#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rel n GLN 2 N 0.00 -1.67 -3.07 0.00 7.27 -1.26 -5.03 117.38 113.61 2rel n GLN 2 Ca 0.00 1.55 -0.18 0.00 0.07 0.00 0.00 57.00 58.45 2rel n GLN 2 Cb 0.00 -1.80 -0.04 0.00 2.41 0.00 0.00 30.24 30.82 2rel n GLN 2 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 2rel n GLU 3 N 0.59 0.54 -0.61 3.69 2.13 -1.26 -4.99 120.64 120.72 2rel n GLU 3 Ca 0.00 -2.66 -0.03 0.00 0.66 0.00 0.00 57.16 55.13 2rel n GLU 3 Cb 0.00 -1.45 -0.04 0.00 0.27 0.00 0.00 31.44 30.22 2rel n GLU 3 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 2rel n PRO 4 N 2.18 1.22 -3.42 5.31 -0.04 -1.26 -4.79 135.00 134.20 2rel n PRO 4 Ca 0.21 -0.22 -0.44 0.00 -0.04 0.00 0.00 63.50 63.00 2rel n PRO 4 Cb 0.54 -1.22 -0.06 0.00 -0.04 0.00 0.00 33.50 32.73 2rel n PRO 4 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2rel s VAL 5 N 0.20 4.85 0.10 0.52 1.01 -1.26 -4.80 120.40 121.01 2rel s VAL 5 Ca 0.14 -1.85 0.00 0.00 0.00 0.00 0.00 61.98 60.28 2rel s VAL 5 Cb 0.07 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.33 2rel s VAL 5 CO -0.00 -0.87 0.00 0.29 0.00 0.00 0.00 175.10 174.52 2rel n LYS 6 N 4.81 0.00 0.00 2.72 5.02 -1.26 -5.12 118.16 124.34 2rel n LYS 6 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 2rel n LYS 6 Cb 0.41 -0.05 0.00 0.00 -0.02 0.00 0.00 35.03 35.38 2rel n LYS 6 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rel n GLY 7 N 1.98 0.69 0.38 0.72 0.00 -1.26 -5.11 105.19 102.59 2rel n GLY 7 Ca 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 46.02 45.88 2rel n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2rel n PRO 8 N 0.00 -0.34 0.00 1.61 -0.04 -1.26 -4.60 135.00 130.37 2rel n PRO 8 Ca 0.00 -0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 2rel n PRO 8 Cb 0.00 -0.14 0.00 0.00 -0.04 0.00 0.00 33.50 33.32 2rel n PRO 8 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2rel n VAL 9 N -2.29 0.00 -4.67 0.52 3.14 -1.26 -4.83 118.33 108.94 2rel n VAL 9 Ca 0.02 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.40 2rel n VAL 9 Cb 0.06 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.84 2rel n VAL 9 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2rel n SER 10 N 1.11 0.00 0.00 6.55 7.64 -1.26 -4.87 113.62 122.79 2rel n SER 10 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2rel n SER 10 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2rel n SER 10 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2rel n THR 11 N 0.00 0.00 -3.18 0.44 5.66 -1.26 -5.00 114.28 110.93 2rel n THR 11 Ca 0.00 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.80 2rel n THR 11 Cb 0.00 -0.01 -0.04 0.00 -1.55 0.00 0.00 70.33 68.73 2rel n THR 11 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 2rel n LYS 12 N -2.49 1.03 0.00 1.09 2.85 -1.26 -5.00 118.16 114.38 2rel n LYS 12 Ca 0.00 -3.42 0.00 0.00 -1.05 0.00 0.00 58.31 53.84 2rel n LYS 12 Cb 0.00 -1.65 0.00 0.00 -0.65 0.00 0.00 35.03 32.73 2rel n LYS 12 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 2rel n PRO 13 N 0.46 0.00 0.00 -1.58 -0.04 -1.26 -4.99 135.00 127.59 2rel n PRO 13 Ca 0.25 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 2rel n PRO 13 Cb 0.62 -0.31 0.00 0.00 -0.04 0.00 0.00 33.50 33.78 2rel n PRO 13 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2rel n GLY 14 N 2.41 1.13 2.74 0.55 0.00 -1.26 -5.06 105.19 105.70 2rel n GLY 14 Ca 0.00 -1.21 -0.28 0.00 0.00 0.00 0.00 46.02 44.53 2rel n GLY 14 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2rel s SER 15 N -1.00 3.22 0.70 1.61 0.15 -1.26 -4.95 113.70 112.17 2rel s SER 15 Ca 0.00 -1.03 -0.14 0.00 0.70 0.00 0.00 55.95 55.47 2rel s SER 15 Cb 0.00 -0.67 0.02 0.00 -1.71 0.00 0.00 66.02 63.66 2rel s SER 15 CO 0.00 -0.33 1.14 0.00 1.20 0.00 0.00 173.24 175.25 2rel n PRO 17 N -2.66 -0.01 -5.09 0.00 -0.04 -1.26 -5.08 135.00 120.87 2rel n PRO 17 Ca 0.11 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.28 2rel n PRO 17 Cb 0.51 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.82 2rel n PRO 17 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 2rel s ILE 18 N -0.80 1.88 0.23 0.52 -1.16 -1.26 -4.88 121.20 115.73 2rel s ILE 18 Ca 0.00 -1.08 0.03 0.00 -0.51 0.00 0.00 60.65 59.09 2rel s ILE 18 Cb 0.00 -1.57 -0.05 0.00 0.61 0.00 0.00 42.46 41.45 2rel s ILE 18 CO 0.00 0.47 0.03 -0.63 -2.81 0.00 0.00 174.94 172.00 2rel s ILE 19 N -0.61 0.84 0.00 2.00 -1.09 -1.26 -4.99 121.20 116.09 2rel s ILE 19 Ca 0.09 -2.01 0.00 0.00 -2.23 0.00 0.00 60.65 56.50 2rel s ILE 19 Cb -0.09 -2.42 0.00 0.00 -1.58 0.00 0.00 42.46 38.37 2rel s ILE 19 CO -0.00 -0.24 0.95 -0.11 -1.23 0.00 0.00 174.94 174.31 2rel n LEU 20 N -0.42 0.00 0.00 2.97 0.00 -1.26 -4.85 117.00 113.44 2rel n LEU 20 Ca -0.04 0.95 0.00 0.00 0.00 0.00 0.00 56.01 56.92 2rel n LEU 20 Cb 0.65 -0.45 0.00 0.00 0.00 0.00 0.00 43.42 43.62 2rel n LEU 20 CO 0.37 -0.45 0.00 -0.38 0.00 0.00 0.00 177.39 176.93 2rel n ILE 21 N -2.55 0.00 -2.10 1.96 5.41 -1.26 -5.03 119.36 115.79 2rel n ILE 21 Ca 0.00 0.00 -0.03 0.00 1.00 0.00 0.00 62.75 63.72 2rel n ILE 21 Cb 0.00 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 38.90 2rel n ILE 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2rel n ARG 22 N 0.00 0.00 -3.04 0.38 5.12 -0.70 -3.66 116.66 114.76 2rel n ARG 22 Ca 0.00 -0.99 0.00 0.00 -1.93 0.00 0.00 57.85 54.93 2rel n ARG 22 Cb 0.00 0.21 0.00 0.00 -1.16 0.00 0.00 32.46 31.51 2rel n ARG 22 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2rel n ALA 24 N 2.17 6.77 -1.93 0.00 0.00 -1.26 -4.70 120.51 121.57 2rel n ALA 24 Ca 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 53.44 49.99 2rel n ALA 24 Cb 0.13 -2.62 0.00 0.00 0.00 0.00 0.00 19.45 16.96 2rel n ALA 24 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2rel n MET 25 N 1.82 0.00 0.00 0.00 2.81 -1.26 -5.12 117.12 115.37 2rel n MET 25 Ca 0.59 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.48 2rel n MET 25 Cb 0.41 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.92 2rel n MET 25 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2rel n LEU 26 N 0.00 0.00 -3.90 4.03 4.32 -1.26 -5.06 117.00 115.13 2rel n LEU 26 Ca 0.00 0.00 -0.30 0.00 -0.02 0.00 0.00 56.01 55.69 2rel n LEU 26 Cb 0.00 0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 41.66 2rel n LEU 26 CO 0.00 0.00 -0.23 0.20 -1.22 0.00 0.00 177.39 176.14 2rel s ASN 27 N 1.00 4.23 0.81 -1.43 0.01 -1.26 -5.10 