#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 -1.60 -4.30 4.33 2.81 -1.26 -4.74 117.12 112.36 1ywi n MET 16 Ca 0.00 0.43 -0.16 0.00 -1.81 0.00 0.00 57.70 56.16 1ywi n MET 16 Cb 0.00 -3.78 -0.10 0.00 -0.71 0.00 0.00 33.22 28.62 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 -3.19 1.45 0.02 2.03 0.52 -1.26 -1.21 118.94 117.29 1ywi s TRP 17 Ca 0.18 -0.79 0.02 0.00 0.02 0.00 0.00 56.10 55.53 1ywi s TRP 17 Cb -0.02 -0.77 -0.01 0.00 -1.15 0.00 0.00 33.47 31.52 1ywi s TRP 17 CO 0.37 0.08 -0.07 0.95 0.02 0.00 0.00 176.95 178.30 1ywi s THR 18 N -3.30 0.56 -0.24 2.01 -4.23 0.04 -4.92 115.64 105.55 1ywi s THR 18 Ca 0.22 -0.62 -0.08 0.00 -1.18 0.00 0.00 61.69 60.03 1ywi s THR 18 Cb 0.03 -0.53 -0.04 0.00 1.34 0.00 0.00 72.50 73.31 1ywi s THR 18 CO 0.04 -0.06 0.09 -0.70 -0.54 0.00 0.00 174.62 173.45 1ywi s GLU 19 N -0.74 3.78 0.13 3.99 -6.30 -1.26 -1.70 118.70 116.60 1ywi s GLU 19 Ca -0.02 -0.42 -0.03 0.00 -2.50 0.00 0.00 54.97 52.00 1ywi s GLU 19 Cb -0.06 -3.36 -0.03 0.00 0.00 0.00 0.00 34.13 30.68 1ywi s GLU 19 CO 0.00 -0.08 0.11 -1.01 0.02 0.00 0.00 175.26 174.30 1ywi s HIS 20 N 1.36 0.71 -0.22 5.30 3.76 -0.76 -5.03 115.29 120.40 1ywi s HIS 20 Ca 0.05 -1.09 -0.01 0.00 -0.15 0.00 0.00 55.06 53.86 1ywi s HIS 20 Cb -0.15 -0.36 0.02 0.00 1.11 0.00 0.00 32.58 33.20 1ywi s HIS 20 CO 0.04 -0.56 -0.11 0.15 -0.85 0.00 0.00 174.74 173.42 1ywi s LYS 21 N -4.02 2.95 0.43 1.40 1.02 -1.26 -0.81 119.74 119.46 1ywi s LYS 21 Ca 0.21 -0.89 -0.24 0.00 0.02 0.00 0.00 55.97 55.07 1ywi s LYS 21 Cb 0.06 -2.84 -0.10 0.00 -0.52 0.00 0.00 37.83 34.43 1ywi s LYS 21 CO 0.00 -0.31 1.02 0.45 -0.92 0.00 0.00 175.35 175.59 1ywi n SER 22 N 4.66 1.30 -0.36 2.83 2.88 0.43 -4.78 113.62 120.58 1ywi n SER 22 Ca -0.18 1.02 0.05 0.00 -1.33 0.00 0.00 58.87 58.43 1ywi n SER 22 Cb 0.48 -1.36 0.21 0.00 -0.75 0.00 0.00 64.21 62.79 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 1.50 1.03 0.00 -1.46 0.11 -1.99 0.67 132.00 131.86 1ywi h PRO 23 Ca -0.45 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1ywi h PRO 23 Cb 1.34 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1ywi h PRO 23 CO 0.57 0.68 0.00 0.22 -0.21 0.00 0.00 178.00 179.26 1ywi h ASP 24 N 1.06 0.00 0.00 -2.05 1.82 -2.06 -3.44 116.42 111.75 1ywi h ASP 24 Ca 0.47 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.11 