0.00 0.00 30.24 25.66 2k44 n GLN 25 CO 0.00 0.00 0.00 0.35 -0.20 0.00 0.00 177.06 177.21 2k44 h PHE 26 N 0.00 0.62 -0.56 3.69 3.57 -1.71 -2.37 116.94 120.19 2k44 h PHE 26 Ca 0.00 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 2k44 h PHE 26 Cb 0.62 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 2k44 h PHE 26 CO 0.00 0.42 0.22 0.77 -2.23 0.00 0.00 178.31 177.49 2k44 h SER 27 N 0.66 0.77 -0.03 0.41 0.02 -1.78 -3.51 113.55 110.08 2k44 h SER 27 Ca 0.17 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k44 h SER 27 Cb -0.02 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.32 2k44 h SER 27 CO -0.03 0.73 0.00 -0.62 -1.14 0.00 0.00 176.83 175.77