#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s6x n GLY 3 N 5.08 3.25 3.18 0.00 0.00 -1.24 -4.85 105.19 110.61 1s6x n GLY 3 Ca -0.10 -1.09 -0.13 0.00 0.00 0.00 0.00 46.02 44.70 1s6x n GLY 3 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1s6x s LYS 4 N 4.66 0.86 0.97 1.61 2.36 -1.26 -4.56 119.74 124.37 1s6x s LYS 4 Ca 0.00 -1.26 -0.14 0.00 -2.55 0.00 0.00 55.97 52.02 1s6x s LYS 4 Cb 0.00 -0.39 -0.02 0.00 -1.05 0.00 0.00 37.83 36.37 1s6x s LYS 4 CO 0.00 0.03 0.01 0.34 1.55 0.00 0.00 175.35 177.29 1s6x n PHE 5 N 0.23 -2.50 -0.99 4.03 -0.00 -1.26 -2.47 117.46 114.49 1s6x n PHE 5 Ca -0.14 0.16 0.00 0.00 -0.00 0.00 0.00 57.45 57.47 1s6x n PHE 5 Cb 0.59 -1.67 0.00 0.00 -0.00 0.00 0.00 39.48 38.41 1s6x n PHE 5 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.76 176.64 1s6x n MET 6 N -0.48 -0.66 -2.93 -4.13 1.56 -1.10 -4.88 117.12 104.50 1s6x n MET 6 Ca 0.04 0.17 -0.40 0.00 -0.27 0.00 0.00 57.70 57.23 1s6x n MET 6 Cb 0.55 -3.68 -0.05 0.00 2.15 0.00 0.00 33.22 32.19 1s6x n MET 6 CO 0.00 0.00 0.00 -1.58 -0.73 0.00 0.00 175.97 173.66 1s6x s TRP 7 N -1.72 3.81 -0.23 1.12 0.52 -1.03 -4.75 118.94 116.66 1s6x s TRP 7 Ca 0.00 1.60 -0.25 0.00 0.02 0.00 0.00 56.10 57.47 1s6x s TRP 7 Cb 0.00 -2.86 -0.01 0.00 -1.15 0.00 0.00 33.47 29.46 1s6x s TRP 7 CO 0.00 0.33 0.83 -1.59 0.02 0.00 0.00 176.95 176.54 1s6x s LYS 8 N -0.38 4.21 0.00 4.98 -2.85 -1.26 -1.65 119.74 122.78 1s6x s LYS 8 Ca 0.39 0.96 0.00 0.00 -1.00 0.00 0.00 55.97 56.32 1s6x s LYS 8 Cb -0.22 -3.63 0.00 0.00 -2.06 0.00 0.00 37.83 31.92 1s6x s LYS 8 CO 0.25 -0.48 0.00 0.00 0.10 0.00 0.00 175.35 175.23 1s6x h LYS 10 N 0.00 0.23 0.00 0.00 2.10 -1.98 -3.48 116.57 113.44 1s6x h LYS 10 Ca 0.00 -0.39 0.00 0.00 -2.00 0.00 0.00 60.65 58.26 1s6x h LYS 10 Cb 0.00 0.15 0.00 0.00 -0.90 0.00 0.00 32.23 31.48 1s6x h LYS 10 CO 0.00 1.19 0.00 0.09 -2.00 0.00 0.00 179.45 178.73 1s6x n ASN 11 N -3.82 0.00 0.00 7.07 4.13 -1.26 -5.02 115.26 116.37 1s6x n ASN 11 Ca -0.28 0.00 0.00 0.00 1.68 0.00 0.00 54.58 55.98 1s6x n ASN 11 Cb 0.94 0.22 0.00 0.00 -1.54 0.00 0.00 39.78 39.39 1s6x n ASN 11 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1s6x n SER 12 N -1.92 0.00 -0.46 6.41 2.88 -1.26 -1.88 113.62 117.39 1s6x n SER 12 Ca 0.00 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.59 1s6x n SER 12 Cb 0.00 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 63.55 