1ywi h ASP 24 Cb 0.37 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.38 1ywi h ASP 24 CO -0.23 0.00 0.00 0.61 -1.61 0.00 0.00 179.24 178.01 1ywi n GLY 25 N -1.27 0.97 3.51 -0.78 0.00 0.17 -5.14 105.19 102.65 1ywi n GLY 25 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 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 0.06 1.73 -0.38 1.61 3.00 -0.86 -4.93 118.95 119.19 1ywi s ARG 26 Ca 0.00 -1.92 -0.04 0.00 0.00 0.00 0.00 55.73 53.78 1ywi s ARG 26 Cb 0.00 -1.41 0.08 0.00 0.00 0.00 0.00 34.95 33.62 1ywi s ARG 26 CO 0.00 0.03 0.15 0.99 0.00 0.00 0.00 175.30 176.48 1ywi s THR 27 N -2.84 3.41 0.35 0.02 2.01 -1.26 0.16 115.64 117.49 1ywi s THR 27 Ca 0.32 -1.70 0.08 0.00 0.31 0.00 0.00 61.69 60.71 1ywi s THR 27 Cb 0.05 -3.17 -0.04 0.00 0.01 0.00 0.00 72.50 69.36 1ywi s THR 27 CO 0.15 -0.47 0.19 -0.72 -0.69 0.00 0.00 174.62 173.08 1ywi s TYR 28 N 1.24 2.75 -0.02 4.92 1.13 0.01 -4.10 117.35 123.27 1ywi s TYR 28 Ca 0.03 -0.38 0.03 0.00 -1.41 0.00 0.00 57.07 55.34 1ywi s TYR 28 Cb -0.22 -1.72 -0.00 0.00 -1.10 0.00 0.00 41.96 38.92 1ywi s TYR 28 CO -0.02 0.27 -0.10 0.71 -2.51 0.00 0.00 175.55 173.90 1ywi s TYR 29 N -2.41 0.98 -0.18 -3.49 1.51 -0.85 -1.83 117.35 111.09 1ywi s TYR 29 Ca 0.39 -0.21 -0.05 0.00 -1.01 0.00 0.00 57.07 56.19 1ywi s TYR 29 Cb -0.03 -0.66 -0.03 0.00 -0.11 0.00 0.00 41.96 41.13 1ywi s TYR 29 CO 0.24 -0.05 -0.00 -0.47 -1.11 0.00 0.00 175.55 174.16 1ywi s TYR 30 N -0.08 3.07 -0.36 2.71 6.14 -0.69 -1.65 117.35 126.49 1ywi s TYR 30 Ca 0.01 -0.30 -0.18 0.00 0.64 0.00 0.00 57.07 57.24 1ywi s TYR 30 Cb -0.06 -2.04 -0.00 0.00 0.42 0.00 0.00 41.96 40.28 1ywi s TYR 30 CO -0.00 -0.09 0.52 1.21 0.64 0.00 0.00 175.55 177.82 1ywi s ASN 31 N 0.66 6.31 0.00 4.32 2.47 0.07 -0.78 114.94 127.99 1ywi s ASN 31 Ca -0.00 -0.08 0.29 0.00 0.42 0.00 0.00 52.86 53.49 1ywi s ASN 31 Cb -0.14 -2.27 1.29 0.00 -1.45 0.00 0.00 41.25 38.68 1ywi s ASN 31 CO 0.02 -0.50 1.90 1.07 -3.72 0.00 0.00 177.10 175.87 1ywi n THR 32 N 5.45 0.00 -0.03 -5.21 5.66 -0.35 -1.06 114.28 118.74 1ywi n THR 32 Ca -0.05 -0.05 -0.03 0.00 -3.05 0.00 0.00 64.05 60.88 1ywi n THR 32 Cb 0.49 -0.18 -0.02 0.00 -1.55 0.00 0.00 70.33 69.07 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 0.44 -0.04 0.00 1.09 4.57 -1.85 -3.35 114.58 115.44 