#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 -4.10 -1.46 2.81 -1.26 -5.05 117.12 111.09 1ywi n MET 16 Ca 0.00 -4.70 -0.10 0.00 -1.81 0.00 0.00 57.70 51.09 1ywi n MET 16 Cb 0.00 -2.18 -0.10 0.00 -0.71 0.00 0.00 33.22 30.22 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 -3.38 0.67 0.01 2.03 0.52 -1.26 -1.68 118.94 115.85 1ywi s TRP 17 Ca 0.48 -0.79 0.07 0.00 0.02 0.00 0.00 56.10 55.87 1ywi s TRP 17 Cb 0.30 -0.42 -0.03 0.00 -1.15 0.00 0.00 33.47 32.17 1ywi s TRP 17 CO -0.14 -0.19 -0.19 0.95 0.02 0.00 0.00 176.95 177.41 1ywi s THR 18 N -2.84 2.71 -0.22 2.01 -4.23 -0.16 -4.93 115.64 107.98 1ywi s THR 18 Ca 0.02 -1.08 -0.08 0.00 -1.18 0.00 0.00 61.69 59.37 1ywi s THR 18 Cb 0.00 -2.09 -0.04 0.00 1.34 0.00 0.00 72.50 71.71 1ywi s THR 18 CO -0.04 0.43 0.08 -0.70 -0.54 0.00 0.00 174.62 173.85 1ywi s GLU 19 N -1.14 3.83 0.19 3.99 2.12 -1.26 -1.82 118.70 124.61 1ywi s GLU 19 Ca 0.13 -0.40 -0.06 0.00 0.36 0.00 0.00 54.97 55.00 1ywi s GLU 19 Cb -0.10 -3.31 -0.02 0.00 0.26 0.00 0.00 34.13 30.96 1ywi s GLU 19 CO 0.03 0.03 0.24 -1.01 -0.54 0.00 0.00 175.26 174.01 1ywi s HIS 20 N 1.05 0.74 -0.24 5.30 3.76 -0.68 -5.04 115.29 120.17 1ywi s HIS 20 Ca 0.04 -1.05 0.00 0.00 -0.15 0.00 0.00 55.06 53.91 1ywi s HIS 20 Cb -0.14 -0.24 0.04 0.00 1.11 0.00 0.00 32.58 33.34 1ywi s HIS 20 CO 0.03 -0.73 -0.10 0.15 -0.85 0.00 0.00 174.74 173.25 1ywi s LYS 21 N -4.06 2.66 0.41 1.40 1.02 -1.26 -0.80 119.74 119.12 1ywi s LYS 21 Ca 0.27 -1.08 -0.24 0.00 0.02 0.00 0.00 55.97 54.95 1ywi s LYS 21 Cb 0.04 -2.88 -0.11 0.00 -0.52 0.00 0.00 37.83 34.36 1ywi s LYS 21 CO 0.07 -0.42 0.85 0.45 -0.92 0.00 0.00 175.35 175.38 1ywi n SER 22 N 4.59 0.52 0.25 2.83 2.88 0.51 -4.78 113.62 120.42 1ywi n SER 22 Ca -0.16 1.00 0.17 0.00 -1.33 0.00 0.00 58.87 58.54 1ywi n SER 22 Cb 0.46 -1.27 0.85 0.00 -0.75 0.00 0.00 64.21 63.50 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 1.28 0.00 -0.42 -1.46 0.11 -1.99 -0.39 132.00 129.13 1ywi h PRO 23 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1ywi h PRO 23 Cb 1.36 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.47 1ywi h PRO 23 CO 0.55 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.87 1ywi n ASP 24 N -2.70 1.49 -0.44 -2.05 2.03 -1.26 -4.84 116.55 108.78 1ywi n ASP 24 Ca -0.01 -2.08 -0.00 0.00 0.52 0.00 0.00 54.79 53.21 