1s6x n SER 12 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1s6x n ASN 13 N 0.00 2.35 0.00 -3.46 4.05 -1.26 -4.51 115.26 112.42 1s6x n ASN 13 Ca 0.00 -1.74 0.00 0.00 0.45 0.00 0.00 54.58 53.29 1s6x n ASN 13 Cb 0.00 -0.11 0.00 0.00 1.23 0.00 0.00 39.78 40.90 1s6x n ASN 13 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 1s6x n ASP 14 N 0.41 0.31 -4.83 1.20 8.00 -1.26 -3.15 116.55 117.24 1s6x n ASP 14 Ca 0.08 -0.71 -0.33 0.00 0.71 0.00 0.00 54.79 54.54 1s6x n ASP 14 Cb 0.33 0.21 -0.06 0.00 -0.02 0.00 0.00 41.12 41.57 1s6x n ASP 14 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1s6x n LYS 17 N -4.20 0.41 -1.31 0.00 3.00 -1.26 0.12 118.16 114.92 1s6x n LYS 17 Ca 0.06 0.17 -0.13 0.00 -0.00 0.00 0.00 58.31 58.41 1s6x n LYS 17 Cb 0.56 -1.62 -0.05 0.00 0.00 0.00 0.00 35.03 33.91 1s6x n LYS 17 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1s6x n ASP 18 N 0.68 -4.68 -4.08 3.14 9.92 -1.26 -4.88 116.55 115.39 1s6x n ASP 18 Ca 0.11 0.31 -0.23 0.00 -0.53 0.00 0.00 54.79 54.45 1s6x n ASP 18 Cb 0.48 -3.80 -0.15 0.00 -0.64 0.00 0.00 41.12 37.00 1s6x n ASP 18 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1s6x s LEU 19 N -3.10 1.94 0.01 0.64 2.96 0.12 0.26 118.68 121.50 1s6x s LEU 19 Ca 0.00 -0.26 0.00 0.00 -0.22 0.00 0.00 54.13 53.66 1s6x s LEU 19 Cb 0.00 -0.73 -0.01 0.00 0.50 0.00 0.00 46.19 45.96 1s6x s LEU 19 CO 0.00 0.14 -0.02 0.68 -1.32 0.00 0.00 176.35 175.83 1s6x s VAL 20 N -0.11 0.09 0.18 1.68 -7.23 -1.04 -4.33 120.40 109.65 1s6x s VAL 20 Ca 0.01 -0.25 -0.30 0.00 -1.81 0.00 0.00 61.98 59.63 1s6x s VAL 20 Cb -0.08 -0.13 -0.09 0.00 0.56 0.00 0.00 36.38 36.65 1s6x s VAL 20 CO 0.00 -0.10 1.32 0.00 -0.31 0.00 0.00 175.10 176.01 1s6x s SER 22 N 0.47 1.58 0.52 0.00 0.15 0.93 -4.57 113.70 112.79 1s6x s SER 22 Ca 0.58 -0.25 0.31 0.00 0.70 0.00 0.00 55.95 57.29 1s6x s SER 22 Cb -0.36 -0.42 1.30 0.00 -1.71 0.00 0.00 66.02 64.82 1s6x s SER 22 CO 0.37 0.10 1.97 0.77 1.20 0.00 0.00 173.24 177.65 1s6x h SER 23 N 6.32 0.00 0.10 5.45 4.64 -1.94 0.89 113.55 129.01 1s6x h SER 23 Ca -0.33 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.82 1s6x h SER 23 Cb 1.17 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.28 1s6x h SER 23 CO 0.48 0.07 -0.73 -0.09 -0.87 0.00 0.00 176.83 175.69 1s6x h ARG 24 N 0.00 0.31 0.00 4.77 1.12 -1.95 -3.24 114.38 115.39 1s6x h ARG 24 Ca -0.00 -0.48 0.00 0.00 -1.11 