#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 -1.80 -3.93 1.43 0.00 -1.26 -4.85 117.12 106.71 1ywi n MET 16 Ca 0.00 0.42 -0.10 0.00 0.00 0.00 0.00 57.70 58.02 1ywi n MET 16 Cb 0.00 -3.79 -0.11 0.00 0.00 0.00 0.00 33.22 29.33 1ywi n MET 16 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 1ywi s TRP 17 N -3.19 0.15 0.10 2.03 0.52 -1.26 -1.87 118.94 115.42 1ywi s TRP 17 Ca 0.15 -0.33 0.10 0.00 0.02 0.00 0.00 56.10 56.04 1ywi s TRP 17 Cb -0.02 -0.12 -0.04 0.00 -1.15 0.00 0.00 33.47 32.14 1ywi s TRP 17 CO 0.36 -0.21 -0.25 0.95 0.02 0.00 0.00 176.95 177.82 1ywi s THR 18 N -1.30 2.34 -0.17 2.01 -4.23 -0.52 -4.96 115.64 108.81 1ywi s THR 18 Ca -0.14 -1.59 -0.07 0.00 -1.18 0.00 0.00 61.69 58.71 1ywi s THR 18 Cb -0.08 -2.01 -0.04 0.00 1.34 0.00 0.00 72.50 71.71 1ywi s THR 18 CO 0.00 0.18 0.05 -0.70 -0.54 0.00 0.00 174.62 173.62 1ywi s GLU 19 N -1.81 3.86 0.25 3.99 2.12 -1.26 -1.78 118.70 124.07 1ywi s GLU 19 Ca 0.14 -0.35 -0.10 0.00 0.36 0.00 0.00 54.97 55.02 1ywi s GLU 19 Cb -0.10 -3.16 -0.01 0.00 0.26 0.00 0.00 34.13 31.12 1ywi s GLU 19 CO 0.05 0.33 0.43 -1.01 -0.54 0.00 0.00 175.26 174.52 1ywi s HIS 20 N 0.21 0.53 -0.15 5.30 3.76 -0.45 -5.00 115.29 119.49 1ywi s HIS 20 Ca 0.04 -0.87 -0.00 0.00 -0.15 0.00 0.00 55.06 54.08 1ywi s HIS 20 Cb -0.12 0.06 0.03 0.00 1.11 0.00 0.00 32.58 33.66 1ywi s HIS 20 CO 0.01 -0.96 -0.09 0.15 -0.85 0.00 0.00 174.74 173.00 1ywi s LYS 21 N -3.95 1.78 0.37 1.40 1.02 -1.26 -1.01 119.74 118.09 1ywi s LYS 21 Ca 0.25 -0.47 -0.26 0.00 0.02 0.00 0.00 55.97 55.51 1ywi s LYS 21 Cb 0.00 -1.93 -0.12 0.00 -0.52 0.00 0.00 37.83 35.27 1ywi s LYS 21 CO 0.10 -0.32 1.12 0.45 -0.92 0.00 0.00 175.35 175.79 1ywi n SER 22 N 4.85 1.85 0.25 2.83 2.88 0.33 -4.80 113.62 121.81 1ywi n SER 22 Ca -0.14 1.12 0.16 0.00 -1.33 0.00 0.00 58.87 58.68 1ywi n SER 22 Cb 0.49 -1.40 0.87 0.00 -0.75 0.00 0.00 64.21 63.42 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 1.97 0.00 -0.49 -1.46 0.11 -2.00 0.51 132.00 130.64 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 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1ywi h PRO 23 CO 0.59 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.91 1ywi n ASP 24 N -2.64 1.52 -0.28 -2.05 2.03 -1.26 -4.83 116.55 109.04 1ywi n ASP 24 Ca -0.02 -2.10 -0.01 0.00 0.52 0.00 0.00 54.79 