1ywi n ASP 24 Cb 0.11 -0.27 0.00 0.00 -0.72 0.00 0.00 41.12 40.24 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 0.62 0.86 3.49 0.27 0.00 -0.21 -5.07 105.19 105.16 1ywi n GLY 25 Ca 0.07 -0.71 -0.24 0.00 0.00 0.00 0.00 46.02 45.15 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 -4.86 1.71 -0.35 1.61 1.81 -0.90 -4.95 118.95 113.02 1ywi s ARG 26 Ca 0.00 -1.91 -0.04 0.00 -1.72 0.00 0.00 55.73 52.06 1ywi s ARG 26 Cb -0.00 -1.29 0.07 0.00 -0.45 0.00 0.00 34.95 33.27 1ywi s ARG 26 CO 0.00 -0.01 0.12 0.99 -0.68 0.00 0.00 175.30 175.72 1ywi s THR 27 N -2.94 3.47 0.34 0.02 2.01 -1.26 0.19 115.64 117.46 1ywi s THR 27 Ca 0.33 -1.48 0.08 0.00 0.31 0.00 0.00 61.69 60.93 1ywi s THR 27 Cb 0.06 -3.10 -0.04 0.00 0.01 0.00 0.00 72.50 69.43 1ywi s THR 27 CO 0.15 -0.33 0.16 -0.72 -0.69 0.00 0.00 174.62 173.19 1ywi s TYR 28 N 1.29 2.73 0.11 4.92 1.13 0.02 -4.23 117.35 123.33 1ywi s TYR 28 Ca 0.00 -0.37 0.04 0.00 -1.41 0.00 0.00 57.07 55.33 1ywi s TYR 28 Cb -0.21 -1.66 -0.04 0.00 -1.10 0.00 0.00 41.96 38.95 1ywi s TYR 28 CO -0.00 0.32 -0.11 0.71 -2.51 0.00 0.00 175.55 173.95 1ywi s TYR 29 N -2.41 1.20 -0.08 -3.49 1.51 -0.71 -1.69 117.35 111.68 1ywi s TYR 29 Ca 0.38 -0.65 0.02 0.00 -1.01 0.00 0.00 57.07 55.81 1ywi s TYR 29 Cb -0.03 -0.64 0.02 0.00 -0.11 0.00 0.00 41.96 41.20 1ywi s TYR 29 CO 0.23 0.06 -0.12 -0.47 -1.11 0.00 0.00 175.55 174.14 1ywi s TYR 30 N -2.53 1.59 -0.29 2.71 6.14 -0.75 -1.01 117.35 123.19 1ywi s TYR 30 Ca 0.09 -0.67 -0.29 0.00 0.64 0.00 0.00 57.07 56.84 1ywi s TYR 30 Cb -0.02 -1.19 0.01 0.00 0.42 0.00 0.00 41.96 41.19 1ywi s TYR 30 CO 0.01 -0.37 1.06 1.21 0.64 0.00 0.00 175.55 178.10 1ywi s ASN 31 N 0.95 6.98 0.24 4.32 3.84 0.45 -0.99 114.94 130.73 1ywi s ASN 31 Ca -0.09 1.14 0.21 0.00 0.21 0.00 0.00 52.86 54.34 1ywi s ASN 31 Cb -0.15 -2.54 0.06 0.00 -0.55 0.00 0.00 41.25 38.07 1ywi s ASN 31 CO 0.00 -0.82 1.17 0.00 -2.79 0.00 0.00 177.10 174.67 1ywi h THR 32 N 5.65 0.14 -0.00 -5.21 1.03 -1.61 -0.30 112.91 112.61 1ywi h THR 32 Ca -0.20 -1.24 -0.03 0.00 -0.01 0.00 0.00 66.41 64.92 1ywi h THR 32 Cb 1.06 1.77 0.00 0.00 -1.07 0.00 0.00 68.15 69.91 1ywi h THR 32 CO 1.02 0.08 -0.12 -0.08 -0.01 0.00 0.00 175.52 176.41 1ywi h GLU 33 N 0.00 0.09 0.00 0.00 4.57 -1.91 -3.32 114.58 114.01 1ywi h GLU 33 Ca -0.03 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 