#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 -1.37 -4.49 0.00 6.02 -1.26 -4.96 117.38 111.32 2rel n GLN 2 Ca 0.00 0.84 -0.30 0.00 -0.01 0.00 0.00 57.00 57.53 2rel n GLN 2 Cb 0.00 -3.19 -0.12 0.00 1.02 0.00 0.00 30.24 27.95 2rel n GLN 2 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2rel s GLU 3 N -4.79 1.93 -0.06 -1.09 2.02 -1.26 -5.10 118.70 110.36 2rel s GLU 3 Ca 0.07 -1.08 -0.30 0.00 0.02 0.00 0.00 54.97 53.69 2rel s GLU 3 Cb -0.03 -2.15 -0.02 0.00 0.10 0.00 0.00 34.13 32.02 2rel s GLU 3 CO 0.87 0.51 1.06 -1.25 0.02 0.00 0.00 175.26 176.47 2rel s PRO 4 N -1.77 4.44 -1.14 0.39 0.04 -1.26 -4.95 135.00 130.75 2rel s PRO 4 Ca 0.16 1.49 -0.05 0.00 0.04 0.00 0.00 61.00 62.64 2rel s PRO 4 Cb -0.11 -3.51 0.10 0.00 0.04 0.00 0.00 34.50 31.02 2rel s PRO 4 CO 0.08 -0.27 2.50 1.55 0.04 0.00 0.00 177.00 180.89 2rel n VAL 5 N 4.35 4.80 0.00 -0.36 3.14 -1.26 -4.57 118.33 124.44 2rel n VAL 5 Ca 0.09 -3.96 0.00 0.00 -2.96 0.00 0.00 64.34 57.50 2rel n VAL 5 Cb 0.49 -1.99 0.00 0.00 -1.06 0.00 0.00 33.84 31.27 2rel n VAL 5 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 2rel n LYS 6 N 1.62 0.00 -0.37 1.45 4.01 -1.26 -5.12 118.16 118.48 2rel n LYS 6 Ca 0.60 0.00 0.05 0.00 -0.51 0.00 0.00 58.31 58.45 2rel n LYS 6 Cb 0.32 -0.06 -0.01 0.00 -0.51 0.00 0.00 35.03 34.76 2rel n LYS 6 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2rel n GLY 7 N 3.05 -2.09 0.00 0.72 0.00 -1.26 -4.76 105.19 100.86 2rel n GLY 7 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.62 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 -1.76 2.00 -0.49 1.61 -0.04 -1.26 -4.77 135.00 130.29 2rel n PRO 8 Ca 0.00 0.00 0.41 0.00 -0.04 0.00 0.00 63.50 63.87 2rel n PRO 8 Cb 0.17 0.00 0.69 0.00 -0.04 0.00 0.00 33.50 34.32 2rel n PRO 8 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 2rel h VAL 9 N -0.07 0.03 0.00 0.52 -1.51 -1.90 -3.41 116.25 109.91 2rel h VAL 9 Ca 0.00 -0.01 0.00 0.00 -1.23 0.00 0.00 66.70 65.46 2rel h VAL 9 Cb 0.00 0.01 0.00 0.00 -2.13 0.00 0.00 31.29 29.17 2rel h VAL 9 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 177.57 174.80 2rel n SER 10 N -4.66 0.00 0.00 4.19 3.41 -1.26 -5.01 113.62 110.29 2rel n SER 10 Ca 0.40 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.01 2rel n SER 10 Cb 1.58 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.53 2rel n SER 10 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2rel n THR 11 N -0.05 0.00 0.05 6.66 5.66 -1.26 -4.60 114.28 120.74 2rel n THR 11 Ca 0.00 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.79 2rel n THR 11 Cb 0.00 -0.48 -0.15 0.00 -1.55 0.00 0.00 70.33 68.16 2rel n THR 11 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 175.07 172.52 2rel h LYS 12 N 0.00 0.32 0.00 1.09 3.11 -1.97 -3.42 116.57 115.69 2rel h LYS 12 Ca 0.00 -0.54 0.00 0.00 -2.81 0.00 0.00 60.65 57.30 2rel h LYS 12 Cb 0.75 0.20 0.00 0.00 -1.00 0.00 0.00 32.23 32.19 2rel h LYS 12 CO 0.00 1.26 0.00 -0.35 -2.81 0.00 0.00 179.45 177.55 2rel n PRO 13 N -4.02 0.00 -2.56 1.90 -0.04 -1.26 -4.87 135.00 124.15 2rel n PRO 13 Ca -0.17 0.20 -0.34 0.00 -0.04 0.00 0.00 63.50 