#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1orl s SER 2 N 0.00 7.31 -0.10 -5.58 0.01 -1.26 -2.37 113.70 111.72 1orl s SER 2 Ca 0.00 1.84 -0.04 0.00 1.31 0.00 0.00 55.95 59.06 1orl s SER 2 Cb 0.00 -2.58 0.05 0.00 0.21 0.00 0.00 66.02 63.70 1orl s SER 2 CO 0.00 -0.09 0.19 0.00 0.41 0.00 0.00 173.24 173.75 1orl h PRO 5 N 3.13 1.02 -2.96 0.00 0.13 -1.81 -1.88 132.00 129.62 1orl h PRO 5 Ca -0.46 -0.23 0.03 0.00 -0.87 0.00 0.00 66.00 64.47 1orl h PRO 5 Cb 1.21 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 1orl h PRO 5 CO 0.50 0.90 0.27 0.54 -0.23 0.00 0.00 178.00 179.98 1orl s ASN 6 N -6.50 -0.11 0.35 1.44 2.20 -1.26 -4.38 114.94 106.68 1orl s ASN 6 Ca -0.11 -0.88 0.03 0.00 -0.94 0.00 0.00 52.86 50.96 1orl s ASN 6 Cb 0.15 0.78 0.65 0.00 -2.00 0.00 0.00 41.25 40.83 1orl s ASN 6 CO 0.83 -1.50 1.97 0.74 -2.94 0.00 0.00 177.10 176.19 1orl h THR 7 N 2.00 1.17 -0.65 0.54 2.02 -1.99 -1.88 112.91 114.11 1orl h THR 7 Ca -0.26 -0.45 -0.08 0.00 0.77 0.00 0.00 66.41 66.39 1orl h THR 7 Cb 1.25 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 68.15 1orl h THR 7 CO 0.33 0.19 0.11 0.74 0.37 0.00 0.00 175.52 177.25 1orl h THR 8 N 0.70 1.26 -0.07 3.16 2.02 -1.98 0.19 112.91 118.18 1orl h THR 8 Ca 0.18 -1.02 0.03 0.00 0.77 0.00 0.00 66.41 66.37 1orl h THR 8 Cb 0.06 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 1orl h THR 8 CO -0.03 0.38 -0.11 1.23 0.37 0.00 0.00 175.52 177.37 1orl h GLY 9 N 1.05 -0.06 0.59 2.16 0.00 -1.62 -0.72 103.07 104.47 1orl h GLY 9 Ca 0.20 0.13 0.06 0.00 0.00 0.00 0.00 47.33 47.72 1orl h GLY 9 CO 0.01 -0.12 0.13 3.21 0.00 0.00 0.00 176.54 179.78 1orl h ARG 10 N -0.15 0.28 -0.08 4.80 2.47 -1.13 -0.90 114.38 119.68 1orl h ARG 10 Ca 0.07 -0.02 0.03 0.00 -1.26 0.00 0.00 59.98 58.80 1orl h ARG 10 Cb 0.24 -0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 28.46 1orl h ARG 10 CO -0.16 0.19 -0.13 -0.97 0.56 0.00 0.00 179.97 179.46 1orl h ASN 11 N 0.29 -0.38 -0.19 7.04 -1.24 -0.53 0.09 115.58 120.66 1orl h ASN 11 Ca 0.20 0.07 -0.02 0.00 0.71 0.00 0.00 56.30 57.26 1orl h ASN 11 Cb 0.20 0.18 -0.01 0.00 0.73 0.00 0.00 38.32 39.42 1orl h ASN 11 CO -0.22 -0.17 0.04 0.40 -1.29 0.00 0.00 177.43 176.19 1orl h ILE 12 N -0.17 1.21 -0.18 2.57 2.04 -0.95 -0.95 117.51 121.07 1orl h ILE 12 Ca 0.07 -0.68 0.05 0.00 1.00 0.00 0.00 64.86 65.31 1orl h ILE 12 Cb 0.27 1.30 -0.06 0.00 -0.74 0.00 0.00 36.82 37.60 1orl h ILE 12 CO -0.18 0.21 -0.25 0.22 0.00 0.00 0.00 178.15 178.15 1orl h TYR 13 N 0.11 -0.66 -0.52 1.37 3.20 -1.00 -0.59 116.97 118.87 1orl h TYR 13 Ca 0.06 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.96 1orl h TYR 13 Cb 0.28 0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.85 1orl h TYR 13 CO 0.01 -0.33 0.32 -0.91 -1.64 0.00 0.00 178.16 175.62 1orl h ASN 14 N -0.29 0.62 -0.30 -2.11 2.35 -0.88 -0.39 115.58 114.59 1orl h ASN 14 Ca 0.12 -0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1orl h ASN 14 Cb 0.47 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 1orl h ASN 14 CO -0.35 0.49 0.17 0.74 -1.65 0.00 0.00 177.43 176.83 1orl h THR 15 N 0.71 1.12 -0.59 2.81 2.02 -0.80 0.27 112.91 118.44 1orl h THR 15 Ca 0.19 -0.29 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 1orl h THR 15 Cb -0.03 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 1orl h THR 15 CO -0.04 0.12 0.32 0.00 0.37 0.00 0.00 175.52 176.29 1orl h ARG 17 N 0.81 0.98 -0.56 0.00 2.47 -0.84 -0.61 114.38 116.63 1orl h ARG 17 Ca 0.21 -0.09 -0.03 0.00 -1.26 0.00 0.00 59.98 58.80 