0.00 0.00 59.98 58.39 1s6x h ARG 24 Cb 0.54 0.17 0.00 0.00 -0.01 0.00 0.00 29.97 30.67 1s6x h ARG 24 CO 0.01 1.20 -0.34 0.91 -3.11 0.00 0.00 179.97 178.64 1s6x n TRP 25 N -4.17 0.12 -1.94 2.20 7.02 -1.14 -4.93 117.44 114.60 1s6x n TRP 25 Ca -0.13 0.03 -0.15 0.00 -1.02 0.00 0.00 57.50 56.24 1s6x n TRP 25 Cb 0.77 -0.41 -0.03 0.00 -2.42 0.00 0.00 31.31 29.22 1s6x n TRP 25 CO 0.00 0.00 0.00 0.36 -2.02 0.00 0.00 177.69 176.03 1s6x n LYS 26 N -1.62 -1.12 -3.01 -0.99 2.85 0.30 -4.91 118.16 109.67 1s6x n LYS 26 Ca 0.06 0.84 0.00 0.00 -1.05 0.00 0.00 58.31 58.16 1s6x n LYS 26 Cb 0.35 -5.08 0.00 0.00 -0.65 0.00 0.00 35.03 29.65 1s6x n LYS 26 CO 0.00 0.00 0.00 -2.67 -0.05 0.00 0.00 177.40 174.68 1s6x n TRP 27 N -3.44 0.00 -2.20 5.58 2.14 -0.86 -4.50 117.44 114.16 1s6x n TRP 27 Ca -0.16 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 58.98 1s6x n TRP 27 Cb 0.57 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 31.05 1s6x n TRP 27 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1s6x s VAL 29 N 2.99 4.10 -0.83 0.00 -7.23 0.96 -2.73 120.40 117.65 1s6x s VAL 29 Ca 0.65 -0.70 -0.21 0.00 -1.81 0.00 0.00 61.98 59.90 1s6x s VAL 29 Cb -0.30 -2.85 -0.19 0.00 0.56 0.00 0.00 36.38 33.60 1s6x s VAL 29 CO 0.25 0.32 2.16 0.00 -0.31 0.00 0.00 175.10 177.52 1s6x n LEU 30 N 1.21 0.80 -3.43 1.32 -0.00 -1.26 -2.50 117.00 113.15 1s6x n LEU 30 Ca -0.14 -1.61 -0.39 0.00 -0.00 0.00 0.00 56.01 53.87 1s6x n LEU 30 Cb 0.52 -1.41 0.00 0.00 -0.00 0.00 0.00 43.42 42.54 1s6x n LEU 30 CO 0.35 -2.65 1.92 0.00 -0.00 0.00 0.00 177.39 177.02 1s6x n ALA 31 N 15.72 6.49 -0.23 1.47 0.00 0.72 -4.79 120.51 139.90 1s6x n ALA 31 Ca 0.44 -4.20 -0.05 0.00 0.00 0.00 0.00 53.44 49.63 1s6x n ALA 31 Cb 0.40 -2.45 0.01 0.00 0.00 0.00 0.00 19.45 17.40 1s6x n ALA 31 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1s6x h SER 32 N 4.23 -1.24 0.00 0.00 0.87 -1.79 -1.71 113.55 113.91 1s6x h SER 32 Ca 0.61 0.24 -0.40 0.00 -1.23 0.00 0.00 61.79 61.01 1s6x h SER 32 Cb 0.33 0.61 0.01 0.00 -0.44 0.00 0.00 62.40 62.90 1s6x h SER 32 CO 1.31 -0.30 2.33 -0.81 -0.53 0.00 0.00 176.83 178.83 1s6x n PRO 33 N -5.44 2.33 -0.20 2.24 -0.04 -1.26 -4.82 135.00 127.82 1s6x n PRO 33 Ca 0.05 -1.47 0.00 0.00 -0.04 0.00 0.00 63.50 62.03 1s6x n PRO 33 Cb 0.36 -2.41 0.00 0.00 -0.04 0.00 0.00 33.50 31.42 1s6x n PRO 33 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80