#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 -1.09 -4.28 -1.46 2.81 -1.26 -4.75 117.12 107.10 1ywi n MET 16 Ca 0.00 0.48 -0.15 0.00 -1.81 0.00 0.00 57.70 56.21 1ywi n MET 16 Cb 0.00 -3.66 -0.10 0.00 -0.71 0.00 0.00 33.22 28.75 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 -3.18 1.38 0.04 2.03 0.52 -1.26 -1.46 118.94 117.01 1ywi s TRP 17 Ca 0.21 -0.90 0.04 0.00 0.02 0.00 0.00 56.10 55.48 1ywi s TRP 17 Cb -0.03 -0.77 -0.02 0.00 -1.15 0.00 0.00 33.47 31.50 1ywi s TRP 17 CO 0.37 -0.05 -0.13 0.95 0.02 0.00 0.00 176.95 178.11 1ywi s THR 18 N -3.45 1.02 -0.21 2.01 -4.23 0.14 -4.92 115.64 105.99 1ywi s THR 18 Ca 0.24 -0.95 -0.07 0.00 -1.18 0.00 0.00 61.69 59.72 1ywi s THR 18 Cb 0.05 -0.93 -0.04 0.00 1.34 0.00 0.00 72.50 72.92 1ywi s THR 18 CO 0.05 -0.02 0.07 -0.70 -0.54 0.00 0.00 174.62 173.48 1ywi s GLU 19 N -1.10 3.84 0.27 3.99 -6.30 -1.26 -1.66 118.70 116.48 1ywi s GLU 19 Ca 0.01 -0.40 -0.07 0.00 -2.50 0.00 0.00 54.97 52.00 1ywi s GLU 19 Cb -0.08 -3.27 -0.01 0.00 0.00 0.00 0.00 34.13 30.77 1ywi s GLU 19 CO 0.01 0.06 0.42 -1.01 0.02 0.00 0.00 175.26 174.76 1ywi s HIS 20 N 0.95 0.73 -0.12 5.30 3.76 -0.32 -5.01 115.29 120.57 1ywi s HIS 20 Ca 0.04 -1.03 -0.01 0.00 -0.15 0.00 0.00 55.06 53.91 1ywi s HIS 20 Cb -0.14 -0.03 0.03 0.00 1.11 0.00 0.00 32.58 33.55 1ywi s HIS 20 CO 0.03 -0.98 -0.04 0.15 -0.85 0.00 0.00 174.74 173.05 1ywi s LYS 21 N -3.72 1.19 0.37 1.40 1.02 -1.26 -0.75 119.74 117.99 1ywi s LYS 21 Ca 0.28 -0.22 -0.26 0.00 0.02 0.00 0.00 55.97 55.78 1ywi s LYS 21 Cb 0.01 -1.55 -0.12 0.00 -0.52 0.00 0.00 37.83 35.65 1ywi s LYS 21 CO 0.13 -0.34 1.14 0.45 -0.92 0.00 0.00 175.35 175.82 1ywi n SER 22 N 4.99 1.98 0.30 2.83 2.88 0.36 -4.81 113.62 122.15 1ywi n SER 22 Ca -0.11 1.13 0.20 0.00 -1.33 0.00 0.00 58.87 58.77 1ywi n SER 22 Cb 0.49 -1.41 1.06 0.00 -0.75 0.00 0.00 64.21 63.61 1ywi n SER 22 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1ywi h PRO 23 N 2.06 0.00 0.00 -1.46 0.11 -2.00 0.05 132.00 130.75 1ywi h PRO 23 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1ywi h PRO 23 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1ywi h PRO 23 CO 0.60 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.14 1ywi n ASP 24 N -2.94 0.00 -0.04 -2.05 8.00 -1.26 -4.82 116.55 113.43 1ywi n ASP 24 Ca -0.02 -1.29 0.00 0.00 0.71 0.00 