63.14 2rel n PRO 13 Cb 0.88 -0.77 -0.04 0.00 -0.04 0.00 0.00 33.50 33.53 2rel n PRO 13 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2rel s GLY 14 N -1.24 2.55 -0.29 0.55 0.00 -1.26 -4.96 107.32 102.67 2rel s GLY 14 Ca 0.00 0.62 -0.03 0.00 0.00 0.00 0.00 44.72 45.31 2rel s GLY 14 CO 0.00 0.95 0.00 -0.56 0.00 0.00 0.00 173.10 173.50 2rel s SER 15 N -1.90 4.80 0.35 1.64 0.01 -1.26 -4.24 113.70 113.10 2rel s SER 15 Ca 0.65 -1.10 -0.26 0.00 1.31 0.00 0.00 55.95 56.55 2rel s SER 15 Cb -0.17 -1.73 -0.09 0.00 0.21 0.00 0.00 66.02 64.24 2rel s SER 15 CO 0.21 -0.23 1.05 0.00 0.41 0.00 0.00 173.24 174.69 2rel n PRO 17 N 0.38 -0.80 -4.39 0.00 -0.04 -1.26 -5.02 135.00 123.87 2rel n PRO 17 Ca 0.03 -1.15 -0.26 0.00 -0.04 0.00 0.00 63.50 62.08 2rel n PRO 17 Cb 0.48 -0.78 -0.11 0.00 -0.04 0.00 0.00 33.50 33.06 2rel n PRO 17 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2rel s ILE 18 N -2.61 2.59 0.36 0.52 -1.09 -1.26 -4.82 121.20 114.88 2rel s ILE 18 Ca 0.42 -1.98 0.09 0.00 -2.23 0.00 0.00 60.65 56.95 2rel s ILE 18 Cb -0.01 -2.27 -0.06 0.00 -1.58 0.00 0.00 42.46 38.54 2rel s ILE 18 CO 0.30 -0.15 -0.01 -0.63 -1.23 0.00 0.00 174.94 173.21 2rel s ILE 19 N -1.78 2.37 0.00 2.92 -1.09 -1.26 -5.05 121.20 117.30 2rel s ILE 19 Ca 0.23 -2.04 0.00 0.00 -2.23 0.00 0.00 60.65 56.61 2rel s ILE 19 Cb -0.08 -2.79 0.00 0.00 -1.58 0.00 0.00 42.46 38.01 2rel s ILE 19 CO 0.12 -0.15 0.79 -0.11 -1.23 0.00 0.00 174.94 174.35 2rel n LEU 20 N -0.92 0.00 0.00 2.97 0.00 -1.26 -4.91 117.00 112.88 2rel n LEU 20 Ca -0.04 0.79 0.00 0.00 0.00 0.00 0.00 56.01 56.75 2rel n LEU 20 Cb 0.64 -0.29 0.00 0.00 0.00 0.00 0.00 43.42 43.77 2rel n LEU 20 CO 0.44 -0.29 0.00 -0.38 0.00 0.00 0.00 177.39 177.17 2rel n ILE 21 N -1.90 0.00 -3.09 1.96 5.41 -1.26 -5.09 119.36 115.38 2rel n ILE 21 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2rel n ILE 21 Cb 0.00 0.00 -0.00 0.00 -0.71 0.00 0.00 39.64 38.93 2rel n ILE 21 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 2rel s ARG 22 N -0.24 0.81 0.19 0.38 3.52 -1.25 -4.53 118.95 117.82 2rel s ARG 22 Ca 0.00 -0.38 0.08 0.00 -0.13 0.00 0.00 55.73 55.29 2rel s ARG 22 Cb 0.00 0.07 0.62 0.00 -1.56 0.00 0.00 34.95 34.07 2rel s ARG 22 CO 0.00 -1.13 0.84 0.00 -0.81 0.00 0.00 175.30 174.20 2rel n ALA 24 N -2.86 0.00 0.00 0.00 0.00 -1.26 -4.83 120.51 111.56 2rel n ALA 24 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2rel n ALA 24 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 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 0.00 0.00 0.00 0.00 2.81 -1.26 -4.46 117.12 114.21 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 0.00 -4.17 4.03 7.94 -1.26 -5.09 117.00 118.45 2rel n LEU 26 Ca 0.00 0.00 -0.40 0.00 -1.11 0.00 0.00 56.01 54.50 2rel n LEU 26 Cb 0.00 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 43.87 2rel n LEU 26 CO 0.00 0.00 0.10 0.20 -1.11 0.00 0.00 177.39 176.58 2rel s ASN 27 N 1.00 5.67 0.44 1.96 0.02 -1.26 -5.06 114.94 117.70 2rel s ASN 27 Ca 0.00 -2.58 -0.23 0.00 -1.02 0.00 0.00 52.86 49.03 2rel s ASN 27 Cb 0.00 -1.96 -0.08 0.00 0.02 0.00 0.00 41.25 39.23 2rel