#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fct n ALA 2 N 0.00 6.87 -0.04 3.04 0.00 -1.26 -4.48 120.51 124.64 1fct n ALA 2 Ca 0.00 -2.54 0.22 0.00 0.00 0.00 0.00 53.44 51.12 1fct n ALA 2 Cb 0.00 -2.77 0.70 0.00 0.00 0.00 0.00 19.45 17.38 1fct n ALA 2 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1fct h MET 3 N 3.86 0.00 -0.32 0.00 1.85 -2.05 0.07 114.93 118.34 1fct h MET 3 Ca 0.48 0.00 0.02 0.00 -0.61 0.00 0.00 59.70 59.59 1fct h MET 3 Cb 0.99 0.00 -0.02 0.00 0.43 0.00 0.00 31.60 33.00 1fct h MET 3 CO 0.89 0.00 0.18 0.00 -0.40 0.00 0.00 176.91 177.58 1fct h ALA 4 N 1.69 0.40 0.35 0.39 0.00 -1.99 0.14 119.26 120.24 1fct h ALA 4 Ca 0.29 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1fct h ALA 4 Cb 1.17 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1fct h ALA 4 CO -0.00 -0.19 -0.17 1.98 0.00 0.00 0.00 179.25 180.87 1fct h MET 5 N 0.36 -0.45 -0.57 0.00 1.85 -1.39 -0.16 114.93 114.57 1fct h MET 5 Ca 0.13 0.03 0.11 0.00 -0.61 0.00 0.00 59.70 59.36 1fct h MET 5 Cb 0.02 0.10 -0.08 0.00 0.43 0.00 0.00 31.60 32.07 1fct h MET 5 CO -0.07 -0.26 0.10 0.00 -0.40 0.00 0.00 176.91 176.28 1fct h ARG 6 N -0.55 0.22 0.52 0.39 2.47 -1.13 0.16 114.38 116.46 1fct h ARG 6 Ca -0.05 -0.01 -0.03 0.00 -1.26 0.00 0.00 59.98 58.63 1fct h ARG 6 Cb 0.41 -0.05 0.01 0.00 -1.65 0.00 0.00 29.97 28.68 1fct h ARG 6 CO 0.08 0.15 -0.25 0.77 0.56 0.00 0.00 179.97 181.28 1fct h SER 7 N 0.23 -0.59 -0.53 7.04 0.02 -0.52 0.28 113.55 119.49 1fct h SER 7 Ca 0.30 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.25 1fct h SER 7 Cb 0.44 0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.10 1fct h SER 7 CO -0.40 -0.39 0.32 0.00 -1.14 0.00 0.00 176.83 175.22 1fct h THR 8 N -0.73 1.16 0.15 -2.27 1.03 -0.55 0.13 112.91 111.83 1fct h THR 8 Ca -0.07 -0.35 0.02 0.00 -0.01 0.00 0.00 66.41 66.00 1fct h THR 8 Cb 0.55 0.44 -0.04 0.00 -1.07 0.00 0.00 68.15 68.03 1fct h THR 8 CO 0.12 0.16 -0.31 0.15 -0.01 0.00 0.00 175.52 175.62 1fct h PHE 9 N 0.71 -0.85 -0.84 0.00 3.57 -0.62 0.24 116.94 119.15 1fct h PHE 9 Ca 0.19 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.77 1fct h PHE 9 Cb -0.02 0.36 -0.05 0.00 2.79 0.00 0.00 35.95 39.02 1fct h PHE 9 CO -0.03 -0.42 0.55 0.00 -2.23 0.00 0.00 178.31 176.18 1fct h ALA 10 N 0.09 1.56 0.00 2.41 0.00 -0.58 0.18 119.26 122.91 1fct h ALA 10 Ca 0.02 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1fct h ALA 10 Cb 0.57 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1fct h ALA 10 CO -0.17 0.32 -0.40 0.00 0.00 0.00 0.00 179.25 179.01 1fct h ALA 11 N 1.54 1.14 0.00 0.00 0.00 0.30 -3.37 119.26 118.87 1fct h ALA 11 Ca 0.36 -0.36 -0.24 0.00 0.00 0.00 0.00 54.91 54.66 1fct h ALA 11 Cb 0.18 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1fct h ALA 11 CO -0.13 0.50 -1.75 0.54 0.00 0.00 0.00 179.25 178.42 1fct n ARG 12 N -3.77 0.56 -1.64 0.00 5.12 -0.02 -4.64 116.66 112.25 1fct n ARG 12 Ca -0.01 0.28 -0.34 0.00 -1.93 0.00 0.00 57.85 55.85 1fct n ARG 12 Cb 0.47 -1.49 0.07 0.00 -1.16 0.00 0.00 32.46 30.34 1fct n ARG 12 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1fct s VAL 13 N -2.64 2.77 0.00 1.55 1.01 0.55 -3.18 120.40 120.46 1fct s VAL 13 Ca -0.33 0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1fct s VAL 13 Cb 0.09 -2.93 0.00 0.00 0.00 0.00 0.00 36.38 33.54 1fct s VAL 13 CO 0.46 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.96 1fct n GLY 14 N -0.01 1.10 2.18 4.51 0.00 -1.26 -4.72 105.19 106.99 1fct n GLY 14 Ca 0.12 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 45.97 1fct n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fct n ALA 15 N 0.00 5.62 0.07 4.61 0.00 -1.19 -0.65 120.51 128.97 1fct n ALA 15 Ca 0.00 -1.83 0.00 0.00 0.00 0.00 0.00 53.44 51.61 1fct n ALA 15 Cb 0.00 -2.53 0.00 0.00 0.00 0.00 0.00 19.45 16.92 1fct n ALA 15 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1fct n LYS 16 N 2.90 0.00 -0.32 0.00 5.02 -1.26 -4.71 118.16 119.79 1fct n LYS 16 Ca 0.42 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.67 