1orl h ARG 17 Cb 0.06 -0.20 -0.02 0.00 -1.65 0.00 0.00 29.97 28.15 1orl h ARG 17 CO -0.03 0.70 0.23 0.35 0.56 0.00 0.00 179.97 181.78 1orl h PHE 18 N 0.98 0.85 -0.41 3.04 3.04 -0.50 -2.66 116.94 121.28 1orl h PHE 18 Ca 0.26 -0.06 -0.00 0.00 3.98 0.00 0.00 57.97 62.15 1orl h PHE 18 Cb -0.02 -0.26 -0.02 0.00 2.56 0.00 0.00 35.95 38.22 1orl h PHE 18 CO -0.01 0.68 0.26 0.00 -2.02 0.00 0.00 178.31 177.22 1orl h ALA 19 N 1.08 0.52 0.00 2.41 0.00 -0.96 -3.47 119.26 118.83 1orl h ALA 19 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1orl h ALA 19 Cb 0.19 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1orl h ALA 19 CO -0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 1orl n GLY 20 N -1.13 1.21 3.83 0.00 0.00 -0.37 -5.10 105.19 103.63 1orl n GLY 20 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 1orl n GLY 20 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1orl s GLY 21 N -1.21 2.28 0.67 -0.02 0.00 -0.41 -5.00 107.32 103.64 1orl s GLY 21 Ca 0.00 0.27 -0.17 0.00 0.00 0.00 0.00 44.72 44.82 1orl s GLY 21 CO 0.00 0.53 1.26 -0.56 0.00 0.00 0.00 173.10 174.34 1orl s SER 22 N -2.45 4.48 0.10 1.64 0.01 -1.26 -4.45 113.70 111.77 1orl s SER 22 Ca 0.60 2.53 -0.31 0.00 1.31 0.00 0.00 55.95 60.07 1orl s SER 22 Cb -0.09 -2.61 -0.12 0.00 0.21 0.00 0.00 66.02 63.40 1orl s SER 22 CO 0.19 -2.08 1.60 0.03 0.41 0.00 0.00 173.24 173.38 1orl h ARG 23 N 0.28 -0.70 -0.51 12.44 3.08 -1.98 -0.26 114.38 126.73 1orl h ARG 23 Ca -0.50 0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.55 1orl h ARG 23 Cb 1.32 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 31.51 1orl h ARG 23 CO 0.52 -0.47 0.11 0.93 -1.07 0.00 0.00 179.97 179.99 1orl h GLU 24 N -0.73 0.78 0.05 0.04 4.39 -1.98 0.06 114.58 117.20 1orl h GLU 24 Ca -0.01 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.53 1orl h GLU 24 Cb 0.68 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 1orl h GLU 24 CO -0.13 0.72 -0.02 -0.09 -1.16 0.00 0.00 179.01 178.32 1orl h ARG 25 N 0.75 -0.07 -0.95 2.33 2.43 -1.85 -0.26 114.38 116.77 1orl h ARG 25 Ca 0.17 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1orl h ARG 25 Cb 0.30 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.82 1orl h ARG 25 CO 0.00 0.03 0.59 0.00 -1.51 0.00 0.00 179.97 179.08 1orl h ALA 27 N 1.32 -0.71 -0.24 0.00 0.00 -0.75 -1.09 119.26 117.78 1orl h ALA 27 Ca 0.34 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 55.13 1orl h ALA 27 Cb -0.08 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 1orl h ALA 27 CO -0.07 -0.86 -0.12 -0.22 0.00 0.00 0.00 179.25 177.98 1orl h LYS 28 N -0.81 -0.09 -0.57 0.00 3.64 -0.93 0.23 116.57 118.04 1orl h LYS 28 Ca -0.07 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.42 1orl h LYS 28 Cb 0.59 0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 32.34 1orl h LYS 28 CO 0.12 -0.06 0.08 1.25 -2.27 0.00 0.00 179.45 178.57 1orl h LEU 29 N -0.10 -0.07 -0.32 5.20 5.85 -1.05 -2.17 115.31 122.65 1orl h LEU 29 Ca 0.13 0.12 -0.12 0.00 0.84 0.00 0.00 57.88 58.85 1orl h LEU 29 Cb 0.29 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 1orl h LEU 29 CO -0.30 -0.02 -0.55 0.77 -0.34 0.00 0.00 178.44 178.00 1orl h SER 30 N 0.21 0.00 0.00 1.25 4.64 -0.58 -3.48 113.55 115.59 1orl h SER 30 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1orl h SER 30 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1orl h SER 30 CO -0.41 0.55 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 1orl n GLY 31 N 0.90 0.98 3.98 -0.77 0.00 