1ywi h GLU 33 Cb 1.12 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.73 1ywi h GLU 33 CO 0.01 0.84 -0.89 1.15 -1.18 0.00 0.00 179.01 178.94 1ywi h THR 34 N -0.63 0.00 -4.45 0.32 2.02 -1.90 -3.49 112.91 104.79 1ywi h THR 34 Ca -0.01 -0.99 -0.06 0.00 0.77 0.00 0.00 66.41 66.12 1ywi h THR 34 Cb 0.88 1.54 0.04 0.00 -1.74 0.00 0.00 68.15 68.87 1ywi h THR 34 CO 0.02 0.00 -0.19 0.29 0.37 0.00 0.00 175.52 176.01 1ywi n LYS 35 N -2.71 -1.00 -3.84 6.66 5.02 -0.22 -5.07 118.16 117.00 1ywi n LYS 35 Ca 0.00 0.89 -0.09 0.00 -2.02 0.00 0.00 58.31 57.09 1ywi n LYS 35 Cb 0.54 -4.09 -0.05 0.00 -0.02 0.00 0.00 35.03 31.42 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 -3.31 1.36 -0.14 1.97 -2.07 -0.61 -5.00 119.66 111.86 1ywi s GLN 36 Ca 0.10 -1.00 -0.06 0.00 -1.82 0.00 0.00 55.36 52.58 1ywi s GLN 36 Cb -0.01 0.48 -0.04 0.00 -1.09 0.00 0.00 33.01 32.35 1ywi s GLN 36 CO 0.45 -0.56 0.06 -1.12 -1.32 0.00 0.00 175.29 172.80 1ywi s SER 37 N -2.92 5.63 0.08 12.60 0.01 -1.26 -0.41 113.70 127.43 1ywi s SER 37 Ca 0.13 0.16 0.02 0.00 1.31 0.00 0.00 55.95 57.58 1ywi s SER 37 Cb 0.00 -1.84 -0.03 0.00 0.21 0.00 0.00 66.02 64.35 1ywi s SER 37 CO -0.00 0.28 -0.08 0.28 0.41 0.00 0.00 173.24 174.13 1ywi s THR 38 N -0.24 0.68 0.30 1.44 -1.32 -0.18 -4.95 115.64 111.37 1ywi s THR 38 Ca 0.08 -1.57 0.07 0.00 -1.21 0.00 0.00 61.69 59.06 1ywi s THR 38 Cb -0.12 -1.23 -0.03 0.00 -1.51 0.00 0.00 72.50 69.61 1ywi s THR 38 CO 0.02 -0.63 0.30 0.26 -2.21 0.00 0.00 174.62 172.35 1ywi s TRP 39 N -2.58 3.05 0.42 9.09 0.52 -1.26 -1.74 118.94 126.44 1ywi s TRP 39 Ca 0.03 -0.21 0.00 0.00 0.02 0.00 0.00 56.10 55.94 1ywi s TRP 39 Cb -0.02 -1.69 0.00 0.00 -1.15 0.00 0.00 33.47 30.61 1ywi s TRP 39 CO -0.02 0.28 0.00 -1.91 0.02 0.00 0.00 176.95 175.32 1ywi n GLU 40 N -1.36 -4.08 -2.11 4.98 2.13 -1.26 -4.86 120.64 114.08 1ywi n GLU 40 Ca -0.04 3.01 -0.41 0.00 0.66 0.00 0.00 57.16 60.38 1ywi n GLU 40 Cb 0.59 -3.37 -0.03 0.00 0.27 0.00 0.00 31.44 28.90 1ywi n GLU 40 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 1ywi s LYS 41 N -3.59 4.33 0.00 5.31 -2.85 -1.26 -4.75 119.74 116.92 1ywi s LYS 41 Ca 0.00 2.19 0.29 0.00 -1.00 0.00 0.00 55.97 57.45 1ywi s LYS 41 Cb 0.00 -3.14 1.72 0.00 -2.06 0.00 0.00 37.83 34.35 1ywi s LYS 41 CO 0.00 -0.32 2.06 -0.35 0.10 0.00 0.00 175.35 176.84