114.94 113.21 2rel s ASN 27 Ca 0.00 -2.70 -0.11 0.00 -0.71 0.00 0.00 52.86 49.33 2rel s ASN 27 Cb 0.00 -1.46 0.08 0.00 0.41 0.00 0.00 41.25 40.28 2rel s ASN 27 CO 0.00 -0.28 1.10 -2.16 -1.51 0.00 0.00 177.10 174.25 2rel s PRO 28 N 0.16 1.97 1.00 -0.60 0.04 -1.26 -5.06 135.00 131.25 2rel s PRO 28 Ca 0.16 0.66 -0.16 0.00 0.04 0.00 0.00 61.00 61.69 2rel s PRO 28 Cb -0.24 -1.90 0.21 0.00 0.04 0.00 0.00 34.50 32.61 2rel s PRO 28 CO -0.03 -1.71 1.27 -1.25 0.04 0.00 0.00 177.00 175.33 2rel s PRO 29 N -5.13 0.34 0.11 0.56 0.04 -1.26 -4.94 135.00 124.72 2rel s PRO 29 Ca 0.61 -0.30 -0.23 0.00 0.04 0.00 0.00 61.00 61.11 2rel s PRO 29 Cb -0.15 -1.80 0.06 0.00 0.04 0.00 0.00 34.50 32.65 2rel s PRO 29 CO 0.54 -2.63 0.58 -0.80 0.04 0.00 0.00 177.00 174.73 2rel s ASN 30 N -4.66 -0.53 -0.21 6.66 0.01 -1.26 -4.33 114.94 110.61 2rel s ASN 30 Ca 0.73 0.10 -0.02 0.00 -0.71 0.00 0.00 52.86 52.96 2rel s ASN 30 Cb -0.06 0.56 -0.13 0.00 0.41 0.00 0.00 41.25 42.04 2rel s ASN 30 CO 0.53 -0.87 -0.22 0.54 -1.51 0.00 0.00 177.10 175.58 2rel n ARG 31 N -0.06 0.51 -4.03 -0.60 3.00 -0.57 -4.97 116.66 109.94 2rel n ARG 31 Ca -0.17 0.15 -0.10 0.00 -0.01 0.00 0.00 57.85 57.71 2rel n ARG 31 Cb 0.63 -1.39 -0.08 0.00 0.00 0.00 0.00 32.46 31.63 2rel n ARG 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2rel n LEU 33 N -0.22 -1.89 -1.11 0.00 -0.00 -1.26 -4.62 117.00 107.89 2rel n LEU 33 Ca -0.05 -3.32 -0.00 0.00 -0.00 0.00 0.00 56.01 52.64 2rel n LEU 33 Cb 0.63 0.24 0.00 0.00 -0.00 0.00 0.00 43.42 44.29 2rel n LEU 33 CO 0.26 1.85 0.00 0.29 -0.00 0.00 0.00 177.39 179.79 2rel n LYS 34 N -0.44 -0.04 0.00 1.47 4.76 -1.26 -5.00 118.16 117.65 2rel n LYS 34 Ca -0.04 0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 2rel n LYS 34 Cb 0.81 -2.32 0.00 0.00 -1.84 0.00 0.00 35.03 31.68 2rel n LYS 34 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2rel n ASP 35 N -1.11 0.00 -3.67 4.39 9.92 -1.26 -4.83 116.55 119.99 2rel n ASP 35 Ca -0.00 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.13 2rel n ASP 35 Cb 0.50 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 40.90 2rel n ASP 35 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 2rel s THR 36 N 0.76 -0.00 0.00 -3.53 -1.32 -1.26 -4.66 115.64 105.63 2rel s THR 36 Ca 0.00 0.01 0.00 0.00 -1.21 0.00 0.00 61.69 60.49 2rel s THR 36 Cb 0.00 -0.82 0.00 0.00 -1.51 0.00 0.00 72.50 70.17 2rel s THR 36 CO 0.00 0.00 0.00 -0.67 -2.21 0.00 0.00 174.62 171.74 2rel n ASP 37 N 3.01 0.00 -4.13 8.08 2.03 -1.26 -4.87 116.55 119.41 2rel n ASP 37 Ca -0.15 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 54.79 2rel n ASP 37 Cb 0.56 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.87 2rel n ASP 37 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2rel h PRO 39 N 7.51 0.00 0.00 0.00 0.13 -1.98 -3.42 132.00 134.24 2rel h PRO 39 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2rel h PRO 39 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2rel h PRO 39 CO 0.73 0.68 0.00 0.41 -0.23 0.00 0.00 178.00 179.59 2rel n GLY 40 N 0.96 -2.86 2.46 1.56 0.00 -1.26 -4.88 105.19 101.17 2rel n GLY 40 Ca 0.00 -0.41 -0.14 0.00 0.00 0.00 0.00 46.02 45.47 2rel n GLY 40 