#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rel s GLN 2 N 0.00 1.99 -0.51 0.00 -0.44 -1.26 -4.75 119.66 114.69 2rel s GLN 2 Ca 0.00 1.25 0.07 0.00 -2.50 0.00 0.00 55.36 54.18 2rel s GLN 2 Cb 0.00 -4.62 0.19 0.00 -1.64 0.00 0.00 33.01 26.94 2rel s GLN 2 CO 0.00 -3.51 0.74 0.39 0.50 0.00 0.00 175.29 173.42 2rel n GLU 3 N 8.98 0.53 -2.49 1.67 1.02 -1.26 -5.07 120.64 124.01 2rel n GLU 3 Ca 0.39 -2.00 -0.40 0.00 -0.02 0.00 0.00 57.16 55.13 2rel n GLU 3 Cb 0.53 -1.42 -0.02 0.00 -0.02 0.00 0.00 31.44 30.51 2rel n GLU 3 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2rel s PRO 4 N 0.87 3.62 -0.30 3.49 0.04 -1.26 -4.66 135.00 136.80 2rel s PRO 4 Ca 0.30 -1.50 0.19 0.00 0.04 0.00 0.00 61.00 60.03 2rel s PRO 4 Cb 0.01 -5.42 0.47 0.00 0.04 0.00 0.00 34.50 29.60 2rel s PRO 4 CO -0.05 -2.46 1.14 1.55 0.04 0.00 0.00 177.00 177.21 2rel n VAL 5 N 6.80 0.92 0.00 -0.36 3.14 -1.26 -4.86 118.33 122.70 2rel n VAL 5 Ca 0.42 -2.59 0.00 0.00 -2.96 0.00 0.00 64.34 59.21 2rel n VAL 5 Cb 0.48 1.06 0.00 0.00 -1.06 0.00 0.00 33.84 34.32 2rel n VAL 5 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 2rel n LYS 6 N -0.57 2.54 0.00 1.45 0.00 -1.26 -5.14 118.16 115.18 2rel n LYS 6 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.34 2rel n LYS 6 Cb 0.82 -0.74 0.00 0.00 -0.00 0.00 0.00 35.03 35.11 2rel n LYS 6 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2rel n GLY 7 N 1.43 -1.90 1.20 2.58 0.00 -1.26 -4.53 105.19 102.72 2rel n GLY 7 Ca 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.57 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 -1.13 1.00 -0.05 1.61 -0.04 -1.26 -3.66 135.00 131.47 2rel n PRO 8 Ca 0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.40 2rel n PRO 8 Cb 0.00 -1.00 -0.06 0.00 -0.04 0.00 0.00 33.50 32.40 2rel n PRO 8 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2rel n VAL 9 N 0.90 0.63 0.00 0.52 0.24 -1.26 -4.82 118.33 114.53 2rel n VAL 9 Ca 0.00 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 2rel n VAL 9 Cb 0.50 -0.82 0.00 0.00 -1.47 0.00 0.00 33.84 32.05 2rel n VAL 9 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2rel n SER 10 N -2.52 0.00 -1.36 -1.34 3.41 -1.24 -4.90 113.62 105.67 2rel n SER 10 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.44 2rel n SER 10 Cb 0.76 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.71 2rel n SER 10 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2rel n THR 11 N -0.32 0.00 -0.03 6.66 -1.04 -1.26 -4.65 114.28 113.65 2rel n THR 11 Ca 0.00 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.79 2rel n THR 11 Cb 0.00 0.00 -0.13 0.00 -1.82 0.00 0.00 70.33 68.38 2rel n THR 11 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 2rel h LYS 12 N 0.00 0.18 0.00 -2.82 1.79 -2.00 -3.44 116.57 110.28 2rel h LYS 12 Ca 0.00 -0.31 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 2rel h LYS 12 Cb 0.00 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 2rel h LYS 12 CO 0.00 1.15 0.00 -0.35 -1.08 0.00 0.00 179.45 179.17 2rel n PRO 13 N -3.88 1.46 -1.46 3.15 -0.04 -1.26 -4.76 135.00 128.22 2rel n PRO 13 Ca -0.30 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 62.72 