#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ywi n MET 16 N 0.00 -3.03 -4.23 -1.46 2.81 -1.26 -4.78 117.12 105.17 1ywi n MET 16 Ca 0.00 0.70 -0.17 0.00 -1.81 0.00 0.00 57.70 56.42 1ywi n MET 16 Cb 0.00 -5.11 -0.11 0.00 -0.71 0.00 0.00 33.22 27.29 1ywi n MET 16 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 1ywi s TRP 17 N -3.31 1.33 -0.00 2.03 0.52 -1.26 -1.42 118.94 116.83 1ywi s TRP 17 Ca 0.25 -0.58 0.05 0.00 0.02 0.00 0.00 56.10 55.83 1ywi s TRP 17 Cb -0.03 -0.70 -0.01 0.00 -1.15 0.00 0.00 33.47 31.57 1ywi s TRP 17 CO 0.60 0.12 -0.14 0.95 0.02 0.00 0.00 176.95 178.49 1ywi s THR 18 N -2.25 1.13 -0.19 2.01 -4.23 -0.38 -4.93 115.64 106.79 1ywi s THR 18 Ca 0.09 -0.68 -0.07 0.00 -1.18 0.00 0.00 61.69 59.84 1ywi s THR 18 Cb -0.04 -0.96 -0.04 0.00 1.34 0.00 0.00 72.50 72.80 1ywi s THR 18 CO 0.02 0.26 0.05 -0.70 -0.54 0.00 0.00 174.62 173.72 1ywi s GLU 19 N -0.49 3.89 0.26 3.99 2.12 -1.26 -1.62 118.70 125.60 1ywi s GLU 19 Ca 0.05 -0.39 -0.06 0.00 0.36 0.00 0.00 54.97 54.93 1ywi s GLU 19 Cb -0.06 -3.21 -0.01 0.00 0.26 0.00 0.00 34.13 31.11 1ywi s GLU 19 CO -0.00 0.18 0.38 -1.01 -0.54 0.00 0.00 175.26 174.28 1ywi s HIS 20 N 0.60 0.79 -0.08 5.30 3.76 -0.73 -5.03 115.29 119.91 1ywi s HIS 20 Ca 0.03 -1.07 0.04 0.00 -0.15 0.00 0.00 55.06 53.90 1ywi s HIS 20 Cb -0.13 -0.10 0.00 0.00 1.11 0.00 0.00 32.58 33.47 1ywi s HIS 20 CO 0.01 -0.94 -0.20 -1.59 -0.85 0.00 0.00 174.74 171.18 1ywi s LYS 21 N -3.77 2.50 0.59 1.40 -2.85 -1.26 -0.92 119.74 115.42 1ywi s LYS 21 Ca 0.29 -0.71 -0.20 0.00 -1.00 0.00 0.00 55.97 54.35 1ywi s LYS 21 Cb 0.01 -1.95 -0.03 0.00 -2.06 0.00 0.00 37.83 33.80 1ywi s LYS 21 CO 0.13 0.14 1.33 0.45 0.10 0.00 0.00 175.35 177.51 1ywi s SER 22 N 0.40 5.01 0.16 0.03 0.15 0.31 -4.79 113.70 114.97 1ywi s SER 22 Ca -0.16 2.70 -0.24 0.00 0.70 0.00 0.00 55.95 58.95 1ywi s SER 22 Cb -0.17 -2.63 0.03 0.00 -1.71 0.00 0.00 66.02 61.55 1ywi s SER 22 CO 0.07 -1.74 1.60 -0.65 1.20 0.00 0.00 173.24 173.71 1ywi h PRO 23 N 1.09 -0.29 -0.35 5.44 0.11 -2.00 0.25 132.00 136.25 1ywi h PRO 23 Ca -0.51 0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.72 1ywi h PRO 23 Cb 1.31 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.48 1ywi h PRO 23 CO 0.56 -0.19 0.57 0.22 -0.21 0.00 0.00 178.00 178.95 1ywi h ASP 24 N -0.30 0.00 0.00 -2.05 3.58 -2.07 -3.43 116.42 112.15 1ywi h ASP 24 Ca 0.15 