s ASN 27 CO 0.00 -0.49 1.10 -2.16 0.02 0.00 0.00 177.10 175.57 2rel s PRO 28 N 0.34 3.93 0.00 -0.60 0.04 -1.26 -5.06 135.00 132.40 2rel s PRO 28 Ca 0.14 1.60 0.00 0.00 0.04 0.00 0.00 61.00 62.79 2rel s PRO 28 Cb -0.19 -2.42 0.00 0.00 0.04 0.00 0.00 34.50 31.93 2rel s PRO 28 CO -0.04 -0.36 0.00 -0.35 0.04 0.00 0.00 177.00 176.28 2rel n PRO 29 N -0.39 1.01 -4.01 0.56 -0.04 -1.26 -4.70 135.00 126.17 2rel n PRO 29 Ca 0.07 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.38 2rel n PRO 29 Cb 0.49 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.81 2rel n PRO 29 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2rel s ASN 30 N -1.03 0.32 -0.07 3.54 0.01 -1.26 -3.76 114.94 112.69 2rel s ASN 30 Ca 0.00 -0.05 -0.07 0.00 -0.71 0.00 0.00 52.86 52.03 2rel s ASN 30 Cb 0.00 -0.05 -0.28 0.00 0.41 0.00 0.00 41.25 41.33 2rel s ASN 30 CO 0.00 0.02 0.59 0.03 -1.51 0.00 0.00 177.10 176.23 2rel h ARG 31 N 6.17 0.32 -3.35 -0.60 2.47 -1.69 -3.48 114.38 114.20 2rel h ARG 31 Ca -0.27 -0.54 -0.02 0.00 -1.26 0.00 0.00 59.98 57.89 2rel h ARG 31 Cb 1.20 0.20 -0.06 0.00 -1.65 0.00 0.00 29.97 29.66 2rel h ARG 31 CO 0.50 1.22 0.06 0.00 0.56 0.00 0.00 179.97 182.32 2rel n LEU 33 N -0.45 -1.20 0.00 0.00 -0.00 -1.26 -4.65 117.00 109.44 2rel n LEU 33 Ca -0.03 -2.60 0.00 0.00 -0.00 0.00 0.00 56.01 53.37 2rel n LEU 33 Cb 0.60 0.10 0.00 0.00 -0.00 0.00 0.00 43.42 44.12 2rel n LEU 33 CO 0.21 1.58 0.00 2.29 -0.00 0.00 0.00 177.39 181.46 2rel n LYS 34 N -0.90 0.00 0.00 1.47 -0.00 -1.26 -4.90 118.16 112.56 2rel n LYS 34 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.11 2rel n LYS 34 Cb 0.78 -0.58 0.00 0.00 -0.00 0.00 0.00 35.03 35.23 2rel n LYS 34 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2rel n ASP 35 N 0.00 0.00 -3.17 -5.58 9.92 -1.26 -5.04 116.55 111.42 2rel n ASP 35 Ca 0.00 0.00 0.03 0.00 -0.53 0.00 0.00 54.79 54.29 2rel n ASP 35 Cb 0.00 0.00 -0.00 0.00 -0.64 0.00 0.00 41.12 40.48 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 0.16 -0.98 0.00 -3.53 2.01 -1.26 -5.15 115.64 106.89 2rel s THR 36 Ca 0.00 0.00 -0.00 0.00 0.31 0.00 0.00 61.69 62.00 2rel s THR 36 Cb 0.00 -0.68 0.00 0.00 0.01 0.00 0.00 72.50 71.83 2rel s THR 36 CO 0.00 0.00 0.02 0.47 -0.69 0.00 0.00 174.62 174.42 2rel n ASP 37 N 5.10 -0.03 -1.28 3.53 8.00 -1.26 -5.10 116.55 125.52 2rel n ASP 37 Ca 0.07 -1.01 0.17 0.00 0.71 0.00 0.00 54.79 54.73 2rel n ASP 37 Cb 0.55 0.04 -0.06 0.00 -0.02 0.00 0.00 41.12 41.64 2rel n ASP 37 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2rel n PRO 39 N -4.04 -0.88 0.03 0.00 -0.04 -1.26 -5.01 135.00 123.80 2rel n PRO 39 Ca -0.02 -0.20 -0.22 0.00 -0.04 0.00 0.00 63.50 63.01 2rel n PRO 39 Cb 0.59 -0.17 -0.14 0.00 -0.04 0.00 0.00 33.50 33.74 2rel n PRO 39 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2rel h GLY 40 N -0.56 0.36 -6.71 0.55 0.00 -1.97 -3.46 103.07 91.27 2rel h GLY 40 Ca -0.05 -0.91 -0.84 0.00 0.00 0.00 0.00 47.33 45.54 2rel h GLY 40 CO 0.03 0.80 0.65 0.29 0.00 0.00 0.00 176.54 178.30 2rel n ILE 41 N -3.67 0.06 -0.14 2.60 -5.35 -1.26 -4.39 119.36 107.21 2rel n ILE 41 Ca -0.27 -0.01 0.00 0.00 -0.27 0.00 0.00 62.75 62.20 2rel n ILE 41 Cb 1.01 -0.58 0.00 0.00 -1.74 0.00 0.00 39.64 38.33 2rel n ILE 41 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2rel n LYS 42 N 3.91 0.00 0.00 6.28 4.76 -1.26 -4.62 118.16 127.23 2rel n LYS 42 Ca 0.28 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.72 2rel n LYS 42 Cb -0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2rel n LYS 42 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2rel n LYS 43 N 14.00 0.00 -4.28 1.97 4.76 -1.17 -5.00 118.16 128.44 2rel n LYS 43 Ca 0.00 0.00 -0.19 0.00 -2.87 0.00 0.00 58.31 55.25 2rel n LYS 43 Cb 0.00 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.04 2rel n LYS 43 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2rel s GLU 46 N -2.44 3.85 -0.02 0.00 2.12 -1.26 -3.06 118.70 117.90 2rel s GLU 46 Ca 0.11 0.60 0.03 0.00 0.36 0.00 0.00 54.97 56.07 2rel s GLU 46 Cb 0.01 -2.35 0.04 0.00 0.26 0.00 0.00 34.13 32.09 2rel s GLU 46 CO 0.08 -0.05 0.83 0.41 -0.54 0.00 0.00 175.26 175.99 2rel n GLY 47 N -1.20 0.26 2.29 -1.50 0.00 -1.26 -4.81 105.19 98.96 2rel n GLY 47 Ca 0.03 -0.16 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 2rel n GLY 47 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2rel n SER 48 N -0.30 -3.27 -0.90 1.61 3.41 -1.26 -4.46 113.62 108.45 2rel n SER 48 Ca 0.02 0.12 -0.06 0.00 -0.26 0.00 0.00 58.87 58.70 2rel n SER 48 Cb 0.53 -2.52 -0.06 0.00 -0.26 0.00 0.00 64.21 61.91 2rel n SER 48 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rel n GLY 50 N 0.00 2.50 3.38 0.00 0.00 -1.26 -4.49 105.19 105.32 2rel n GLY 50 Ca -0.23 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 2rel n GLY 50 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2rel n MET 51 N 0.00 0.28 -0.61 1.61 0.00 -1.25 -4.37 117.12 112.79 2rel n MET 51 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 57.70 57.80 2rel n MET 51 Cb 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 33.22 31.96 2rel n MET 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2rel n ALA 52 N -0.89 0.00 -2.65 3.04 0.00 -1.17 -1.90 120.51 116.93 2rel n ALA 52 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.16 2rel n ALA 52 Cb 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.77 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 1.84 2.48 0.38 0.00 0.08 -1.11 -4.86 117.98 116.79 2rel s PHE 54 Ca 0.26 -0.28 0.01 0.00 0.12 0.00 0.00 56.93 57.03 2rel s PHE 54 Cb -0.16 -1.17 -0.02 0.00 -0.57 0.00 0.00 43.02 41.10 2rel s PHE 54 CO 0.10 0.57 0.59 0.54 -0.10 0.00 0.00 175.22 176.92 2rel s VAL 55 N -1.96 4.65 0.00 -0.44 0.11 -1.26 -3.04 120.40 118.46 2rel s VAL 55 Ca 0.26 -0.50 0.00 0.00 -2.93 0.00 0.00 61.98 58.81 2rel s VAL 55 Cb -0.07 -3.70 0.00 0.00 -1.53 0.00 0.00 36.38 31.08 2rel s VAL 55 CO 0.14 -0.46 0.00 -0.81 -3.33 0.00 0.00 175.10 170.64 2rel n PRO 56 N -1.89 0.29 0.00 1.54 -0.04 -1.26 -4.42 135.00 129.23 2rel n PRO 56 Ca -0.02 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.57 2rel n PRO 56 Cb 0.57 0.00 0.40 0.00 -0.04 0.00 0.00 33.50 34.43 2rel n PRO 56 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46