0.40 -4.61 105.19 106.08 1orl n GLY 31 Ca 0.01 -0.04 -0.20 0.00 0.00 0.00 0.00 46.02 45.79 1orl n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orl s LYS 33 N -4.32 2.21 -0.02 0.00 -2.85 -0.15 -3.34 119.74 111.27 1orl s LYS 33 Ca 0.47 -1.91 0.01 0.00 -1.00 0.00 0.00 55.97 53.55 1orl s LYS 33 Cb -0.10 -1.94 0.02 0.00 -2.06 0.00 0.00 37.83 33.75 1orl s LYS 33 CO 0.33 -0.16 -0.02 0.42 0.10 0.00 0.00 175.35 176.02 1orl s ILE 34 N -2.64 0.27 0.02 3.79 1.01 -1.26 -1.15 121.20 121.24 1orl s ILE 34 Ca 0.38 -0.03 -0.05 0.00 0.00 0.00 0.00 60.65 60.95 1orl s ILE 34 Cb 0.04 -0.30 -0.01 0.00 0.01 0.00 0.00 42.46 42.19 1orl s ILE 34 CO 0.21 0.13 0.07 0.27 0.00 0.00 0.00 174.94 175.62 1orl s ILE 35 N 0.60 0.11 -1.02 2.92 -4.36 -1.00 -5.00 121.20 113.45 1orl s ILE 35 Ca -0.06 -0.94 0.10 0.00 -0.26 0.00 0.00 60.65 59.49 1orl s ILE 35 Cb -0.09 -0.60 0.46 0.00 1.25 0.00 0.00 42.46 43.48 1orl s ILE 35 CO -0.01 -0.52 1.28 -1.54 0.24 0.00 0.00 174.94 174.39 1orl n SER 36 N 1.19 3.39 0.17 4.36 3.41 -1.26 -0.13 113.62 124.75 1orl n SER 36 Ca -0.21 -2.38 0.08 0.00 -0.26 0.00 0.00 58.87 56.09 1orl n SER 36 Cb 0.57 -0.51 0.09 0.00 -0.26 0.00 0.00 64.21 64.10 1orl n SER 36 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1orl h ALA 37 N 3.41 0.83 0.00 7.33 0.00 -1.96 -3.47 119.26 125.39 1orl h ALA 37 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1orl h ALA 37 Cb 1.14 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1orl h ALA 37 CO 0.20 0.27 0.00 0.45 0.00 0.00 0.00 179.25 180.18 1orl n SER 38 N -3.11 0.00 -4.67 0.00 2.88 -1.26 -4.89 113.62 102.57 1orl n SER 38 Ca 0.02 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.22 1orl n SER 38 Cb 0.62 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.99 1orl n SER 38 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1orl s THR 39 N 0.00 5.03 0.12 2.46 2.01 -1.26 -4.80 115.64 119.20 1orl s THR 39 Ca 0.00 0.05 0.07 0.00 0.31 0.00 0.00 61.69 62.12 1orl s THR 39 Cb 0.00 -3.28 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 1orl s THR 39 CO 0.00 0.45 -0.06 0.00 -0.69 0.00 0.00 174.62 174.31 1orl s PRO 41 N -2.42 2.27 -1.07 0.00 0.04 -1.26 -4.89 135.00 127.67 1orl s PRO 41 Ca 0.24 1.16 -0.15 0.00 0.04 0.00 0.00 61.00 62.30 1orl s PRO 41 Cb -0.11 -1.90 -0.08 0.00 0.04 0.00 0.00 34.50 32.46 1orl s PRO 41 CO 0.16 -1.63 2.16 0.43 0.04 0.00 0.00 177.00 178.16 1orl n SER 42 N -3.52 4.18 0.00 6.66 7.64 -1.26 -2.70 113.62 124.62 1orl n SER 42 Ca 0.09 -2.61 0.00 0.00 1.01 0.00 0.00 58.87 57.36 1orl n SER 42 Cb 0.53 -1.28 0.00 0.00 -1.01 0.00 0.00 64.21 62.45 1orl n SER 42 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1orl n ASP 43 N 5.86 0.00 -3.71 6.43 9.92 -1.26 -4.97 116.55 128.82 1orl n ASP 43 Ca 0.52 0.00 -0.30 0.00 -0.53 0.00 0.00 54.79 54.48 1orl n ASP 43 Cb 0.31 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 40.71 1orl n ASP 43 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1orl n TYR 44 N -0.97 3.51 0.97 1.24 4.02 -1.10 -4.60 117.16 120.24 1orl n TYR 44 Ca 0.00 -4.07 0.13 0.00 -0.01 0.00 0.00 57.90 53.95 1orl n TYR 44 Cb 0.00 -0.72 0.58 0.00 -0.02 0.00 0.00 39.34 39.17 1orl n TYR 44 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1orl n PRO 45 N 1.42 0.09 0.00 -0.72 -0.04 -1.14 -4.28 135.00 130.34 1orl n PRO 45 Ca 0.25 0.05 0.12 0.00 -0.04 0.00 0.00 63.50 63.89 1orl n PRO 45 Cb 0.38 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.44 1orl n PRO 45 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09