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.60 1ywi h ASP 24 Cb 0.55 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.60 1ywi h ASP 24 CO -0.50 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.47 1ywi n GLY 25 N -1.45 0.97 3.69 -0.78 0.00 0.82 -5.15 105.19 103.29 1ywi n GLY 25 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 1ywi n GLY 25 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ywi s ARG 26 N 0.07 2.21 -0.44 1.61 3.00 -0.91 -4.89 118.95 119.60 1ywi s ARG 26 Ca 0.00 -1.69 -0.10 0.00 0.00 0.00 0.00 55.73 53.94 1ywi s ARG 26 Cb 0.00 -2.03 0.09 0.00 0.00 0.00 0.00 34.95 33.01 1ywi s ARG 26 CO 0.00 0.08 0.30 0.99 0.00 0.00 0.00 175.30 176.67 1ywi s THR 27 N -2.50 4.39 0.32 0.02 2.01 -1.26 0.12 115.64 118.74 1ywi s THR 27 Ca 0.37 -1.41 0.09 0.00 0.31 0.00 0.00 61.69 61.04 1ywi s THR 27 Cb -0.00 -3.71 -0.05 0.00 0.01 0.00 0.00 72.50 68.75 1ywi s THR 27 CO 0.21 -0.57 0.07 -0.72 -0.69 0.00 0.00 174.62 172.92 1ywi s TYR 28 N 1.45 2.66 0.13 4.92 1.13 -0.10 -4.21 117.35 123.33 1ywi s TYR 28 Ca 0.04 -0.36 0.06 0.00 -1.41 0.00 0.00 57.07 55.40 1ywi s TYR 28 Cb -0.24 -1.49 -0.04 0.00 -1.10 0.00 0.00 41.96 39.09 1ywi s TYR 28 CO 0.02 0.44 -0.14 0.71 -2.51 0.00 0.00 175.55 174.08 1ywi s TYR 29 N -2.43 1.40 -0.12 -3.49 1.51 -0.84 -1.77 117.35 111.61 1ywi s TYR 29 Ca 0.35 -0.57 0.00 0.00 -1.01 0.00 0.00 57.07 55.84 1ywi s TYR 29 Cb -0.03 -0.72 0.02 0.00 -0.11 0.00 0.00 41.96 41.12 1ywi s TYR 29 CO 0.21 0.15 -0.12 -0.47 -1.11 0.00 0.00 175.55 174.21 1ywi s TYR 30 N -2.28 1.80 -0.31 2.71 6.14 -0.64 -0.67 117.35 124.10 1ywi s TYR 30 Ca 0.10 -0.91 -0.25 0.00 0.64 0.00 0.00 57.07 56.65 1ywi s TYR 30 Cb -0.04 -1.37 0.01 0.00 0.42 0.00 0.00 41.96 40.97 1ywi s TYR 30 CO 0.03 -0.54 0.85 1.21 0.64 0.00 0.00 175.55 177.74 1ywi s ASN 31 N 1.40 6.71 0.00 4.32 2.47 0.41 -1.26 114.94 129.00 1ywi s ASN 31 Ca 0.01 0.72 0.28 0.00 0.42 0.00 0.00 52.86 54.29 1ywi s ASN 31 Cb -0.13 -2.44 1.16 0.00 -1.45 0.00 0.00 41.25 38.39 1ywi s ASN 31 CO -0.07 -0.68 1.81 1.07 -3.72 0.00 0.00 177.10 175.51 1ywi n THR 32 N 5.63 0.00 -0.09 -5.21 5.66 -0.51 -1.03 114.28 118.73 1ywi n THR 32 Ca 0.05 -0.10 -0.18 0.00 -3.05 0.00 0.00 64.05 60.78 1ywi n THR 32 Cb 0.48 0.06 -0.12 0.00 -1.55 0.00 0.00 70.33 69.20 1ywi n THR 32 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 1ywi h GLU 33 N 0.91 0.00 0.00 1.09 4.57 -1.86 -3.37 114.58 115.92 1ywi h GLU 33 