53.18 1ywi n ASP 24 Cb 0.09 -0.30 0.00 0.00 -0.72 0.00 0.00 41.12 40.18 1ywi n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ywi n GLY 25 N 0.53 0.46 3.65 0.27 0.00 0.12 -5.06 105.19 105.16 1ywi n GLY 25 Ca 0.07 -0.78 -0.25 0.00 0.00 0.00 0.00 46.02 45.06 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 -4.32 2.12 -0.33 1.61 0.52 -0.85 -4.94 118.95 112.76 1ywi s ARG 26 Ca 0.01 -1.75 -0.05 0.00 -0.52 0.00 0.00 55.73 53.42 1ywi s ARG 26 Cb -0.00 -1.95 0.04 0.00 0.52 0.00 0.00 34.95 33.56 1ywi s ARG 26 CO 0.01 0.10 0.07 0.99 0.02 0.00 0.00 175.30 176.49 1ywi s THR 27 N -2.53 3.54 0.31 0.02 2.01 -1.26 0.12 115.64 117.86 1ywi s THR 27 Ca 0.36 -1.20 0.10 0.00 0.31 0.00 0.00 61.69 61.26 1ywi s THR 27 Cb 0.01 -3.01 -0.06 0.00 0.01 0.00 0.00 72.50 69.45 1ywi s THR 27 CO 0.20 -0.15 -0.12 -0.72 -0.69 0.00 0.00 174.62 173.14 1ywi s TYR 28 N 1.36 2.40 0.09 4.92 1.13 -0.18 -3.96 117.35 123.11 1ywi s TYR 28 Ca -0.03 -0.40 0.05 0.00 -1.41 0.00 0.00 57.07 55.28 1ywi s TYR 28 Cb -0.20 -1.22 -0.03 0.00 -1.10 0.00 0.00 41.96 39.41 1ywi s TYR 28 CO 0.02 0.63 -0.13 0.71 -2.51 0.00 0.00 175.55 174.26 1ywi s TYR 29 N -2.53 1.24 -0.21 -3.49 1.51 -0.83 -1.34 117.35 111.69 1ywi s TYR 29 Ca 0.32 -0.53 -0.02 0.00 -1.01 0.00 0.00 57.07 55.83 1ywi s TYR 29 Cb -0.02 -0.67 0.01 0.00 -0.11 0.00 0.00 41.96 41.16 1ywi s TYR 29 CO 0.17 0.07 -0.09 -0.47 -1.11 0.00 0.00 175.55 174.12 1ywi s TYR 30 N -1.78 2.93 -0.17 2.71 6.14 -0.73 -1.68 117.35 124.76 1ywi s TYR 30 Ca 0.03 -1.24 -0.29 0.00 0.64 0.00 0.00 57.07 56.20 1ywi s TYR 30 Cb -0.07 -2.05 -0.00 0.00 0.42 0.00 0.00 41.96 40.26 1ywi s TYR 30 CO 0.02 -0.65 1.02 1.21 0.64 0.00 0.00 175.55 177.78 1ywi s ASN 31 N 1.40 7.17 0.01 4.32 2.47 0.80 -1.44 114.94 129.66 1ywi s ASN 31 Ca 0.05 1.45 0.23 0.00 0.42 0.00 0.00 52.86 55.00 1ywi s ASN 31 Cb -0.14 -2.55 0.11 0.00 -1.45 0.00 0.00 41.25 37.22 1ywi s ASN 31 CO -0.06 -0.55 1.12 1.07 -3.72 0.00 0.00 177.10 174.95 1ywi n THR 32 N 4.93 0.04 0.15 -5.21 5.66 -0.78 -1.52 114.28 117.55 1ywi n THR 32 Ca 0.10 -0.07 -0.07 0.00 -3.05 0.00 0.00 64.05 60.97 1ywi n THR 32 Cb 0.47 0.52 -0.03 0.00 -1.55 0.00 0.00 70.33 69.74 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 0.00 -0.45 0.00 1.09 4.57 -1.89 -3.34 114.58 114.56 1ywi h GLU 33 Ca 0.00 