1fct n LYS 16 Cb 0.61 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.60 1fct n LYS 16 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1fct n PRO 17 N -2.70 -0.27 -0.06 1.97 -0.02 -1.11 -0.58 135.00 132.24 1fct n PRO 17 Ca 0.00 1.23 0.06 0.00 -2.02 0.00 0.00 63.50 62.77 1fct n PRO 17 Cb 0.00 -1.81 0.27 0.00 -0.02 0.00 0.00 33.50 31.93 1fct n PRO 17 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fct n ALA 18 N -3.49 2.52 0.04 3.55 0.00 0.18 -3.01 120.51 120.30 1fct n ALA 18 Ca 0.05 -0.28 0.02 0.00 0.00 0.00 0.00 53.44 53.24 1fct n ALA 18 Cb 0.27 -1.10 0.05 0.00 0.00 0.00 0.00 19.45 18.67 1fct n ALA 18 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1fct n VAL 19 N -0.18 0.58 -1.63 0.00 0.31 0.25 -5.02 118.33 112.64 1fct n VAL 19 Ca 0.10 -0.79 -0.42 0.00 -0.01 0.00 0.00 64.34 63.22 1fct n VAL 19 Cb 0.15 0.75 0.01 0.00 -0.91 0.00 0.00 33.84 33.84 1fct n VAL 19 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 1fct n ARG 20 N 0.08 1.48 0.00 5.55 1.85 -0.97 -0.65 116.66 124.00 1fct n ARG 20 Ca 0.04 0.53 0.00 0.00 -1.00 0.00 0.00 57.85 57.42 1fct n ARG 20 Cb 0.24 -2.09 0.00 0.00 -1.05 0.00 0.00 32.46 29.56 1fct n ARG 20 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1fct n GLY 21 N 1.11 2.87 0.30 2.89 0.00 -1.26 -4.87 105.19 106.23 1fct n GLY 21 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1fct n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fct n ALA 22 N -0.24 -1.20 -0.22 4.61 0.00 0.17 -5.11 120.51 118.53 1fct n ALA 22 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1fct n ALA 22 Cb 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 18.77 1fct n ALA 22 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1fct n ARG 23 N -1.32 0.00 -0.02 0.00 1.85 -1.26 -5.07 116.66 110.84 1fct n ARG 23 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1fct n ARG 23 Cb 0.04 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.45 1fct n ARG 23 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1fct n PRO 24 N -2.17 0.60 -3.78 2.89 -0.04 -1.26 -4.63 135.00 126.61 1fct n PRO 24 Ca 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.33 1fct n PRO 24 Cb 0.00 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.32 1fct n PRO 24 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fct s ALA 25 N -3.91 -0.20 0.00 0.55 0.00 0.84 -4.79 121.76 114.25 1fct s ALA 25 Ca 0.00 0.51 -0.02 0.00 0.00 0.00 0.00 51.96 52.45 1fct s ALA 25 Cb 0.00 -0.34 -0.08 0.00 0.00 0.00 0.00 23.12 22.70 1fct s ALA 25 CO 0.00 -0.12 2.17 0.43 0.00 0.00 0.00 175.76 178.24 1fct n SER 26 N 3.89 4.34 -0.13 0.00 7.64 -1.26 -3.92 113.62 124.18 1fct n SER 26 Ca -0.23 -2.21 -0.11 0.00 1.01 0.00 0.00 58.87 57.33 1fct n SER 26 Cb 0.53 -1.01 -0.02 0.00 -1.01 0.00 0.00 64.21 62.70 1fct n SER 26 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1fct h ARG 27 N 2.29 0.78 0.00 1.43 -0.00 -1.95 -3.46 114.38 113.47 1fct h ARG 27 Ca 0.06 -0.31 0.00 0.00 -0.50 0.00 0.00 59.98 59.23 1fct h ARG 27 Cb 0.98 -0.04 0.00 0.00 0.00 0.00 0.00 29.97 30.91 1fct h ARG 27 CO 0.10 0.93 0.00 0.00 0.00 0.00 0.00 179.97 181.00 1fct n MET 28 N -4.31 0.00 -3.75 0.04 0.00 -1.25 -5.17 117.12 102.68 1fct n MET 28 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 57.70 57.66 1fct n MET 28 Cb 0.38 0.00 -0.01 0.00 0.00 0.00 0.00 33.22 33.59 1fct n MET 28 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 1fct s SER 29 N -1.82 -0.14 0.56 3.17 0.01 -1.26 -5.03 113.70 109.18 1fct s SER 29 Ca 0.00 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 56.86 1fct s SER 29 Cb 0.00 0.44 0.00 0.00 0.21 0.00 0.00 66.02 66.67 1fct s SER 29 CO 0.00 -0.83 0.00 0.00 0.41 0.00 0.00 173.24 172.82 1fct s MET 31 N 0.00 0.04 0.00 0.00 0.00 -1.26 -0.11 119.30 117.96 1fct s MET 31 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 55.69 55.77 1fct s MET 31 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 34.83 34.65 1fct s MET 31 CO 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 175.02 174.94