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2rel n ILE 41 N 0.00 1.86 -4.36 -0.61 3.06 -1.26 -5.07 119.36 112.98 2rel n ILE 41 Ca 0.00 -3.70 -0.16 0.00 -2.50 0.00 0.00 62.75 56.39 2rel n ILE 41 Cb 0.00 -0.05 -0.03 0.00 0.54 0.00 0.00 39.64 40.10 2rel n ILE 41 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 2rel n LYS 42 N -0.56 1.39 -3.97 9.51 5.02 -1.26 -4.33 118.16 123.96 2rel n LYS 42 Ca 0.26 -1.81 -0.10 0.00 -2.02 0.00 0.00 58.31 54.64 2rel n LYS 42 Cb 0.85 0.48 -0.06 0.00 -0.02 0.00 0.00 35.03 36.27 2rel n LYS 42 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2rel s LYS 43 N -2.90 1.32 -0.96 1.97 -0.14 -1.15 -4.89 119.74 113.00 2rel s LYS 43 Ca 0.00 -1.21 -0.24 0.00 -1.36 0.00 0.00 55.97 53.16 2rel s LYS 43 Cb -0.00 0.42 0.04 0.00 -1.68 0.00 0.00 37.83 36.61 2rel s LYS 43 CO 0.00 -0.52 1.44 0.00 -0.76 0.00 0.00 175.35 175.52 2rel s GLU 46 N -0.34 3.34 -0.22 0.00 2.02 -1.26 -2.92 118.70 119.31 2rel s GLU 46 Ca 0.00 -0.21 0.11 0.00 0.02 0.00 0.00 54.97 54.90 2rel s GLU 46 Cb 0.00 -3.09 0.44 0.00 0.10 0.00 0.00 34.13 31.57 2rel s GLU 46 CO 0.00 0.75 1.20 0.41 0.02 0.00 0.00 175.26 177.65 2rel n GLY 47 N 1.93 5.08 4.20 -1.39 0.00 -1.19 -4.69 105.19 109.13 2rel n GLY 47 Ca -0.19 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2rel n GLY 47 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2rel n SER 48 N -0.85 0.00 -3.15 1.61 2.88 -1.24 -4.73 113.62 108.13 2rel n SER 48 Ca 0.25 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.81 2rel n SER 48 Cb 0.81 -0.06 -0.01 0.00 -0.75 0.00 0.00 64.21 64.21 2rel n SER 48 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2rel n GLY 50 N 4.50 2.11 3.83 0.00 0.00 -1.26 -4.82 105.19 109.55 2rel n GLY 50 Ca 0.09 -1.56 -0.33 0.00 0.00 0.00 0.00 46.02 44.23 2rel n GLY 50 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2rel s MET 51 N -5.00 4.12 0.27 1.61 1.00 -1.26 -3.14 119.30 116.90 2rel s MET 51 Ca 0.00 0.95 -0.16 0.00 0.00 0.00 0.00 55.69 56.47 2rel s MET 51 Cb 0.00 -2.26 0.01 0.00 0.00 0.00 0.00 34.83 32.58 2rel s MET 51 CO 0.00 0.00 0.59 0.00 0.00 0.00 0.00 175.02 175.61 2rel s ALA 52 N -2.17 -0.66 -0.49 3.03 0.00 -1.15 -1.51 121.76 118.81 2rel s ALA 52 Ca 0.59 -0.64 -0.29 0.00 0.00 0.00 0.00 51.96 51.62 2rel s ALA 52 Cb -0.09 0.97 0.03 0.00 0.00 0.00 0.00 23.12 24.02 2rel s ALA 52 CO 0.17 -0.94 1.13 0.00 0.00 0.00 0.00 175.76 176.12 2rel s PHE 54 N 4.47 3.25 0.05 0.00 0.40 -0.34 -4.79 117.98 121.03 2rel s PHE 54 Ca 0.47 0.23 -0.30 0.00 -0.60 0.00 0.00 56.93 56.73 2rel s PHE 54 Cb -0.07 -1.78 -0.04 0.00 0.51 0.00 0.00 43.02 41.63 2rel s PHE 54 CO 0.31 0.53 1.00 0.54 0.70 0.00 0.00 175.22 178.30 2rel s VAL 55 N -1.02 4.61 0.58 -0.44 0.11 -1.26 -2.92 120.40 120.06 2rel s VAL 55 Ca 0.17 1.99 -0.10 0.00 -2.93 0.00 0.00 61.98 61.11 2rel s VAL 55 Cb -0.12 -4.27 0.14 0.00 -1.53 0.00 0.00 36.38 30.60 2rel s VAL 55 CO 0.07 0.22 0.75 -0.81 -3.33 0.00 0.00 175.10 172.00 2rel n PRO 56 N 3.42 -0.95 0.00 1.54 -0.04 -1.26 -4.85 135.00 132.85 2rel n PRO 56 Ca 0.05 -1.16 0.14 0.00 -0.04 0.00 0.00 63.50 62.48 2rel n PRO 56 Cb 0.50 -0.81 0.53 0.00 -0.04 0.00 0.00 33.50 33.67 2rel n PRO 56 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50