#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s6x s GLY 3 N 5.58 1.85 0.25 0.00 0.00 -1.02 -4.77 107.32 109.22 1s6x s GLY 3 Ca 0.59 -1.63 -0.08 0.00 0.00 0.00 0.00 44.72 43.60 1s6x s GLY 3 CO 0.25 -1.48 0.55 0.54 0.00 0.00 0.00 173.10 172.96 1s6x s LYS 4 N -4.26 3.74 0.48 2.90 -0.14 -1.26 -3.43 119.74 117.77 1s6x s LYS 4 Ca 0.51 0.18 -0.19 0.00 -1.36 0.00 0.00 55.97 55.11 1s6x s LYS 4 Cb -0.09 -2.64 -0.15 0.00 -1.68 0.00 0.00 37.83 33.27 1s6x s LYS 4 CO 0.32 0.27 -0.06 0.34 -0.76 0.00 0.00 175.35 175.45 1s6x n PHE 5 N -0.45 -2.67 -0.08 3.18 7.35 -1.26 -0.36 117.46 123.16 1s6x n PHE 5 Ca -0.00 0.50 0.00 0.00 -0.76 0.00 0.00 57.45 57.18 1s6x n PHE 5 Cb 0.53 -1.71 0.00 0.00 0.35 0.00 0.00 39.48 38.65 1s6x n PHE 5 CO 0.00 0.00 0.00 -1.33 -0.76 0.00 0.00 176.76 174.67 1s6x n MET 6 N 1.44 0.00 -1.86 -4.13 2.81 -1.19 -4.93 117.12 109.26 1s6x n MET 6 Ca 0.09 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.56 1s6x n MET 6 Cb 0.45 -1.92 -0.03 0.00 -0.71 0.00 0.00 33.22 31.02 1s6x n MET 6 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 1s6x s TRP 7 N -2.81 2.58 0.52 2.03 0.52 0.51 -4.67 118.94 117.61 1s6x s TRP 7 Ca 0.00 0.32 -0.21 0.00 0.02 0.00 0.00 56.10 56.23 1s6x s TRP 7 Cb 0.00 -4.02 -0.08 0.00 -1.15 0.00 0.00 33.47 28.22 1s6x s TRP 7 CO 0.00 -4.03 0.94 1.63 0.02 0.00 0.00 176.95 175.51 1s6x n LYS 8 N 5.01 1.07 -4.28 4.98 4.76 -1.26 -2.48 118.16 125.96 1s6x n LYS 8 Ca 0.16 0.40 -0.19 0.00 -2.87 0.00 0.00 58.31 55.80 1s6x n LYS 8 Cb 0.39 -2.07 -0.08 0.00 -1.84 0.00 0.00 35.03 31.42 1s6x n LYS 8 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1s6x n LYS 10 N -0.60 3.74 0.00 0.00 2.85 -1.26 -4.99 118.16 117.90 1s6x n LYS 10 Ca 0.07 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.33 1s6x n LYS 10 Cb 0.62 -0.98 0.00 0.00 -0.65 0.00 0.00 35.03 34.02 1s6x n LYS 10 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1s6x n ASN 11 N -1.97 0.00 0.00 -5.58 5.15 -1.26 -5.02 115.26 106.58 1s6x n ASN 11 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1s6x n ASN 11 Cb 0.48 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.73 1s6x n ASN 11 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1s6x n SER 12 N -1.03 0.00 0.00 1.20 7.64 -1.26 -3.62 113.62 116.54 1s6x n SER 12 Ca 0.00 0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.94 1s6x n SER 12 Cb 0.00 0.00 0.30 0.00 -1.01 0.00 0.00 64.21 63.50 1s6x n SER 12 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1s6x n ASN 13 N 0.00 0.00 -0.07 6.43 4.13 -1.26 -2.15 115.26 122.34 1s6x n ASN 13 Ca 0.00 -0.02 0.03 0.00 1.68 0.00 0.00 54.58 56.27 1s6x n ASN 13 Cb 0.00 -0.20 -0.02 0.00 -1.54 0.00 0.00 39.78 38.02 1s6x n ASN 13 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1s6x n ASP 14 N -1.20 0.61 -4.74 6.41 2.03 -1.26 -2.44 116.55 115.97 1s6x n ASP 14 Ca 0.06 -0.81 -0.40 0.00 0.52 0.00 0.00 54.79 54.16 1s6x n ASP 14 Cb 0.07 0.79 -0.05 0.00 -0.72 0.00 0.00 41.12 41.21 1s6x n ASP 14 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1s6x n LYS 17 N -3.61 0.92 -1.01 0.00 4.81 -1.26 0.13 118.16 118.14 1s6x n LYS 17 Ca 0.03 0.34 -0.00 0.00 -0.87 0.00 0.00 58.31 57.81 1s6x n LYS 17 Cb 0.57 -1.91 -0.00 0.00 0.02 0.00 0.00 35.03 33.70 1s6x n LYS 17 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1s6x n ASP 18 N 0.30 -5.35 -4.24 3.14 9.92 -1.26 -4.95 116.55 114.11 1s6x n ASP 18 Ca 0.11 0.01 -0.26 0.00 -0.53 0.00 0.00 54.79 54.12 1s6x n ASP 18 Cb 0.43 -2.89 -0.15 0.00 -0.64 0.00 0.00 41.12 37.88 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 -0.10 2.11 0.02 0.64 2.96 0.12 -1.88 118.68 122.55 1s6x s LEU 19 Ca 0.00 -0.46 -0.01 0.00 -0.22 0.00 0.00 54.13 53.44 1s6x s LEU 19 Cb 0.00 -1.02 -0.02 0.00 0.50 0.00 0.00 46.19 45.66 1s6x s LEU 19 CO 0.00 0.20 0.00 0.68 -1.32 0.00 0.00 176.35 175.92 1s6x s VAL 20 N -0.66 0.10 0.35 1.68 -7.23 -0.55 -4.39 120.40 109.71 1s6x s VAL 20 Ca 0.08 -0.86 -0.28 0.00 -1.81 0.00 0.00 61.98 59.10 1s6x s VAL 20 Cb -0.08 -0.29 -0.10 0.00 0.56 0.00 0.00 36.38 36.46 1s6x s VAL 20 CO 0.01 -0.47 1.36 0.00 -0.31 0.00 0.00 175.10 175.68 1s6x s SER 22 N -0.41 0.48 0.47 0.00 0.15 -0.23 -4.85 113.70 109.31 1s6x s SER 22 Ca 0.51 0.15 0.26 0.00 0.70 0.00 0.00 55.95 57.57 1s6x s SER 22 Cb -0.42 0.02 1.03 0.00 -1.71 0.00 0.00 66.02 64.95 1s6x s SER 22 CO 0.56 -0.19 1.87 0.28 1.20 0.00 0.00 173.24 176.96 1s6x h SER 23 N 7.83 0.00 0.69 5.45 0.02 -1.95 0.70 113.55 126.28 1s6x h SER 23 Ca -0.29 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.42 1s6x h SER 23 Cb 1.12 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.66 1s6x h SER 23 CO 0.31 0.18 -1.09 -0.09 -1.14 0.00 0.00 176.83 174.99 1s6x h ARG 24 N 0.00 0.20 0.00 3.45 2.43 -1.94 -3.22 114.38 115.30 1s6x h ARG 24 Ca -0.00 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 1s6x h ARG 24 Cb 0.68 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.33 1s6x h ARG 24 CO 0.02 1.11 -0.82 0.91 -1.51 0.00 0.00 179.97 179.68 1s6x n TRP 25 N -3.53 0.00 -2.25 2.20 7.02 -1.07 -4.96 117.44 114.85 1s6x n TRP 25 Ca -0.05 0.00 -0.16 0.00 -1.02 0.00 0.00 57.50 56.27 1s6x n TRP 25 Cb 0.95 -0.09 -0.01 0.00 -2.42 0.00 0.00 31.31 29.74 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 -1.50 -1.23 -3.21 -0.99 2.85 0.24 -4.92 118.16 109.39 1s6x n LYS 26 Ca 0.05 0.77 0.00 0.00 -1.05 0.00 0.00 58.31 58.07 1s6x n LYS 26 Cb 0.33 -5.12 0.00 0.00 -0.65 0.00 0.00 35.03 29.59 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 -3.94 0.00 -2.28 5.58 2.14 -0.94 -4.72 117.44 113.27 1s6x n TRP 27 Ca -0.18 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 58.96 1s6x n TRP 27 Cb 0.63 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 31.11 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 2.08 3.37 -0.28 0.00 -7.23 0.10 -3.15 120.40 115.30 1s6x s VAL 29 Ca 0.62 -1.88 -0.03 0.00 -1.81 0.00 0.00 61.98 58.88 1s6x s VAL 29 Cb -0.30 -2.77 -0.06 0.00 0.56 0.00 0.00 36.38 33.80 1s6x s VAL 29 CO 0.26 -0.32 1.60 0.18 -0.31 0.00 0.00 175.10 176.51 1s6x n LEU 30 N -0.70 2.36 -3.47 1.32 4.77 -1.26 -1.49 117.00 118.53 1s6x n LEU 30 Ca -0.07 -1.77 -0.22 0.00 -0.03 0.00 0.00 56.01 53.91 1s6x n LEU 30 Cb 0.58 -0.67 -0.05 0.00 -2.33 0.00 0.00 43.42 40.95 1s6x n LEU 30 CO 0.39 0.04 -0.20 0.00 -1.33 0.00 0.00 177.39 176.30 1s6x n ALA 31 N 3.72 -1.18 -3.63 -1.18 0.00 -0.79 -4.84 120.51 112.60 1s6x n ALA 31 Ca 0.21 -0.19 -0.07 0.00 0.00 0.00 0.00 53.44 53.39 1s6x n ALA 31 Cb 0.19 -0.99 -0.08 0.00 0.00 0.00 0.00 19.45 18.57 1s6x n ALA 31 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1s6x s SER 32 N -3.11 -0.43 -0.83 0.00 0.15 -1.26 -5.07 113.70 103.14 1s6x s SER 32 Ca 0.25 1.08 -0.26 0.00 0.70 0.00 0.00 55.95 57.72 1s6x s SER 32 Cb -0.14 1.55 0.03 0.00 -1.71 0.00 0.00 66.02 65.74 1s6x s SER 32 CO 0.61 -0.23 1.38 -2.16 1.20 0.00 0.00 173.24 174.04 1s6x s PRO 33 N 2.67 3.27 0.00 5.44 0.04 -1.26 -5.05 135.00 140.11 1s6x s PRO 33 Ca -0.02 -0.48 0.19 0.00 0.04 0.00 0.00 61.00 60.74 1s6x s PRO 33 Cb -0.12 -4.59 1.15 0.00 0.04 0.00 0.00 34.50 30.98 1s6x s PRO 33 CO -0.14 -2.23 1.54 1.19 0.04 0.00 0.00 177.00 177.40