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1ywi h GLU 33 Cb 0.56 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.25 1ywi h GLU 33 CO 0.00 -0.30 -0.75 1.15 -1.18 0.00 0.00 179.01 177.93 1ywi h THR 34 N -1.09 0.00 -3.92 0.32 2.02 -1.91 -3.49 112.91 104.84 1ywi h THR 34 Ca -0.05 -0.75 -0.02 0.00 0.77 0.00 0.00 66.41 66.36 1ywi h THR 34 Cb 0.36 1.32 0.02 0.00 -1.74 0.00 0.00 68.15 68.10 1ywi h THR 34 CO 0.08 0.00 -0.08 0.29 0.37 0.00 0.00 175.52 176.17 1ywi n LYS 35 N -2.43 -0.60 -3.78 6.66 5.02 -0.91 -5.09 118.16 117.03 1ywi n LYS 35 Ca 0.02 0.75 -0.09 0.00 -2.02 0.00 0.00 58.31 56.96 1ywi n LYS 35 Cb 0.49 -3.16 -0.04 0.00 -0.02 0.00 0.00 35.03 32.31 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 -3.14 1.39 -0.10 1.97 -2.07 -0.57 -5.00 119.66 112.14 1ywi s GLN 36 Ca 0.05 -0.93 -0.04 0.00 -1.82 0.00 0.00 55.36 52.62 1ywi s GLN 36 Cb -0.01 0.51 -0.04 0.00 -1.09 0.00 0.00 33.01 32.39 1ywi s GLN 36 CO 0.29 -0.59 0.05 -1.12 -1.32 0.00 0.00 175.29 172.60 1ywi s SER 37 N -2.89 5.61 0.15 12.60 0.01 -1.26 -0.14 113.70 127.78 1ywi s SER 37 Ca 0.11 0.25 -0.06 0.00 1.31 0.00 0.00 55.95 57.56 1ywi s SER 37 Cb -0.01 -1.68 -0.02 0.00 0.21 0.00 0.00 66.02 64.52 1ywi s SER 37 CO -0.01 0.38 0.19 0.28 0.41 0.00 0.00 173.24 174.49 1ywi s THR 38 N -0.89 0.08 0.34 1.44 -1.32 -0.68 -4.96 115.64 109.65 1ywi s THR 38 Ca 0.13 -1.61 0.07 0.00 -1.21 0.00 0.00 61.69 59.07 1ywi s THR 38 Cb -0.12 -1.95 -0.02 0.00 -1.51 0.00 0.00 72.50 68.91 1ywi s THR 38 CO 0.03 -0.35 0.37 0.26 -2.21 0.00 0.00 174.62 172.72 1ywi s TRP 39 N -4.01 2.97 0.41 9.09 0.52 -1.26 -1.96 118.94 124.70 1ywi s TRP 39 Ca 0.21 -0.29 0.00 0.00 0.02 0.00 0.00 56.10 56.04 1ywi s TRP 39 Cb 0.05 -1.91 0.00 0.00 -1.15 0.00 0.00 33.47 30.46 1ywi s TRP 39 CO 0.01 0.07 0.00 -1.91 0.02 0.00 0.00 176.95 175.15 1ywi n GLU 40 N -1.50 -3.41 -1.66 4.98 2.13 -1.25 -4.82 120.64 115.11 1ywi n GLU 40 Ca -0.01 2.56 -0.47 0.00 0.66 0.00 0.00 57.16 59.91 1ywi n GLU 40 Cb 0.59 -2.96 -0.04 0.00 0.27 0.00 0.00 31.44 29.30 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 -1.26 2.00 0.00 5.31 5.02 -1.26 -4.72 118.16 123.25 1ywi n LYS 41 Ca 0.00 0.72 0.13 0.00 -2.02 0.00 0.00 58.31 57.14 1ywi n LYS 41 Cb 0.09 -2.47 0.25 0.00 -0.02 0.00 0.00 35.03 32.87 1ywi n LYS 41 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53