2rel n PRO 13 Cb 0.90 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 34.22 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 4.74 -0.39 0.57 0.55 0.00 -1.26 -4.19 105.19 105.20 2rel n GLY 14 Ca 0.00 1.13 0.00 0.00 0.00 0.00 0.00 46.02 47.15 2rel n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2rel n SER 15 N 10.17 0.00 -3.95 1.61 3.41 -1.26 -4.11 113.62 119.49 2rel n SER 15 Ca 0.63 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 59.10 2rel n SER 15 Cb 0.04 0.14 -0.13 0.00 -0.26 0.00 0.00 64.21 64.00 2rel n SER 15 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rel n PRO 17 N 2.61 -1.05 -2.75 0.00 -0.04 -1.26 -4.86 135.00 127.65 2rel n PRO 17 Ca -0.15 -1.38 -0.40 0.00 -0.04 0.00 0.00 63.50 61.52 2rel n PRO 17 Cb 0.58 -0.95 -0.05 0.00 -0.04 0.00 0.00 33.50 33.03 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 -2.92 4.27 -0.28 0.52 -1.16 -1.26 -4.88 121.20 115.49 2rel s ILE 18 Ca 0.51 2.07 -0.03 0.00 -0.51 0.00 0.00 60.65 62.69 2rel s ILE 18 Cb -0.02 -4.32 0.09 0.00 0.61 0.00 0.00 42.46 38.83 2rel s ILE 18 CO 0.36 0.42 0.11 -0.63 -2.81 0.00 0.00 174.94 172.39 2rel s ILE 19 N -0.65 0.31 0.00 2.00 -1.09 -1.26 -4.86 121.20 115.65 2rel s ILE 19 Ca 0.43 -0.94 0.00 0.00 -2.23 0.00 0.00 60.65 57.92 2rel s ILE 19 Cb -0.25 -1.20 0.00 0.00 -1.58 0.00 0.00 42.46 39.43 2rel s ILE 19 CO 0.31 -0.65 0.00 0.00 -1.23 0.00 0.00 174.94 173.37 2rel n LEU 20 N 5.10 0.00 0.00 2.97 -0.00 -1.26 -4.88 117.00 118.92 2rel n LEU 20 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.96 2rel n LEU 20 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.85 2rel n LEU 20 CO 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 177.39 177.47 2rel n ILE 21 N 0.00 0.00 -2.96 1.47 0.13 -1.26 -5.02 119.36 111.73 2rel n ILE 21 Ca 0.00 0.00 -0.14 0.00 -1.10 0.00 0.00 62.75 61.51 2rel n ILE 21 Cb 0.00 0.00 0.01 0.00 -0.84 0.00 0.00 39.64 38.81 2rel n ILE 21 CO 0.00 0.00 0.00 0.54 2.80 0.00 0.00 176.55 179.89 2rel n ARG 22 N 0.00 1.04 -3.91 9.51 1.74 -1.17 -3.68 116.66 120.19 2rel n ARG 22 Ca 0.00 -3.10 -0.29 0.00 -0.77 0.00 0.00 57.85 53.69 2rel n ARG 22 Cb 0.00 -1.40 -0.03 0.00 -1.02 0.00 0.00 32.46 30.01 2rel n ARG 22 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2rel n ALA 24 N -3.77 -0.00 0.00 0.00 0.00 -1.26 -4.37 120.51 111.11 2rel n ALA 24 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2rel n ALA 24 Cb 0.45 -0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 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 -4.00 0.00 0.01 0.00 2.81 -1.26 -4.29 117.12 110.38 2rel n MET 25 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2rel n MET 25 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 2rel n MET 25 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2rel n LEU 26 N 0.00 -0.08 -3.39 4.03 -0.00 -1.26 -5.06 117.00 111.23 2rel n LEU 26 Ca 0.00 0.03 -0.25 0.00 -0.00 0.00 0.00 56.01 55.78 2rel n LEU 26 Cb 0.00 0.33 -0.10 0.00 -0.00 0.00 0.00 43.42 43.65 2rel n LEU 26 CO 0.00 -0.49 -0.28 0.20 -0.00 0.00 0.00 177.39 176.82 2rel s ASN 27 N -2.47 1.98 0.29 1.96 0.01 -1.26 -5.12 114.94 110.33 2rel s ASN 27 Ca 0.00 -2.37 -0.28 0.00 -0.71 