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1ywi h GLU 33 Cb 0.38 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 1ywi h GLU 33 CO 0.00 0.97 -0.99 2.41 -1.18 0.00 0.00 179.01 180.23 1ywi n THR 34 N -4.52 0.41 -2.29 0.32 -1.04 -1.25 -5.01 114.28 100.90 1ywi n THR 34 Ca -0.21 -0.41 -0.03 0.00 -2.04 0.00 0.00 64.05 61.36 1ywi n THR 34 Cb 0.57 -0.14 0.02 0.00 -1.82 0.00 0.00 70.33 68.96 1ywi n THR 34 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1ywi n LYS 35 N -2.35 -0.84 -3.65 -2.82 4.76 -0.20 -5.07 118.16 107.99 1ywi n LYS 35 Ca 0.01 0.72 -0.09 0.00 -2.87 0.00 0.00 58.31 56.07 1ywi n LYS 35 Cb 0.50 -3.56 -0.02 0.00 -1.84 0.00 0.00 35.03 30.10 1ywi n LYS 35 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 1ywi s GLN 36 N -3.31 1.54 0.03 1.97 -2.07 -0.71 -5.01 119.66 112.10 1ywi s GLN 36 Ca 0.10 -0.74 0.01 0.00 -1.82 0.00 0.00 55.36 52.92 1ywi s GLN 36 Cb -0.01 0.60 -0.04 0.00 -1.09 0.00 0.00 33.01 32.47 1ywi s GLN 36 CO 0.36 -0.69 0.09 -1.12 -1.32 0.00 0.00 175.29 172.60 1ywi s SER 37 N -2.84 5.65 0.05 12.60 0.01 -1.26 -0.44 113.70 127.47 1ywi s SER 37 Ca 0.06 0.09 -0.04 0.00 1.31 0.00 0.00 55.95 57.37 1ywi s SER 37 Cb -0.04 -1.59 -0.02 0.00 0.21 0.00 0.00 66.02 64.58 1ywi s SER 37 CO -0.03 0.23 0.05 0.28 0.41 0.00 0.00 173.24 174.18 1ywi s THR 38 N -1.29 0.16 0.21 1.44 -1.32 0.16 -4.95 115.64 110.05 1ywi s THR 38 Ca 0.26 -1.36 0.05 0.00 -1.21 0.00 0.00 61.69 59.44 1ywi s THR 38 Cb -0.12 -1.14 -0.03 0.00 -1.51 0.00 0.00 72.50 69.69 1ywi s THR 38 CO 0.18 -0.75 0.23 0.26 -2.21 0.00 0.00 174.62 172.33 1ywi s TRP 39 N -3.20 3.26 0.48 9.09 0.52 -1.26 -1.98 118.94 125.85 1ywi s TRP 39 Ca 0.00 -0.03 0.00 0.00 0.02 0.00 0.00 56.10 56.09 1ywi s TRP 39 Cb 0.02 -1.51 0.00 0.00 -1.15 0.00 0.00 33.47 30.83 1ywi s TRP 39 CO -0.07 0.50 0.00 -1.91 0.02 0.00 0.00 176.95 175.49 1ywi n GLU 40 N -0.92 -4.27 -1.69 4.98 2.13 -1.26 -4.79 120.64 114.81 1ywi n GLU 40 Ca -0.08 3.18 -0.44 0.00 0.66 0.00 0.00 57.16 60.48 1ywi n GLU 40 Cb 0.56 -3.57 -0.03 0.00 0.27 0.00 0.00 31.44 28.67 1ywi n GLU 40 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1ywi n LYS 41 N -0.79 2.60 0.00 5.31 2.85 -1.26 -4.81 118.16 122.06 1ywi n LYS 41 Ca 0.00 0.94 0.15 0.00 -1.05 0.00 0.00 58.31 58.35 1ywi n LYS 41 Cb 0.00 -2.79 0.90 0.00 -0.65 0.00 0.00 35.03 32.49 1ywi n LYS 41 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00