0.00 54.79 54.18 1ywi n ASP 24 Cb 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 1ywi n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ywi n GLY 25 N 0.61 1.12 3.56 0.44 0.00 -0.05 -5.09 105.19 105.77 1ywi n GLY 25 Ca 0.12 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.58 1.85 -0.32 1.61 1.81 -0.86 -4.95 118.95 115.50 1ywi s ARG 26 Ca 0.00 -1.98 -0.05 0.00 -1.72 0.00 0.00 55.73 51.99 1ywi s ARG 26 Cb 0.00 -1.69 0.04 0.00 -0.45 0.00 0.00 34.95 32.85 1ywi s ARG 26 CO 0.00 0.10 0.07 0.99 -0.68 0.00 0.00 175.30 175.78 1ywi s THR 27 N -2.63 3.51 0.33 0.02 2.01 -1.26 0.13 115.64 117.74 1ywi s THR 27 Ca 0.33 -1.22 0.09 0.00 0.31 0.00 0.00 61.69 61.21 1ywi s THR 27 Cb 0.04 -2.99 -0.05 0.00 0.01 0.00 0.00 72.50 69.50 1ywi s THR 27 CO 0.17 -0.15 -0.02 -0.72 -0.69 0.00 0.00 174.62 173.21 1ywi s TYR 28 N 1.35 2.53 0.07 4.92 1.13 0.07 -3.58 117.35 123.85 1ywi s TYR 28 Ca -0.03 -0.41 0.04 0.00 -1.41 0.00 0.00 57.07 55.26 1ywi s TYR 28 Cb -0.20 -1.40 -0.03 0.00 -1.10 0.00 0.00 41.96 39.23 1ywi s TYR 28 CO 0.01 0.52 -0.11 0.71 -2.51 0.00 0.00 175.55 174.18 1ywi s TYR 29 N -2.50 0.99 -0.15 -3.49 1.51 -0.83 -1.18 117.35 111.71 1ywi s TYR 29 Ca 0.34 -0.55 -0.02 0.00 -1.01 0.00 0.00 57.07 55.82 1ywi s TYR 29 Cb -0.01 -0.56 -0.02 0.00 -0.11 0.00 0.00 41.96 41.26 1ywi s TYR 29 CO 0.19 -0.01 -0.07 -0.47 -1.11 0.00 0.00 175.55 174.08 1ywi s TYR 30 N -1.79 2.94 -0.50 2.71 6.14 -0.66 -1.35 117.35 124.84 1ywi s TYR 30 Ca -0.01 -0.45 -0.20 0.00 0.64 0.00 0.00 57.07 57.05 1ywi s TYR 30 Cb -0.07 -1.92 0.05 0.00 0.42 0.00 0.00 41.96 40.44 1ywi s TYR 30 CO 0.01 -0.12 0.65 1.21 0.64 0.00 0.00 175.55 177.94 1ywi s ASN 31 N 0.40 6.25 0.00 4.32 2.47 0.27 -0.69 114.94 127.96 1ywi s ASN 31 Ca -0.06 -0.74 0.16 0.00 0.42 0.00 0.00 52.86 52.63 1ywi s ASN 31 Cb -0.15 -2.31 0.66 0.00 -1.45 0.00 0.00 41.25 38.00 1ywi s ASN 31 CO 0.04 -0.89 1.46 1.07 -3.72 0.00 0.00 177.10 175.06 1ywi n THR 32 N 5.71 0.19 -0.01 -5.21 5.66 -0.54 -1.76 114.28 118.33 1ywi n THR 32 Ca -0.05 -0.25 -0.01 0.00 -3.05 0.00 0.00 64.05 60.69 1ywi n THR 32 Cb 0.46 0.14 -0.00 0.00 -1.55 0.00 0.00 70.33 69.38 1ywi n THR 32 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1ywi n GLU 33 N 0.01 0.09 0.13 1.09 2.13 -1.23 -4.45 120.64 118.41 1ywi n GLU 33 Ca 0.13 0.27 0.13 0.00 0.66 0.00 0.00 57.16 58.35 1ywi