0.00 0.00 52.86 49.50 2rel s ASN 27 Cb 0.00 -0.17 -0.09 0.00 0.41 0.00 0.00 41.25 41.40 2rel s ASN 27 CO 0.00 -0.24 0.99 -2.16 -1.51 0.00 0.00 177.10 174.18 2rel s PRO 28 N 0.78 4.64 0.00 -0.60 0.04 -1.26 -5.06 135.00 133.53 2rel s PRO 28 Ca 0.23 1.53 0.00 0.00 0.04 0.00 0.00 61.00 62.80 2rel s PRO 28 Cb -0.12 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.39 2rel s PRO 28 CO -0.07 0.29 0.00 -0.35 0.04 0.00 0.00 177.00 176.91 2rel n PRO 29 N 0.95 0.05 -0.70 0.56 -0.04 -1.26 -4.87 135.00 129.68 2rel n PRO 29 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2rel n PRO 29 Cb 0.48 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.94 2rel n PRO 29 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2rel n ASN 30 N -2.46 0.00 0.00 3.54 3.02 -1.26 -3.93 115.26 114.17 2rel n ASN 30 Ca 0.00 -0.42 0.00 0.00 -0.03 0.00 0.00 54.58 54.13 2rel n ASN 30 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2rel n ASN 30 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2rel n ARG 31 N 0.00 0.00 -3.81 3.52 1.74 -1.23 -4.92 116.66 111.97 2rel n ARG 31 Ca 0.00 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.06 2rel n ARG 31 Cb 0.00 -0.43 0.00 0.00 -1.02 0.00 0.00 32.46 31.02 2rel n ARG 31 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2rel n LEU 33 N -0.60 0.00 0.00 0.00 4.77 -1.26 -4.51 117.00 115.40 2rel n LEU 33 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 2rel n LEU 33 Cb 0.60 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 2rel n LEU 33 CO 0.17 0.00 0.00 2.29 -1.33 0.00 0.00 177.39 178.52 2rel n LYS 34 N -1.36 0.00 -0.97 3.23 2.85 -1.26 -4.86 118.16 115.79 2rel n LYS 34 Ca 0.00 0.00 0.01 0.00 -1.05 0.00 0.00 58.31 57.27 2rel n LYS 34 Cb 0.00 0.00 0.37 0.00 -0.65 0.00 0.00 35.03 34.75 2rel n LYS 34 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2rel n ASP 35 N -1.07 5.41 -4.72 -5.58 9.92 -1.26 -4.87 116.55 114.38 2rel n ASP 35 Ca 0.00 -3.06 -0.23 0.00 -0.53 0.00 0.00 54.79 50.97 2rel n ASP 35 Cb 0.00 -0.72 -0.06 0.00 -0.64 0.00 0.00 41.12 39.70 2rel n ASP 35 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2rel s THR 36 N -2.87 3.06 -0.08 -3.53 2.01 -1.26 -5.12 115.64 107.84 2rel s THR 36 Ca 0.55 -1.72 -0.01 0.00 0.31 0.00 0.00 61.69 60.83 2rel s THR 36 Cb 0.43 -2.97 -0.03 0.00 0.01 0.00 0.00 72.50 69.94 2rel s THR 36 CO 0.15 -0.20 -0.03 -1.81 -0.69 0.00 0.00 174.62 172.05 2rel s ASP 37 N -3.83 4.99 -0.69 3.53 1.01 -1.26 -4.91 116.67 115.50 2rel s ASP 37 Ca 0.37 0.07 0.01 0.00 0.71 0.00 0.00 52.55 53.72 2rel s ASP 37 Cb -0.03 -1.35 0.17 0.00 1.01 0.00 0.00 42.92 42.73 2rel s ASP 37 CO 0.22 0.37 0.50 0.00 0.21 0.00 0.00 175.17 176.48 2rel n PRO 39 N 2.66 2.98 0.00 0.00 -0.04 -1.26 -3.63 135.00 135.71 2rel n PRO 39 Ca 0.14 -2.47 0.00 0.00 -0.04 0.00 0.00 63.50 61.13 2rel n PRO 39 Cb 0.35 -3.15 0.00 0.00 -0.04 0.00 0.00 33.50 30.66 2rel n PRO 39 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2rel n GLY 40 N 3.99 0.02 2.79 0.55 0.00 -1.26 -5.08 105.19 106.20 2rel n GLY 40 Ca 0.58 -0.01 -0.16 0.00 0.00 0.00 0.00 46.02 46.43 2rel n GLY 40 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2rel s ILE 41 N -1.02 -0.38 