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 0.34 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.94 1ywi h GLU 33 CO 0.00 0.13 -0.55 1.15 -1.18 0.00 0.00 179.01 178.56 1ywi h THR 34 N -1.01 0.00 -4.46 0.32 2.02 -1.90 -3.48 112.91 104.40 1ywi h THR 34 Ca -0.00 -0.51 -0.14 0.00 0.77 0.00 0.00 66.41 66.52 1ywi h THR 34 Cb 0.20 1.15 0.11 0.00 -1.74 0.00 0.00 68.15 67.87 1ywi h THR 34 CO 0.01 0.00 -0.49 0.29 0.37 0.00 0.00 175.52 175.70 1ywi n LYS 35 N -2.17 -1.32 -3.88 6.66 4.76 -0.22 -5.06 118.16 116.93 1ywi n LYS 35 Ca 0.03 0.54 -0.09 0.00 -2.87 0.00 0.00 58.31 55.92 1ywi n LYS 35 Cb 0.44 -4.09 -0.06 0.00 -1.84 0.00 0.00 35.03 29.49 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 -3.79 1.25 -0.08 1.97 -2.07 -0.65 -5.01 119.66 111.27 1ywi s GLN 36 Ca 0.26 -1.07 -0.00 0.00 -1.82 0.00 0.00 55.36 52.74 1ywi s GLN 36 Cb -0.03 0.43 -0.03 0.00 -1.09 0.00 0.00 33.01 32.29 1ywi s GLN 36 CO 0.44 -0.49 -0.05 -1.12 -1.32 0.00 0.00 175.29 172.75 1ywi s SER 37 N -2.94 4.78 0.09 12.60 0.01 -1.26 -0.75 113.70 126.23 1ywi s SER 37 Ca 0.14 0.01 -0.01 0.00 1.31 0.00 0.00 55.95 57.40 1ywi s SER 37 Cb 0.02 -1.28 -0.04 0.00 0.21 0.00 0.00 66.02 64.93 1ywi s SER 37 CO -0.01 0.35 0.02 0.28 0.41 0.00 0.00 173.24 174.30 1ywi s THR 38 N -0.74 0.16 0.20 1.44 -1.32 -0.66 -4.99 115.64 109.73 1ywi s THR 38 Ca 0.11 -1.83 0.05 0.00 -1.21 0.00 0.00 61.69 58.81 1ywi s THR 38 Cb -0.11 -1.77 -0.03 0.00 -1.51 0.00 0.00 72.50 69.07 1ywi s THR 38 CO 0.02 -0.72 0.24 0.26 -2.21 0.00 0.00 174.62 172.20 1ywi s TRP 39 N -3.98 3.29 0.42 9.09 0.52 -1.26 -2.00 118.94 125.02 1ywi s TRP 39 Ca 0.15 -0.00 0.00 0.00 0.02 0.00 0.00 56.10 56.27 1ywi s TRP 39 Cb 0.08 -1.54 0.00 0.00 -1.15 0.00 0.00 33.47 30.86 1ywi s TRP 39 CO -0.04 0.50 0.00 -1.91 0.02 0.00 0.00 176.95 175.52 1ywi n GLU 40 N -0.82 -4.08 -2.05 4.98 2.13 -1.26 -4.83 120.64 114.70 1ywi n GLU 40 Ca -0.08 3.01 -0.42 0.00 0.66 0.00 0.00 57.16 60.33 1ywi n GLU 40 Cb 0.56 -3.37 -0.03 0.00 0.27 0.00 0.00 31.44 28.87 1ywi n GLU 40 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1ywi s LYS 41 N -3.60 4.27 0.00 5.31 2.20 -1.26 -4.76 119.74 121.91 1ywi s LYS 41 Ca 0.00 2.22 0.27 0.00 -0.36 0.00 0.00 55.97 58.10 1ywi s LYS 41 Cb 0.00 -3.20 1.63 0.00 -1.51 0.00 0.00 37.83 34.75 1ywi s LYS 41 CO 0.00 -0.51 1.98 -0.35 -0.36 0.00 0.00 175.35 176.10