n GLU 33 Cb 0.22 -0.91 0.40 0.00 0.27 0.00 0.00 31.44 31.42 1ywi n GLU 33 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 1ywi h THR 34 N -0.20 0.00 -3.72 6.31 2.02 -1.91 -3.48 112.91 111.93 1ywi h THR 34 Ca 0.00 -0.52 0.00 0.00 0.77 0.00 0.00 66.41 66.66 1ywi h THR 34 Cb 0.11 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 1ywi h THR 34 CO 0.00 0.00 -0.01 0.29 0.37 0.00 0.00 175.52 176.17 1ywi n LYS 35 N -2.42 -0.43 -3.66 6.66 5.02 -0.84 -5.09 118.16 117.40 1ywi n LYS 35 Ca 0.05 0.82 -0.07 0.00 -2.02 0.00 0.00 58.31 57.09 1ywi n LYS 35 Cb 0.41 -2.80 -0.02 0.00 -0.02 0.00 0.00 35.03 32.60 1ywi n LYS 35 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1ywi s GLN 36 N -2.87 1.26 -0.11 1.97 -2.07 -0.72 -5.03 119.66 112.09 1ywi s GLN 36 Ca 0.01 -0.62 -0.05 0.00 -1.82 0.00 0.00 55.36 52.88 1ywi s GLN 36 Cb -0.00 0.48 -0.04 0.00 -1.09 0.00 0.00 33.01 32.36 1ywi s GLN 36 CO 0.23 -0.57 0.06 -1.12 -1.32 0.00 0.00 175.29 172.58 1ywi s SER 37 N -2.79 5.74 0.14 12.60 0.01 -1.26 -0.57 113.70 127.57 1ywi s SER 37 Ca 0.08 0.26 0.04 0.00 1.31 0.00 0.00 55.95 57.64 1ywi s SER 37 Cb -0.02 -1.78 -0.04 0.00 0.21 0.00 0.00 66.02 64.38 1ywi s SER 37 CO -0.02 0.36 -0.10 0.28 0.41 0.00 0.00 173.24 174.16 1ywi s THR 38 N -0.73 1.14 0.19 1.44 -1.32 -0.46 -4.95 115.64 110.95 1ywi s THR 38 Ca 0.12 -2.05 0.05 0.00 -1.21 0.00 0.00 61.69 58.60 1ywi s THR 38 Cb -0.12 -1.83 -0.04 0.00 -1.51 0.00 0.00 72.50 69.00 1ywi s THR 38 CO 0.03 -0.75 0.20 0.26 -2.21 0.00 0.00 174.62 172.14 1ywi s TRP 39 N -3.33 3.23 0.52 9.09 0.52 -1.26 -1.96 118.94 125.75 1ywi s TRP 39 Ca 0.16 -0.01 0.00 0.00 0.02 0.00 0.00 56.10 56.27 1ywi s TRP 39 Cb 0.03 -1.52 0.00 0.00 -1.15 0.00 0.00 33.47 30.82 1ywi s TRP 39 CO 0.00 0.51 0.00 -1.91 0.02 0.00 0.00 176.95 175.57 1ywi n GLU 40 N -0.68 -3.84 -1.57 4.98 2.13 -1.23 -4.81 120.64 115.62 1ywi n GLU 40 Ca -0.08 2.95 -0.46 0.00 0.66 0.00 0.00 57.16 60.22 1ywi n GLU 40 Cb 0.55 -3.59 -0.03 0.00 0.27 0.00 0.00 31.44 28.65 1ywi n GLU 40 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1ywi n LYS 41 N -2.12 1.20 0.00 5.31 5.02 -1.26 -4.68 118.16 121.63 1ywi n LYS 41 Ca 0.00 0.42 0.15 0.00 -2.02 0.00 0.00 58.31 56.86 1ywi n LYS 41 Cb 0.33 -1.82 0.87 0.00 -0.02 0.00 0.00 35.03 34.40 1ywi n LYS 41 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53