0.00 -0.61 2.07 -1.24 -5.06 121.20 114.96 2rel s ILE 41 Ca 0.00 -0.92 0.00 0.00 -1.41 0.00 0.00 60.65 58.32 2rel s ILE 41 Cb 0.00 -0.64 0.00 0.00 0.13 0.00 0.00 42.46 41.95 2rel s ILE 41 CO 0.00 -0.54 0.00 0.29 -1.91 0.00 0.00 174.94 172.78 2rel n LYS 42 N 4.28 0.00 -0.88 3.50 4.01 -1.25 -3.59 118.16 124.23 2rel n LYS 42 Ca 0.11 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.91 2rel n LYS 42 Cb 0.46 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.98 2rel n LYS 42 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 2rel n LYS 43 N 0.00 0.00 -2.53 1.97 4.01 -1.22 -4.56 118.16 115.83 2rel n LYS 43 Ca 0.00 0.00 -0.33 0.00 -0.51 0.00 0.00 58.31 57.47 2rel n LYS 43 Cb 0.00 0.00 -0.04 0.00 -0.51 0.00 0.00 35.03 34.48 2rel n LYS 43 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2rel s GLU 46 N -1.84 3.77 0.03 0.00 2.02 -1.26 -3.14 118.70 118.27 2rel s GLU 46 Ca 0.00 0.65 -0.00 0.00 0.02 0.00 0.00 54.97 55.64 2rel s GLU 46 Cb 0.00 -2.24 -0.02 0.00 0.10 0.00 0.00 34.13 31.97 2rel s GLU 46 CO 0.00 -0.25 -0.03 0.20 0.02 0.00 0.00 175.26 175.20 2rel s GLY 47 N -3.47 0.30 0.00 -1.39 0.00 -1.26 -4.80 107.32 96.70 2rel s GLY 47 Ca 0.54 -0.72 0.07 0.00 0.00 0.00 0.00 44.72 44.61 2rel s GLY 47 CO 0.38 -0.79 1.20 1.44 0.00 0.00 0.00 173.10 175.33 2rel n SER 48 N 1.31 0.00 -3.03 1.64 7.64 -1.24 -4.05 113.62 115.89 2rel n SER 48 Ca -0.22 0.48 -0.01 0.00 1.01 0.00 0.00 58.87 60.13 2rel n SER 48 Cb 0.56 -0.49 -0.00 0.00 -1.01 0.00 0.00 64.21 63.27 2rel n SER 48 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2rel n GLY 50 N 3.89 -1.30 3.08 0.00 0.00 -1.26 -4.92 105.19 104.67 2rel n GLY 50 Ca 0.13 -0.82 -0.26 0.00 0.00 0.00 0.00 46.02 45.07 2rel n GLY 50 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2rel n MET 51 N 1.31 -1.44 -3.73 1.61 1.56 -1.25 -4.42 117.12 110.76 2rel n MET 51 Ca 0.00 -0.42 0.00 0.00 -0.27 0.00 0.00 57.70 57.01 2rel n MET 51 Cb 0.00 -1.42 0.00 0.00 2.15 0.00 0.00 33.22 33.95 2rel n MET 51 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2rel n ALA 52 N -4.14 0.00 -2.66 -5.12 0.00 -1.19 -3.47 120.51 103.93 2rel n ALA 52 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.05 2rel n ALA 52 Cb 0.50 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.91 2rel n ALA 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rel s PHE 54 N 2.23 1.67 -0.71 0.00 0.40 0.33 -4.82 117.98 117.10 2rel s PHE 54 Ca 0.35 -0.95 -0.01 0.00 -0.60 0.00 0.00 56.93 55.72 2rel s PHE 54 Cb -0.16 -1.70 0.18 0.00 0.51 0.00 0.00 43.02 41.84 2rel s PHE 54 CO 0.11 -0.08 0.53 0.54 0.70 0.00 0.00 175.22 177.02 2rel s VAL 55 N -2.86 3.70 0.00 -0.44 0.11 -1.26 -3.45 120.40 116.20 2rel s VAL 55 Ca 0.13 -3.43 0.00 0.00 -2.93 0.00 0.00 61.98 55.75 2rel s VAL 55 Cb -0.01 -3.38 0.00 0.00 -1.53 0.00 0.00 36.38 31.46 2rel s VAL 55 CO 0.08 -0.95 0.00 -0.81 -3.33 0.00 0.00 175.10 170.09 2rel n PRO 56 N 2.91 2.14 0.00 1.54 -0.04 -1.26 -4.80 135.00 135.48 2rel n PRO 56 Ca 0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 2rel n PRO 56 Cb 0.37 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.83 2rel n PRO 56 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50